#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 1.67 -0.20 7.83 0.23 -1.08 -3.33 115.26 120.39 1i01 n ASN 2 Ca 0.00 -2.06 0.02 0.00 -0.53 0.00 0.00 54.58 52.01 1i01 n ASN 2 Cb 0.00 -0.25 0.04 0.00 -2.08 0.00 0.00 39.78 37.50 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 0.29 0.12 -1.67 -2.53 3.01 0.07 -4.89 117.46 111.85 1i01 n PHE 3 Ca 0.09 -0.38 -0.46 0.00 1.01 0.00 0.00 57.45 57.71 1i01 n PHE 3 Cb 0.29 -0.03 -0.04 0.00 -0.01 0.00 0.00 39.48 39.69 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 -0.07 2.15 -0.15 -1.08 2.13 -1.21 -1.31 120.64 121.10 1i01 n GLU 4 Ca 0.03 0.77 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1i01 n GLU 4 Cb 0.26 -2.54 0.00 0.00 0.27 0.00 0.00 31.44 29.43 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 3.36 1.19 3.91 8.31 0.00 -1.26 -4.99 105.19 115.71 1i01 n GLY 5 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.53 3.43 -0.15 1.61 -0.14 -0.43 -5.01 119.74 118.52 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 -3.08 -0.01 0.00 -1.68 0.00 0.00 37.83 33.06 1i01 s LYS 6 CO 0.00 0.66 -0.11 0.42 -0.76 0.00 0.00 175.35 175.55 1i01 s ILE 7 N -1.37 3.10 -0.07 2.17 1.01 -1.26 -1.42 121.20 123.35 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 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 40.01 1i01 s ILE 7 CO 0.21 0.51 -0.24 0.00 0.00 0.00 0.00 174.94 175.42 1i01 s ALA 8 N 0.58 2.20 -0.27 9.38 0.00 -0.37 -0.73 121.76 132.55 1i01 s ALA 8 Ca -0.07 -1.02 -0.06 0.00 0.00 0.00 0.00 51.96 50.81 1i01 s ALA 8 Cb -0.15 -0.75 -0.00 0.00 0.00 0.00 0.00 23.12 22.22 1i01 s ALA 8 CO 0.03 0.38 0.06 -1.17 0.00 0.00 0.00 175.76 175.06 1i01 s LEU 9 N -0.01 3.62 -0.25 0.00 2.96 0.69 -0.73 118.68 124.96 1i01 s LEU 9 Ca -0.08 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.28 1i01 s LEU 9 Cb -0.15 -1.87 0.04 0.00 0.50 0.00 0.00 46.19 44.71 1i01 s LEU 9 CO 0.05 -0.13 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.18 1i01 s VAL 10 N 1.52 2.57 0.33 1.68 1.01 -0.05 -0.95 120.40 126.51 1i01 s VAL 10 Ca 0.04 -1.25 -0.19 0.00 0.00 0.00 0.00 61.98 60.58 1i01 s VAL 10 Cb -0.16 -2.36 -0.09 0.00 0.00 0.00 0.00 36.38 33.76 1i01 s VAL 10 CO 0.02 0.13 0.82 0.42 0.00 0.00 0.00 175.10 176.49 1i01 s THR 11 N 1.24 4.51 -1.11 3.92 -4.23 -0.77 -1.25 115.64 117.95 1i01 s THR 11 Ca -0.03 1.29 -0.02 0.00 -1.18 0.00 0.00 61.69 61.75 1i01 s THR 11 Cb -0.18 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 69.95 1i01 s THR 11 CO -0.05 -0.09 0.94 0.61 -0.54 0.00 0.00 174.62 175.48 1i01 n GLY 12 N -0.08 -0.31 1.07 3.99 0.00 -0.94 -3.40 105.19 105.52 1i01 n GLY 12 Ca 0.03 0.07 0.05 0.00 0.00 0.00 0.00 46.02 46.17 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 -4.08 2.91 0.23 4.61 0.00 -0.74 -4.14 120.51 119.31 1i01 n ALA 13 Ca -0.18 -0.94 -0.15 0.00 0.00 0.00 0.00 53.44 52.18 1i01 n ALA 13 Cb 0.62 -1.03 -0.08 0.00 0.00 0.00 0.00 19.45 18.96 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 2.37 -0.47 -4.27 0.00 0.02 -1.90 -3.27 113.55 106.03 1i01 h SER 14 Ca 0.00 -0.06 -0.38 0.00 -0.84 0.00 0.00 61.79 60.51 1i01 h SER 14 Cb 1.00 0.12 -0.10 0.00 0.14 0.00 0.00 62.40 63.56 1i01 h SER 14 CO 0.16 -0.23 -0.37 -2.11 -1.14 0.00 0.00 176.83 173.14 1i01 n ARG 15 N -5.27 0.34 0.00 3.45 1.85 -1.26 -4.76 116.66 111.00 1i01 n ARG 15 Ca -0.11 -2.65 0.00 0.00 -1.00 0.00 0.00 57.85 54.09 1i01 n ARG 15 Cb 0.27 2.15 0.00 0.00 -1.05 0.00 0.00 32.46 33.83 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 -0.49 2.29 0.22 2.89 0.00 -1.26 -2.56 105.19 106.27 1i01 n GLY 16 Ca 0.06 -0.18 -0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 0.55 -0.44 -0.61 2.04 -1.93 -1.36 117.51 115.76 1i01 h ILE 17 Ca 0.00 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 65.88 1i01 h ILE 17 Cb 0.00 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.44 1i01 h ILE 17 CO 0.00 0.02 0.13 1.23 0.00 0.00 0.00 178.15 179.53 1i01 h GLY 18 N 0.13 0.56 1.36 5.37 0.00 -1.67 -0.54 103.07 108.28 1i01 h GLY 18 Ca 0.29 -0.06 -0.13 0.00 0.00 0.00 0.00 47.33 47.43 1i01 h GLY 18 CO -0.48 -0.01 -0.31 -0.09 0.00 0.00 0.00 176.54 175.66 1i01 h ARG 19 N 0.28 0.72 -0.70 4.80 2.43 -1.13 -1.56 114.38 119.22 1i01 h ARG 19 Ca 0.21 -0.33 -0.05 0.00 -0.81 0.00 0.00 59.98 59.01 1i01 h ARG 19 Cb 0.24 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 1i01 h ARG 19 CO -0.24 0.93 0.24 0.00 -1.51 0.00 0.00 179.97 179.39 1i01 h ALA 20 N 1.04 1.11 -0.27 2.80 0.00 -0.82 0.63 119.26 123.75 1i01 h ALA 20 Ca 0.07 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1i01 h ALA 20 Cb 0.83 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1i01 h ALA 20 CO 0.07 0.62 -0.05 0.82 0.00 0.00 0.00 179.25 180.71 1i01 h ILE 21 N 1.02 1.28 -0.51 0.00 2.04 -0.92 -1.16 117.51 119.26 1i01 h ILE 21 Ca 0.23 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.01 1i01 h ILE 21 Cb 0.25 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 1i01 h ILE 21 CO -0.01 0.33 0.20 0.00 0.00 0.00 0.00 178.15 178.66 1i01 h ALA 22 N 0.78 0.67 -0.25 1.87 0.00 -0.92 -1.62 119.26 119.79 1i01 h ALA 22 Ca 0.07 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1i01 h ALA 22 Cb 0.51 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1i01 h ALA 22 CO 0.02 0.29 -0.34 0.93 0.00 0.00 0.00 179.25 180.16 1i01 h GLU 23 N 0.69 0.55 -0.15 0.00 5.08 -0.85 -2.03 114.58 117.88 1i01 h GLU 23 Ca 0.17 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1i01 h GLU 23 Cb 0.21 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 1i01 h GLU 23 CO -0.01 0.81 -0.06 1.15 -1.00 0.00 0.00 179.01 179.90 1i01 h THR 24 N 0.46 1.30 -0.58 1.13 2.02 -1.03 0.69 112.91 116.90 1i01 h THR 24 Ca 0.05 -1.06 -0.05 0.00 0.77 0.00 0.00 66.41 66.13 1i01 h THR 24 Cb 0.81 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.89 1i01 h THR 24 CO 0.07 0.31 0.18 -0.07 0.37 0.00 0.00 175.52 176.37 1i01 h LEU 25 N -0.03 0.81 -0.40 2.58 3.38 -1.29 -2.10 115.31 118.27 1i01 h LEU 25 Ca 0.03 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 1i01 h LEU 25 Cb 0.51 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1i01 h LEU 25 CO 0.02 0.77 -0.16 0.00 0.09 0.00 0.00 178.44 179.16 1i01 h ALA 26 N 1.34 0.56 0.00 1.53 0.00 -1.25 -1.34 119.26 120.10 1i01 h ALA 26 Ca 0.19 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1i01 h ALA 26 Cb 0.25 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1i01 h ALA 26 CO -0.01 0.49 -0.03 0.00 0.00 0.00 0.00 179.25 179.71 1i01 h ALA 27 N 0.82 1.06 -0.60 0.00 0.00 -0.52 -1.95 119.26 118.08 1i01 h ALA 27 Ca 0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1i01 h ALA 27 Cb 0.71 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.43 1i01 h ALA 27 CO 0.05 0.03 0.13 0.54 0.00 0.00 0.00 179.25 180.01 1i01 n ARG 28 N -3.21 3.89 -0.30 0.00 1.74 -0.82 -4.80 116.66 113.15 1i01 n ARG 28 Ca -0.01 -3.09 0.00 0.00 -0.77 0.00 0.00 57.85 53.98 1i01 n ARG 28 Cb 0.20 -2.16 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 -0.02 0.72 3.87 -0.13 0.00 -0.73 -0.75 105.19 108.14 1i01 n GLY 29 Ca 0.34 0.00 -0.31 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 -2.64 3.23 -0.36 4.61 0.00 -0.54 -3.29 121.76 122.77 1i01 s ALA 30 Ca 0.00 -0.11 -0.18 0.00 0.00 0.00 0.00 51.96 51.68 1i01 s ALA 30 Cb 0.00 -2.87 -0.00 0.00 0.00 0.00 0.00 23.12 20.25 1i01 s ALA 30 CO 0.00 -0.22 0.48 0.15 0.00 0.00 0.00 175.76 176.17 1i01 s LYS 31 N -4.23 3.54 -0.13 0.00 -0.14 -0.51 -4.36 119.74 113.91 1i01 s LYS 31 Ca 0.54 -0.28 -0.05 0.00 -1.36 0.00 0.00 55.97 54.82 1i01 s LYS 31 Cb -0.10 -3.83 -0.04 0.00 -1.68 0.00 0.00 37.83 32.18 1i01 s LYS 31 CO 0.36 -0.66 0.05 0.08 -0.76 0.00 0.00 175.35 174.42 1i01 s VAL 32 N 2.32 4.68 -0.29 3.17 1.01 -0.30 -1.23 120.40 129.76 1i01 s VAL 32 Ca 0.17 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.07 1i01 s VAL 32 Cb -0.16 -3.04 0.06 0.00 0.00 0.00 0.00 36.38 33.24 1i01 s VAL 32 CO 0.13 0.54 -0.04 -0.63 0.00 0.00 0.00 175.10 175.11 1i01 s ILE 33 N -0.34 2.52 0.00 2.22 1.09 0.10 -1.11 121.20 125.67 1i01 s ILE 33 Ca 0.08 -1.66 -0.02 0.00 -1.10 0.00 0.00 60.65 57.95 1i01 s ILE 33 Cb -0.12 -2.53 -0.04 0.00 -1.06 0.00 0.00 42.46 38.71 1i01 s ILE 33 CO 0.02 -0.16 0.19 -0.83 -0.10 0.00 0.00 174.94 174.06 1i01 s GLY 34 N 1.17 2.18 0.28 6.18 0.00 -0.69 -0.87 107.32 115.57 1i01 s GLY 34 Ca -0.04 -0.77 0.12 0.00 0.00 0.00 0.00 44.72 44.02 1i01 s GLY 34 CO -0.04 -0.67 -0.18 -0.51 0.00 0.00 0.00 173.10 171.70 1i01 s THR 35 N -1.35 2.56 0.13 0.90 -4.23 -0.38 -1.36 115.64 111.91 1i01 s THR 35 Ca 0.28 -2.36 -0.05 0.00 -1.18 0.00 0.00 61.69 58.38 1i01 s THR 35 Cb -0.13 -2.34 -0.02 0.00 1.34 0.00 0.00 72.50 71.34 1i01 s THR 35 CO 0.20 -0.39 0.15 0.00 -0.54 0.00 0.00 174.62 174.03 1i01 s ALA 36 N -2.48 0.39 -0.79 3.99 0.00 -0.96 -1.78 121.76 120.12 1i01 s ALA 36 Ca 0.30 -1.13 0.26 0.00 0.00 0.00 0.00 51.96 51.38 1i01 s ALA 36 Cb -0.05 0.77 0.69 0.00 0.00 0.00 0.00 23.12 24.52 1i01 s ALA 36 CO 0.15 -0.54 1.60 0.25 0.00 0.00 0.00 175.76 177.23 1i01 n THR 37 N -0.12 0.33 -4.50 0.00 -2.24 -1.26 -0.81 114.28 105.68 1i01 n THR 37 Ca -0.08 -0.19 -0.26 0.00 -2.27 0.00 0.00 64.05 61.25 1i01 n THR 37 Cb 0.63 -0.30 -0.10 0.00 -2.10 0.00 0.00 70.33 68.46 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 -3.95 3.86 0.08 3.42 1.04 -1.26 -4.74 113.70 112.16 1i01 s SER 38 Ca 0.10 -1.17 -0.14 0.00 0.48 0.00 0.00 55.95 55.22 1i01 s SER 38 Cb 0.15 -0.40 -0.16 0.00 0.10 0.00 0.00 66.02 65.71 1i01 s SER 38 CO 0.64 -0.24 1.28 -0.08 0.98 0.00 0.00 173.24 175.82 1i01 h GLU 39 N 1.94 0.72 -0.23 4.02 4.57 -1.98 -2.80 114.58 120.82 1i01 h GLU 39 Ca -0.42 -0.59 -0.06 0.00 -1.18 0.00 0.00 59.36 57.12 1i01 h GLU 39 Cb 1.25 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.95 1i01 h GLU 39 CO 0.71 1.20 -0.10 -0.91 -1.18 0.00 0.00 179.01 178.72 1i01 h ASN 40 N 0.42 0.35 -0.65 1.04 -0.26 -1.99 -2.51 115.58 111.98 1i01 h ASN 40 Ca -0.05 -0.08 -0.09 0.00 -0.56 0.00 0.00 56.30 55.53 1i01 h ASN 40 Cb 1.33 -0.09 -0.02 0.00 -1.06 0.00 0.00 38.32 38.47 1i01 h ASN 40 CO 0.14 0.49 0.06 1.23 -1.06 0.00 0.00 177.43 178.30 1i01 h GLY 41 N 0.82 1.19 1.29 2.83 0.00 -1.94 -2.63 103.07 104.64 1i01 h GLY 41 Ca 0.07 -0.83 -0.07 0.00 0.00 0.00 0.00 47.33 46.50 1i01 h GLY 41 CO 0.02 0.77 0.03 0.00 0.00 0.00 0.00 176.54 177.36 1i01 h ALA 42 N 1.03 1.07 -0.16 3.60 0.00 -1.22 -2.68 119.26 120.89 1i01 h ALA 42 Ca 0.19 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1i01 h ALA 42 Cb 0.50 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1i01 h ALA 42 CO 0.02 0.59 -0.37 1.96 0.00 0.00 0.00 179.25 181.45 1i01 h GLN 43 N 0.81 0.34 -0.48 0.00 4.20 -1.25 -0.76 115.11 117.97 1i01 h GLN 43 Ca 0.16 -0.15 -0.09 0.00 0.06 0.00 0.00 58.65 58.63 1i01 h GLN 43 Cb 0.44 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1i01 h GLN 43 CO 0.02 0.67 -0.06 0.00 -0.67 0.00 0.00 178.83 178.78 1i01 h ALA 44 N 1.32 0.98 -0.51 3.87 0.00 -1.25 -0.57 119.26 123.11 1i01 h ALA 44 Ca 0.03 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.54 1i01 h ALA 44 Cb 0.79 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1i01 h ALA 44 CO 0.06 0.61 -0.06 0.82 0.00 0.00 0.00 179.25 180.69 1i01 h ILE 45 N 0.77 1.27 -0.38 0.00 2.04 -1.12 -2.52 117.51 117.56 1i01 h ILE 45 Ca 0.14 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 1i01 h ILE 45 Cb 0.56 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 1i01 h ILE 45 CO 0.03 0.41 0.17 0.28 0.00 0.00 0.00 178.15 179.05 1i01 h SER 46 N 0.80 0.47 -0.21 1.72 0.02 -0.70 -1.37 113.55 114.28 1i01 h SER 46 Ca 0.14 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 60.96 1i01 h SER 46 Cb 0.60 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 1i01 h SER 46 CO 0.04 0.41 -0.24 -0.78 -1.14 0.00 0.00 176.83 175.12 1i01 h ASP 47 N 0.53 0.57 1.73 3.07 1.82 -0.70 -2.66 116.42 120.78 1i01 h ASP 47 Ca 0.13 -0.49 -0.01 0.00 -0.39 0.00 0.00 57.03 56.27 1i01 h ASP 47 Cb 0.07 -0.16 -0.00 0.00 0.68 0.00 0.00 39.33 39.92 1i01 h ASP 47 CO -0.02 0.95 -0.07 0.10 -1.61 0.00 0.00 179.24 178.59 1i01 h TYR 48 N 0.21 0.00 0.00 0.28 -0.00 -1.17 -3.08 116.97 113.21 1i01 h TYR 48 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.67 1i01 h TYR 48 Cb 0.79 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.51 1i01 h TYR 48 CO 0.08 0.07 -0.49 -0.07 -0.00 0.00 0.00 178.16 177.75 1i01 h LEU 49 N 0.00 0.00 0.00 0.10 3.38 -1.28 -3.48 115.31 114.02 1i01 h LEU 49 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i01 h LEU 49 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1i01 h LEU 49 CO 0.01 0.40 0.00 0.61 0.09 0.00 0.00 178.44 179.55 1i01 n GLY 50 N 1.21 3.52 0.09 0.83 0.00 -1.00 -1.32 105.19 108.51 1i01 n GLY 50 Ca 0.01 0.04 0.15 0.00 0.00 0.00 0.00 46.02 46.22 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 11.26 2.67 1.06 4.61 0.00 -1.26 -3.71 120.51 135.14 1i01 n ALA 51 Ca 0.00 -0.23 0.11 0.00 0.00 0.00 0.00 53.44 53.32 1i01 n ALA 51 Cb 0.00 -1.40 0.34 0.00 0.00 0.00 0.00 19.45 18.39 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 -0.99 2.06 0.00 0.00 3.02 -0.43 -5.02 115.26 113.90 1i01 n ASN 52 Ca 0.16 -1.76 0.00 0.00 -0.03 0.00 0.00 54.58 52.95 1i01 n ASN 52 Cb 0.24 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 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 1.22 -0.63 3.48 7.41 0.00 -1.24 -1.15 105.19 114.28 1i01 n GLY 53 Ca 0.17 -0.59 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.63 1.08 -0.09 1.61 2.20 -0.27 -4.68 119.74 118.95 1i01 s LYS 54 Ca 0.00 -0.13 -0.01 0.00 -0.36 0.00 0.00 55.97 55.46 1i01 s LYS 54 Cb 0.00 0.50 -0.03 0.00 -1.51 0.00 0.00 37.83 36.79 1i01 s LYS 54 CO 0.00 -0.42 -0.03 0.20 -0.36 0.00 0.00 175.35 174.75 1i01 s GLY 55 N -2.01 1.78 0.05 5.54 0.00 -1.25 -1.70 107.32 109.73 1i01 s GLY 55 Ca -0.03 -0.83 0.04 0.00 0.00 0.00 0.00 44.72 43.90 1i01 s GLY 55 CO -0.03 -0.49 -0.12 1.08 0.00 0.00 0.00 173.10 173.54 1i01 s LEU 56 N -0.61 2.23 0.08 0.66 1.43 -0.46 -4.68 118.68 117.33 1i01 s LEU 56 Ca 0.10 -0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 52.38 1i01 s LEU 56 Cb -0.12 -0.42 -0.05 0.00 0.03 0.00 0.00 46.19 45.64 1i01 s LEU 56 CO 0.02 -0.08 0.95 -0.32 0.23 0.00 0.00 176.35 177.15 1i01 s MET 57 N -1.44 4.66 -0.04 1.70 -2.45 -1.26 -2.27 119.30 118.19 1i01 s MET 57 Ca -0.03 1.42 -0.03 0.00 -1.25 0.00 0.00 55.69 55.79 1i01 s MET 57 Cb -0.09 -3.39 0.02 0.00 1.25 0.00 0.00 34.83 32.61 1i01 s MET 57 CO 0.01 0.17 0.11 -1.17 1.05 0.00 0.00 175.02 175.19 1i01 s LEU 58 N 0.19 1.41 -0.34 4.11 2.96 0.01 -4.87 118.68 122.15 1i01 s LEU 58 Ca 0.47 0.22 0.03 0.00 -0.22 0.00 0.00 54.13 54.64 1i01 s LEU 58 Cb -0.23 0.34 0.10 0.00 0.50 0.00 0.00 46.19 46.91 1i01 s LEU 58 CO 0.29 -0.06 0.06 0.21 -1.32 0.00 0.00 176.35 175.53 1i01 s ASN 59 N 0.30 4.66 0.66 3.68 3.84 -1.26 -4.14 114.94 122.67 1i01 s ASN 59 Ca -0.02 -2.09 0.40 0.00 0.21 0.00 0.00 52.86 51.36 1i01 s ASN 59 Cb -0.03 -1.52 2.21 0.00 -0.55 0.00 0.00 41.25 41.36 1i01 s ASN 59 CO -0.01 -0.38 2.28 -0.37 -2.79 0.00 0.00 177.10 175.83 1i01 h VAL 60 N 6.58 0.08 0.00 -5.21 -1.51 -1.97 -0.78 116.25 113.44 1i01 h VAL 60 Ca -0.05 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 65.37 1i01 h VAL 60 Cb 1.02 0.94 -0.01 0.00 -2.13 0.00 0.00 31.29 31.11 1i01 h VAL 60 CO 0.51 0.00 -0.22 0.74 -1.23 0.00 0.00 177.57 177.38 1i01 h THR 61 N 0.00 0.48 -3.51 7.19 2.02 -1.94 -3.42 112.91 113.73 1i01 h THR 61 Ca 0.01 -1.21 -0.72 0.00 0.77 0.00 0.00 66.41 65.26 1i01 h THR 61 Cb 0.13 1.86 -0.22 0.00 -1.74 0.00 0.00 68.15 68.18 1i01 h THR 61 CO -0.00 0.21 -0.45 -0.62 0.37 0.00 0.00 175.52 175.04 1i01 s ASP 62 N -6.18 6.00 0.63 4.18 -1.08 -0.30 -4.95 116.67 114.97 1i01 s ASP 62 Ca 0.02 -0.97 0.41 0.00 -0.52 0.00 0.00 52.55 51.49 1i01 s ASP 62 Cb 0.09 -2.12 2.10 0.00 -1.46 0.00 0.00 42.92 41.53 1i01 s ASP 62 CO 0.65 -0.45 2.25 -0.65 0.52 0.00 0.00 175.17 177.49 1i01 h PRO 63 N 8.58 0.00 0.00 4.34 0.11 -1.82 -1.10 132.00 142.11 1i01 h PRO 63 Ca -0.27 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.67 1i01 h PRO 63 Cb 1.11 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1i01 h PRO 63 CO 0.72 0.00 -0.84 0.00 -0.21 0.00 0.00 178.00 177.67 1i01 h ALA 64 N 2.00 0.60 -0.16 -0.75 0.00 -1.92 -2.94 119.26 116.09 1i01 h ALA 64 Ca 0.00 -0.76 -0.19 0.00 0.00 0.00 0.00 54.91 53.97 1i01 h ALA 64 Cb 0.16 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1i01 h ALA 64 CO 0.00 1.02 -0.63 1.03 0.00 0.00 0.00 179.25 180.67 1i01 h SER 65 N 0.02 0.84 0.18 0.00 0.87 -1.48 -2.50 113.55 111.47 1i01 h SER 65 Ca -0.01 -0.61 -0.00 0.00 -1.23 0.00 0.00 61.79 59.93 1i01 h SER 65 Cb 1.49 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 1i01 h SER 65 CO 0.11 1.31 -0.13 0.40 -0.53 0.00 0.00 176.83 177.99 1i01 h ILE 66 N 0.42 0.71 -0.18 2.23 2.04 -1.42 0.03 117.51 121.34 1i01 h ILE 66 Ca -0.03 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 1i01 h ILE 66 Cb 1.26 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 1i01 h ILE 66 CO 0.13 0.00 -0.25 1.05 0.00 0.00 0.00 178.15 179.09 1i01 h GLU 67 N -0.32 0.33 -0.28 2.37 -0.00 -1.60 -1.03 114.58 114.06 1i01 h GLU 67 Ca -0.01 -0.11 -0.01 0.00 -0.00 0.00 0.00 59.36 59.23 1i01 h GLU 67 Cb 0.28 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 28.99 1i01 h GLU 67 CO -0.00 0.56 0.15 1.03 -0.00 0.00 0.00 179.01 180.75 1i01 h SER 68 N 0.30 0.35 -0.30 3.06 0.87 -1.02 -0.29 113.55 116.52 1i01 h SER 68 Ca 0.05 -0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 1i01 h SER 68 Cb 0.60 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.46 1i01 h SER 68 CO 0.04 0.34 0.05 0.58 -0.53 0.00 0.00 176.83 177.32 1i01 h VAL 69 N 0.34 1.23 -0.06 2.23 2.07 -0.68 -2.04 116.25 119.35 1i01 h VAL 69 Ca 0.10 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 1i01 h VAL 69 Cb 0.07 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1i01 h VAL 69 CO -0.02 0.26 -0.04 -0.07 0.02 0.00 0.00 177.57 177.72 1i01 h LEU 70 N 0.32 0.08 -0.20 2.57 3.38 -1.04 -1.20 115.31 119.21 1i01 h LEU 70 Ca 0.09 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 1i01 h LEU 70 Cb 0.34 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1i01 h LEU 70 CO 0.01 0.14 -0.40 -0.08 0.09 0.00 0.00 178.44 178.19 1i01 h GLU 71 N 0.08 0.63 -0.60 1.13 4.57 -0.72 -1.56 114.58 118.11 1i01 h GLU 71 Ca 0.02 -0.41 -0.01 0.00 -1.18 0.00 0.00 59.36 57.78 1i01 h GLU 71 Cb 0.14 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.75 1i01 h GLU 71 CO 0.01 1.02 0.34 0.87 -1.18 0.00 0.00 179.01 180.07 1i01 h LYS 72 N 0.32 0.83 -0.67 1.92 1.57 -0.72 -1.16 116.57 118.66 1i01 h LYS 72 Ca 0.01 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 1i01 h LYS 72 Cb 1.00 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.12 1i01 h LYS 72 CO 0.09 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 0.00 1.86 2.04 -1.20 -1.81 117.51 120.45 1i01 h ILE 73 Ca 0.21 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 65.24 1i01 h ILE 73 Cb 0.03 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1i01 h ILE 73 CO -0.04 0.31 -0.16 0.03 0.00 0.00 0.00 178.15 178.30 1i01 h ARG 74 N 0.96 0.00 0.00 2.37 3.08 -0.96 0.34 114.38 120.18 1i01 h ARG 74 Ca 0.22 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.13 1i01 h ARG 74 Cb 0.24 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1i01 h ARG 74 CO -0.01 0.16 -0.93 0.00 -1.07 0.00 0.00 179.97 178.11 1i01 h ALA 75 N 1.84 0.64 0.00 0.04 0.00 -0.64 -3.32 119.26 117.82 1i01 h ALA 75 Ca -0.00 -0.66 -0.15 0.00 0.00 0.00 0.00 54.91 54.10 1i01 h ALA 75 Cb 0.57 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1i01 h ALA 75 CO 0.02 0.80 -1.77 -1.91 0.00 0.00 0.00 179.25 176.40 1i01 n GLU 76 N -3.09 1.41 0.00 0.00 2.13 -0.74 -4.89 120.64 115.46 1i01 n GLU 76 Ca -0.03 -0.05 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1i01 n GLU 76 Cb 0.80 -1.32 0.00 0.00 0.27 0.00 0.00 31.44 31.19 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 -2.28 0.00 0.00 4.31 3.01 0.11 -5.09 117.46 117.51 1i01 n PHE 77 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.32 1i01 n PHE 77 Cb 0.71 0.09 0.00 0.00 -0.01 0.00 0.00 39.48 40.26 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 2.61 0.73 3.81 1.37 0.00 -0.33 -4.99 105.19 108.39 1i01 n GLY 78 Ca 0.00 -1.69 -0.36 0.00 0.00 0.00 0.00 46.02 43.97 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 -1.81 4.31 -0.10 1.61 0.41 -1.26 -3.27 118.70 118.58 1i01 s GLU 79 Ca 0.00 0.96 -0.30 0.00 -0.41 0.00 0.00 54.97 55.22 1i01 s GLU 79 Cb 0.00 -2.81 -0.03 0.00 -1.78 0.00 0.00 34.13 29.51 1i01 s GLU 79 CO 0.00 0.34 1.26 0.08 -0.49 0.00 0.00 175.26 176.45 1i01 s VAL 80 N -1.59 4.21 -0.15 2.63 1.01 -1.26 -4.53 120.40 120.71 1i01 s VAL 80 Ca 0.46 1.51 0.14 0.00 0.00 0.00 0.00 61.98 64.08 1i01 s VAL 80 Cb -0.16 -3.97 -0.24 0.00 0.00 0.00 0.00 36.38 32.01 1i01 s VAL 80 CO 0.21 -0.07 0.24 0.47 0.00 0.00 0.00 175.10 175.95 1i01 n ASP 81 N 5.94 0.57 -3.97 3.32 9.92 0.09 -4.64 116.55 127.78 1i01 n ASP 81 Ca 0.13 0.12 -0.26 0.00 -0.53 0.00 0.00 54.79 54.26 1i01 n ASP 81 Cb 0.45 0.44 -0.17 0.00 -0.64 0.00 0.00 41.12 41.21 1i01 n ASP 81 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1i01 s ILE 82 N -2.53 1.08 -0.16 0.53 1.01 -0.49 -2.02 121.20 118.62 1i01 s ILE 82 Ca -0.11 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.15 1i01 s ILE 82 Cb 0.07 -1.03 0.00 0.00 0.01 0.00 0.00 42.46 41.51 1i01 s ILE 82 CO 0.80 0.36 -0.16 -0.22 0.00 0.00 0.00 174.94 175.72 1i01 s LEU 83 N 1.15 2.38 -0.22 2.97 2.96 0.23 -0.22 118.68 127.92 1i01 s LEU 83 Ca -0.05 -0.52 0.02 0.00 -0.22 0.00 0.00 54.13 53.35 1i01 s LEU 83 Cb -0.14 -1.54 0.04 0.00 0.50 0.00 0.00 46.19 45.05 1i01 s LEU 83 CO -0.02 0.06 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.23 1i01 s VAL 84 N 0.97 2.08 -0.56 1.68 1.01 -0.13 -0.54 120.40 124.91 1i01 s VAL 84 Ca -0.03 -1.32 -0.20 0.00 0.00 0.00 0.00 61.98 60.43 1i01 s VAL 84 Cb -0.15 -2.07 0.07 0.00 0.00 0.00 0.00 36.38 34.23 1i01 s VAL 84 CO -0.03 0.20 0.73 0.20 0.00 0.00 0.00 175.10 176.20 1i01 s ASN 85 N 1.20 6.22 -0.23 3.32 0.01 0.10 -1.85 114.94 123.71 1i01 s ASN 85 Ca -0.03 -1.02 -0.13 0.00 -0.71 0.00 0.00 52.86 50.97 1i01 s ASN 85 Cb -0.17 -2.33 -0.05 0.00 0.41 0.00 0.00 41.25 39.12 1i01 s ASN 85 CO -0.08 -1.07 0.26 0.21 -1.51 0.00 0.00 177.10 174.91 1i01 s ASN 86 N 3.12 6.25 0.52 -1.22 3.04 -1.22 -0.43 114.94 124.99 1i01 s ASN 86 Ca 0.17 0.28 -0.21 0.00 0.04 0.00 0.00 52.86 53.14 1i01 s ASN 86 Cb -0.20 -2.16 -0.06 0.00 -1.54 0.00 0.00 41.25 37.29 1i01 s ASN 86 CO 0.11 -0.00 1.14 0.00 -3.04 0.00 0.00 177.10 175.30 1i01 s ALA 87 N 1.19 2.78 1.00 1.71 0.00 -1.24 -4.52 121.76 122.70 1i01 s ALA 87 Ca 0.12 0.85 0.00 0.00 0.00 0.00 0.00 51.96 52.93 1i01 s ALA 87 Cb -0.14 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.62 1i01 s ALA 87 CO 0.06 -0.72 0.00 0.41 0.00 0.00 0.00 175.76 175.51 1i01 n GLY 88 N 0.23 -1.74 3.67 0.00 0.00 -1.26 -4.95 105.19 101.14 1i01 n GLY 88 Ca 0.10 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 1i01 n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i01 s ILE 89 N -0.72 4.85 0.22 -0.61 1.01 -1.26 -4.79 121.20 119.91 1i01 s ILE 89 Ca 0.00 1.68 -0.23 0.00 0.00 0.00 0.00 60.65 62.10 1i01 s ILE 89 Cb 0.00 -4.16 -0.08 0.00 0.01 0.00 0.00 42.46 38.23 1i01 s ILE 89 CO 0.00 -0.00 0.79 0.42 0.00 0.00 0.00 174.94 176.15 1i01 s THR 90 N 2.30 4.41 -0.35 2.92 -4.23 -1.26 -5.02 115.64 114.41 1i01 s THR 90 Ca 0.39 1.57 0.03 0.00 -1.18 0.00 0.00 61.69 62.50 1i01 s THR 90 Cb -0.16 -4.01 0.10 0.00 1.34 0.00 0.00 72.50 69.77 1i01 s THR 90 CO 0.12 0.33 0.07 -0.60 -0.54 0.00 0.00 174.62 174.00 1i01 s ARG 91 N -1.63 1.40 0.70 3.99 6.06 -1.26 -4.96 118.95 123.25 1i01 s ARG 91 Ca 0.41 -1.81 -0.16 0.00 -2.50 0.00 0.00 55.73 51.66 1i01 s ARG 91 Cb -0.20 -3.03 -0.04 0.00 0.06 0.00 0.00 34.95 31.75 1i01 s ARG 91 CO 0.24 -0.96 0.64 -3.47 -2.50 0.00 0.00 175.30 169.25 1i01 n ASP 92 N 4.25 -0.75 -3.75 -2.12 2.03 -1.26 -5.05 116.55 109.90 1i01 n ASP 92 Ca 0.03 0.63 -0.04 0.00 0.52 0.00 0.00 54.79 55.93 1i01 n ASP 92 Cb 0.41 -1.26 -0.01 0.00 -0.72 0.00 0.00 41.12 39.54 1i01 n ASP 92 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1i01 s ASN 93 N -1.46 -0.20 0.05 1.67 2.47 -1.26 -5.08 114.94 111.14 1i01 s ASN 93 Ca 0.68 -0.41 -0.16 0.00 0.42 0.00 0.00 52.86 53.39 1i01 s ASN 93 Cb -0.36 0.51 -0.06 0.00 -1.45 0.00 0.00 41.25 39.89 1i01 s ASN 93 CO 0.55 -0.94 0.49 -0.76 -3.72 0.00 0.00 177.10 172.72 1i01 s LEU 94 N -2.92 4.47 0.10 3.21 1.43 -1.26 -3.66 118.68 120.06 1i01 s LEU 94 Ca 0.12 1.09 -0.33 0.00 -1.03 0.00 0.00 54.13 53.99 1i01 s LEU 94 Cb -0.02 -2.82 -0.13 0.00 0.03 0.00 0.00 46.19 43.26 1i01 s LEU 94 CO 0.02 0.27 1.58 -0.07 0.23 0.00 0.00 176.35 178.38 1i01 h LEU 95 N 4.44 -1.28 0.00 1.79 3.38 -1.96 -1.74 115.31 119.94 1i01 h LEU 95 Ca -0.50 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1i01 h LEU 95 Cb 1.21 0.46 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1i01 h LEU 95 CO 0.63 -0.54 0.00 0.23 0.09 0.00 0.00 178.44 178.85 1i01 n MET 96 N -5.49 0.39 0.00 1.13 2.81 -1.26 -1.68 117.12 113.03 1i01 n MET 96 Ca -0.09 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.82 1i01 n MET 96 Cb 0.40 -1.37 -0.03 0.00 -0.71 0.00 0.00 33.22 31.52 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 -0.87 5.42 -2.86 0.03 1.74 -0.79 -5.02 116.66 114.32 1i01 n ARG 97 Ca 0.07 -0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.75 1i01 n ARG 97 Cb 0.03 -0.72 -0.06 0.00 -1.02 0.00 0.00 32.46 30.69 1i01 n ARG 97 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1i01 s MET 98 N -1.44 4.71 0.46 5.56 0.23 -0.67 -4.97 119.30 123.18 1i01 s MET 98 Ca 0.02 1.33 -0.03 0.00 -1.03 0.00 0.00 55.69 55.98 1i01 s MET 98 Cb 0.04 -3.29 -0.02 0.00 -1.53 0.00 0.00 34.83 30.03 1i01 s MET 98 CO 0.19 0.50 0.72 0.15 -2.03 0.00 0.00 175.02 174.55 1i01 s LYS 99 N -1.01 3.32 0.33 3.16 3.01 -1.26 -4.89 119.74 122.40 1i01 s LYS 99 Ca 0.39 -0.12 0.11 0.00 -1.01 0.00 0.00 55.97 55.34 1i01 s LYS 99 Cb -0.24 -2.47 0.95 0.00 -1.01 0.00 0.00 37.83 35.06 1i01 s LYS 99 CO 0.29 -0.21 1.71 -0.44 0.51 0.00 0.00 175.35 177.21 1i01 h ASP 100 N 0.33 0.62 -0.05 2.83 3.45 -1.98 -1.36 116.42 120.27 1i01 h ASP 100 Ca -0.47 0.15 0.01 0.00 0.43 0.00 0.00 57.03 57.15 1i01 h ASP 100 Cb 1.23 0.07 -0.02 0.00 -0.56 0.00 0.00 39.33 40.04 1i01 h ASP 100 CO 0.60 0.02 -0.20 -0.08 -1.57 0.00 0.00 179.24 178.01 1i01 h GLU 101 N 0.50 -0.21 0.01 3.56 4.57 -1.99 0.31 114.58 121.33 1i01 h GLU 101 Ca 0.67 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.89 1i01 h GLU 101 Cb 1.37 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.98 1i01 h GLU 101 CO -0.52 -0.14 -0.14 1.49 -1.18 0.00 0.00 179.01 178.52 1i01 h GLU 102 N -0.22 -0.23 -0.39 1.92 4.81 -1.67 -0.79 114.58 118.02 1i01 h GLU 102 Ca 0.01 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.34 1i01 h GLU 102 Cb 0.26 0.05 -0.09 0.00 0.63 0.00 0.00 28.75 29.60 1i01 h GLU 102 CO -0.16 -0.15 -0.28 2.35 -0.73 0.00 0.00 179.01 180.03 1i01 h TRP 103 N -0.23 -0.77 -0.75 0.92 2.91 -1.12 0.67 115.95 117.57 1i01 h TRP 103 Ca 0.04 0.05 -0.00 0.00 1.13 0.00 0.00 58.89 60.11 1i01 h TRP 103 Cb 0.29 0.39 -0.04 0.00 -0.51 0.00 0.00 29.16 29.30 1i01 h TRP 103 CO -0.19 -0.35 0.45 -0.91 -1.03 0.00 0.00 178.44 176.41 1i01 h ASN 104 N -0.22 0.91 -0.15 2.65 -0.26 -0.17 -1.77 115.58 116.56 1i01 h ASN 104 Ca 0.18 -0.06 -0.05 0.00 -0.56 0.00 0.00 56.30 55.80 1i01 h ASN 104 Cb 0.51 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 37.52 1i01 h ASN 104 CO -0.51 0.70 -0.05 0.44 -1.06 0.00 0.00 177.43 176.95 1i01 h ASP 105 N 1.03 0.42 -0.10 5.81 5.19 0.25 -0.68 116.42 128.34 1i01 h ASP 105 Ca 0.27 -0.08 -0.24 0.00 -0.62 0.00 0.00 57.03 56.36 1i01 h ASP 105 Cb -0.03 -0.11 0.01 0.00 0.18 0.00 0.00 39.33 39.38 1i01 h ASP 105 CO -0.05 0.53 -0.87 0.40 -3.12 0.00 0.00 179.24 176.13 1i01 h ILE 106 N 0.42 1.28 0.29 0.35 2.04 -0.55 -0.87 117.51 120.48 1i01 h ILE 106 Ca 0.09 -2.06 -0.01 0.00 1.00 0.00 0.00 64.86 63.87 1i01 h ILE 106 Cb 0.36 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 1i01 h ILE 106 CO 0.02 0.65 -0.14 0.40 0.00 0.00 0.00 178.15 179.08 1i01 h ILE 107 N 0.50 0.74 -0.65 -0.67 1.08 -1.10 0.49 117.51 117.89 1i01 h ILE 107 Ca -0.08 -0.26 0.08 0.00 -0.39 0.00 0.00 64.86 64.21 1i01 h ILE 107 Cb 1.51 0.89 -0.06 0.00 -3.07 0.00 0.00 36.82 36.08 1i01 h ILE 107 CO 0.18 0.06 0.33 -0.08 -0.69 0.00 0.00 178.15 177.94 1i01 h GLU 108 N -0.53 0.57 0.04 2.37 4.57 -1.15 0.49 114.58 120.95 1i01 h GLU 108 Ca -0.04 -0.03 -0.27 0.00 -1.18 0.00 0.00 59.36 57.84 1i01 h GLU 108 Cb 0.39 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 1i01 h GLU 108 CO 0.07 0.38 -1.37 1.15 -1.18 0.00 0.00 179.01 178.05 1i01 h THR 109 N 0.59 1.29 0.00 0.32 2.02 -1.11 -2.49 112.91 113.52 1i01 h THR 109 Ca 0.31 -3.01 0.00 0.00 0.77 0.00 0.00 66.41 64.48 1i01 h THR 109 Cb 0.28 2.71 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1i01 h THR 109 CO -0.23 0.79 -1.81 0.59 0.37 0.00 0.00 175.52 175.23 1i01 n ASN 110 N -3.31 0.39 0.01 4.18 5.03 0.17 -4.55 115.26 117.18 1i01 n ASN 110 Ca -0.10 -0.12 -0.00 0.00 0.87 0.00 0.00 54.58 55.22 1i01 n ASN 110 Cb 1.01 1.82 -0.00 0.00 -1.02 0.00 0.00 39.78 41.59 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 -2.12 0.45 -0.11 3.41 7.94 0.16 -4.68 117.00 122.06 1i01 n LEU 111 Ca -0.03 0.06 0.12 0.00 -1.11 0.00 0.00 56.01 55.05 1i01 n LEU 111 Cb 0.51 -0.19 0.48 0.00 0.53 0.00 0.00 43.42 44.74 1i01 n LEU 111 CO 0.43 -0.57 1.20 0.28 -1.11 0.00 0.00 177.39 177.61 1i01 h SER 112 N -0.05 0.42 -0.49 1.96 0.02 -1.48 -1.99 113.55 111.94 1i01 h SER 112 Ca 0.00 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.89 1i01 h SER 112 Cb 0.05 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1i01 h SER 112 CO 0.00 0.25 0.03 0.77 -1.14 0.00 0.00 176.83 176.74 1i01 h SER 113 N 0.46 0.87 -0.22 3.07 4.64 -1.66 -0.59 113.55 120.11 1i01 h SER 113 Ca 0.30 -0.21 -0.07 0.00 -0.47 0.00 0.00 61.79 61.34 1i01 h SER 113 Cb 0.56 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 1i01 h SER 113 CO -0.09 0.91 -0.09 0.58 -0.87 0.00 0.00 176.83 177.26 1i01 h VAL 114 N 0.84 1.24 -0.32 0.95 2.07 -1.64 -0.25 116.25 119.14 1i01 h VAL 114 Ca 0.16 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 1i01 h VAL 114 Cb 0.45 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1i01 h VAL 114 CO 0.02 0.34 0.03 0.15 0.02 0.00 0.00 177.57 178.13 1i01 h PHE 115 N 0.55 0.60 -0.45 1.57 3.57 -1.23 -1.16 116.94 120.39 1i01 h PHE 115 Ca 0.10 -0.09 -0.12 0.00 3.53 0.00 0.00 57.97 61.39 1i01 h PHE 115 Cb 0.49 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1i01 h PHE 115 CO 0.02 0.65 -0.21 0.00 -2.23 0.00 0.00 178.31 176.55 1i01 h ARG 116 N 0.37 0.90 -0.20 1.11 3.08 -0.75 -2.15 114.38 116.74 1i01 h ARG 116 Ca 0.10 -0.37 -0.12 0.00 0.07 0.00 0.00 59.98 59.66 1i01 h ARG 116 Cb 0.40 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 1i01 h ARG 116 CO 0.01 1.02 -0.34 -0.07 -1.07 0.00 0.00 179.97 179.52 1i01 h LEU 117 N 0.78 0.66 -0.99 3.04 3.38 -1.02 -2.12 115.31 119.03 1i01 h LEU 117 Ca 0.11 -0.53 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 1i01 h LEU 117 Cb 0.75 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 1i01 h LEU 117 CO 0.06 1.06 0.47 0.28 0.09 0.00 0.00 178.44 180.41 1i01 h SER 118 N 0.27 1.05 -0.64 -0.43 0.02 -1.22 -2.22 113.55 110.39 1i01 h SER 118 Ca 0.01 -0.09 -0.09 0.00 -0.84 0.00 0.00 61.79 60.79 1i01 h SER 118 Cb 0.93 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 1i01 h SER 118 CO 0.08 0.84 0.07 0.50 -1.14 0.00 0.00 176.83 177.18 1i01 h LYS 119 N 1.18 1.09 0.00 3.45 3.64 -1.35 -2.13 116.57 122.46 1i01 h LYS 119 Ca 0.30 -0.31 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 1i01 h LYS 119 Cb 0.01 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1i01 h LYS 119 CO -0.05 1.02 -0.28 0.00 -2.27 0.00 0.00 179.45 177.87 1i01 h ALA 120 N 1.05 1.17 0.00 5.00 0.00 -0.79 -3.27 119.26 122.42 1i01 h ALA 120 Ca 0.19 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1i01 h ALA 120 Cb 0.48 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1i01 h ALA 120 CO 0.02 0.36 -0.92 1.33 0.00 0.00 0.00 179.25 180.03 1i01 n VAL 121 N -3.68 0.00 -0.33 0.00 0.24 -0.96 -4.67 118.33 108.93 1i01 n VAL 121 Ca -0.01 -0.16 -0.03 0.00 -2.04 0.00 0.00 64.34 62.10 1i01 n VAL 121 Cb 0.40 0.86 0.09 0.00 -1.47 0.00 0.00 33.84 33.72 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 1.19 0.10 7.34 2.07 -1.43 -3.01 114.93 121.19 1i01 h MET 122 Ca 0.00 -0.09 0.00 0.00 -2.07 0.00 0.00 59.70 57.54 1i01 h MET 122 Cb 0.44 -0.26 -0.01 0.00 -1.87 0.00 0.00 31.60 29.91 1i01 h MET 122 CO 0.00 0.81 -0.09 0.00 1.07 0.00 0.00 176.91 178.70 1i01 h ARG 123 N 1.21 -0.20 -0.10 1.72 2.47 -1.83 0.86 114.38 118.51 1i01 h ARG 123 Ca 0.32 0.01 0.03 0.00 -1.26 0.00 0.00 59.98 59.08 1i01 h ARG 123 Cb -0.09 0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.27 1i01 h ARG 123 CO -0.06 -0.13 0.07 0.00 0.56 0.00 0.00 179.97 180.41 1i01 h ALA 124 N 0.69 2.09 -0.18 0.04 0.00 -1.88 -0.61 119.26 119.41 1i01 h ALA 124 Ca 0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1i01 h ALA 124 Cb 0.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1i01 h ALA 124 CO -0.02 -0.13 -0.46 0.52 0.00 0.00 0.00 179.25 179.16 1i01 h MET 125 N 0.00 0.62 -0.41 0.00 2.86 -1.18 -3.11 114.93 113.72 1i01 h MET 125 Ca 0.05 -0.44 -0.10 0.00 -2.06 0.00 0.00 59.70 57.15 1i01 h MET 125 Cb 0.20 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 1i01 h MET 125 CO -0.00 1.05 -0.16 0.52 1.06 0.00 0.00 176.91 179.39 1i01 h MET 126 N 0.29 0.76 0.00 1.72 2.07 0.36 -0.69 114.93 119.44 1i01 h MET 126 Ca -0.01 -0.27 -0.04 0.00 -2.07 0.00 0.00 59.70 57.32 1i01 h MET 126 Cb 1.08 -0.05 -0.01 0.00 -1.87 0.00 0.00 31.60 30.75 1i01 h MET 126 CO 0.10 0.87 -0.17 1.57 1.07 0.00 0.00 176.91 180.35 1i01 h LYS 127 N 0.67 0.00 -0.00 1.72 2.10 -1.21 -1.30 116.57 118.56 1i01 h LYS 127 Ca 0.11 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.76 1i01 h LYS 127 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1i01 h LYS 127 CO 0.05 0.17 -0.60 1.63 -2.00 0.00 0.00 179.45 178.69 1i01 n LYS 128 N -3.69 0.06 -2.52 0.07 5.02 -0.92 -4.93 118.16 111.25 1i01 n LYS 128 Ca -0.02 -0.04 -0.21 0.00 -2.02 0.00 0.00 58.31 56.03 1i01 n LYS 128 Cb 0.28 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 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 -1.44 -2.30 -3.66 1.97 1.74 -0.33 -4.96 116.66 107.68 1i01 n ARG 129 Ca 0.06 0.96 -0.10 0.00 -0.77 0.00 0.00 57.85 58.00 1i01 n ARG 129 Cb 0.34 -5.63 -0.08 0.00 -1.02 0.00 0.00 32.46 26.07 1i01 n ARG 129 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1i01 s HIS 130 N -3.05 -0.84 -0.18 -1.55 2.46 -0.81 -4.25 115.29 107.07 1i01 s HIS 130 Ca 0.06 1.80 -0.33 0.00 0.47 0.00 0.00 55.06 57.07 1i01 s HIS 130 Cb -0.03 0.42 0.14 0.00 -0.13 0.00 0.00 32.58 32.98 1i01 s HIS 130 CO 0.08 -0.42 1.17 0.20 -2.47 0.00 0.00 174.74 173.29 1i01 s GLY 131 N 1.13 -0.24 -0.03 1.59 0.00 -0.81 -4.57 107.32 104.38 1i01 s GLY 131 Ca -0.06 1.81 0.00 0.00 0.00 0.00 0.00 44.72 46.46 1i01 s GLY 131 CO -0.11 0.68 0.01 0.50 0.00 0.00 0.00 173.10 174.18 1i01 s ARG 132 N -2.06 0.23 -0.15 2.90 1.81 -0.85 -1.71 118.95 119.12 1i01 s ARG 132 Ca 0.07 0.12 -0.00 0.00 -1.72 0.00 0.00 55.73 54.19 1i01 s ARG 132 Cb -0.01 -0.47 0.04 0.00 -0.45 0.00 0.00 34.95 34.06 1i01 s ARG 132 CO -0.05 -0.16 -0.06 0.42 -0.68 0.00 0.00 175.30 174.77 1i01 s ILE 133 N 1.15 1.12 -0.09 1.52 1.01 -0.28 -0.60 121.20 125.02 1i01 s ILE 133 Ca -0.08 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 60.04 1i01 s ILE 133 Cb -0.13 -1.25 0.01 0.00 0.01 0.00 0.00 42.46 41.10 1i01 s ILE 133 CO -0.02 0.20 -0.16 -0.63 0.00 0.00 0.00 174.94 174.33 1i01 s ILE 134 N 1.64 1.45 -0.11 2.92 1.01 0.29 -0.91 121.20 127.50 1i01 s ILE 134 Ca 0.02 -0.64 0.00 0.00 0.00 0.00 0.00 60.65 60.03 1i01 s ILE 134 Cb -0.15 -1.31 -0.02 0.00 0.01 0.00 0.00 42.46 40.99 1i01 s ILE 134 CO -0.08 0.43 -0.11 -0.89 0.00 0.00 0.00 174.94 174.29 1i01 s THR 135 N 0.73 3.27 -0.21 2.92 2.01 -0.61 -0.72 115.64 123.03 1i01 s THR 135 Ca -0.12 -0.61 -0.14 0.00 0.31 0.00 0.00 61.69 61.14 1i01 s THR 135 Cb -0.16 -2.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 1i01 s THR 135 CO 0.03 0.54 0.29 -0.63 -0.69 0.00 0.00 174.62 174.17 1i01 s ILE 136 N -0.03 5.27 0.77 1.82 1.09 0.42 -1.12 121.20 129.43 1i01 s ILE 136 Ca -0.02 0.49 -0.11 0.00 -1.10 0.00 0.00 60.65 59.91 1i01 s ILE 136 Cb -0.14 -3.63 0.06 0.00 -1.06 0.00 0.00 42.46 37.69 1i01 s ILE 136 CO 0.04 0.31 1.09 -0.83 -0.10 0.00 0.00 174.94 175.44 1i01 s GLY 137 N 0.96 1.67 0.10 6.18 0.00 0.37 -3.62 107.32 112.97 1i01 s GLY 137 Ca 0.14 0.21 -0.31 0.00 0.00 0.00 0.00 44.72 44.77 1i01 s GLY 137 CO 0.06 0.56 1.65 -0.56 0.00 0.00 0.00 173.10 174.81 1i01 s SER 138 N -3.46 6.58 0.24 1.64 0.01 -1.26 -4.55 113.70 112.90 1i01 s SER 138 Ca 0.61 2.54 -0.30 0.00 1.31 0.00 0.00 55.95 60.11 1i01 s SER 138 Cb -0.17 -2.57 -0.09 0.00 0.21 0.00 0.00 66.02 63.40 1i01 s SER 138 CO 0.56 -0.88 1.35 0.54 0.41 0.00 0.00 173.24 175.22 1i01 s VAL 139 N 2.31 2.93 0.05 3.43 0.11 -1.26 -4.77 120.40 123.20 1i01 s VAL 139 Ca 0.74 0.80 -0.30 0.00 -2.93 0.00 0.00 61.98 60.28 1i01 s VAL 139 Cb -0.41 -3.51 -0.08 0.00 -1.53 0.00 0.00 36.38 30.84 1i01 s VAL 139 CO 0.32 0.14 1.81 -0.69 -3.33 0.00 0.00 175.10 173.35 1i01 s VAL 140 N -0.16 3.02 0.34 2.04 1.01 -0.88 -4.82 120.40 120.95 1i01 s VAL 140 Ca 0.56 0.26 -0.05 0.00 0.00 0.00 0.00 61.98 62.75 1i01 s VAL 140 Cb -0.39 -3.17 0.08 0.00 0.00 0.00 0.00 36.38 32.90 1i01 s VAL 140 CO 0.42 -0.01 0.47 0.61 0.00 0.00 0.00 175.10 176.59 1i01 n GLY 141 N 4.28 -0.72 1.27 4.51 0.00 -1.26 -4.38 105.19 108.88 1i01 n GLY 141 Ca 0.18 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1i01 n GLY 141 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i01 n THR 142 N -2.48 0.95 -0.23 2.61 -2.24 -1.26 -5.03 114.28 106.59 1i01 n THR 142 Ca 0.06 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1i01 n THR 142 Cb 0.22 -1.04 0.00 0.00 -2.10 0.00 0.00 70.33 67.41 1i01 n THR 142 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i01 n GLY 147 N 1.06 0.77 0.86 3.38 0.00 -1.26 -5.03 105.19 104.98 1i01 n GLY 147 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1i01 n GLY 147 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1i01 n GLN 148 N -2.14 1.19 -0.33 1.61 7.27 -1.26 -4.31 117.38 119.41 1i01 n GLN 148 Ca 0.00 -2.98 0.13 0.00 0.07 0.00 0.00 57.00 54.22 1i01 n GLN 148 Cb 0.00 -1.20 0.32 0.00 2.41 0.00 0.00 30.24 31.76 1i01 n GLN 148 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1i01 h ALA 149 N 1.02 1.57 0.00 1.69 0.00 -2.00 -1.06 119.26 120.48 1i01 h ALA 149 Ca -0.06 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1i01 h ALA 149 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1i01 h ALA 149 CO 0.03 -0.19 0.00 -2.95 0.00 0.00 0.00 179.25 176.15 1i01 h ASN 150 N 0.60 0.00 0.00 0.00 -1.07 -1.89 -1.69 115.58 111.53 1i01 h ASN 150 Ca 0.57 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.94 1i01 h ASN 150 Cb 0.98 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.23 1i01 h ASN 150 CO -0.44 0.00 -0.91 -1.22 0.07 0.00 0.00 177.43 174.93 1i01 n TYR 151 N -2.36 0.00 -0.25 4.14 4.02 -0.42 -4.70 117.16 117.59 1i01 n TYR 151 Ca -0.01 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.92 1i01 n TYR 151 Cb 0.10 -0.06 0.17 0.00 -0.02 0.00 0.00 39.34 39.53 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 2.16 1.03 0.46 -0.72 0.00 -1.12 -1.07 119.26 120.01 1i01 h ALA 152 Ca 0.00 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1i01 h ALA 152 Cb 0.44 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1i01 h ALA 152 CO 0.00 -0.14 -0.22 0.00 0.00 0.00 0.00 179.25 178.89 1i01 h ALA 153 N 1.50 -0.62 -0.88 0.00 0.00 -1.84 -1.79 119.26 115.63 1i01 h ALA 153 Ca 0.39 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.22 1i01 h ALA 153 Cb 0.52 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.49 1i01 h ALA 153 CO -0.34 -0.72 0.57 0.00 0.00 0.00 0.00 179.25 178.75 1i01 h ALA 154 N -0.49 1.71 -0.24 0.00 0.00 -1.86 0.30 119.26 118.68 1i01 h ALA 154 Ca -0.06 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1i01 h ALA 154 Cb 0.58 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1i01 h ALA 154 CO 0.10 0.09 0.03 -0.22 0.00 0.00 0.00 179.25 179.25 1i01 h LYS 155 N 0.80 0.39 -0.28 0.00 3.64 -1.04 -0.98 116.57 119.11 1i01 h LYS 155 Ca 0.42 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.58 1i01 h LYS 155 Cb 0.51 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1i01 h LYS 155 CO -0.18 0.53 -0.30 0.00 -2.27 0.00 0.00 179.45 177.23 1i01 h ALA 156 N 0.84 0.95 -0.11 5.00 0.00 -0.78 -2.51 119.26 122.64 1i01 h ALA 156 Ca 0.07 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 1i01 h ALA 156 Cb 0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1i01 h ALA 156 CO 0.01 0.61 -0.40 0.78 0.00 0.00 0.00 179.25 180.25 1i01 h GLY 157 N 1.03 0.27 0.97 0.00 0.00 -0.83 -1.68 103.07 102.81 1i01 h GLY 157 Ca 0.06 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.09 1i01 h GLY 157 CO 0.06 0.23 0.07 -2.00 0.00 0.00 0.00 176.54 174.90 1i01 h LEU 158 N 0.21 0.73 -0.51 3.11 5.85 -0.90 0.57 115.31 124.36 1i01 h LEU 158 Ca 0.02 -0.26 -0.13 0.00 0.84 0.00 0.00 57.88 58.35 1i01 h LEU 158 Cb 0.80 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1i01 h LEU 158 CO 0.06 0.80 -0.18 0.40 -0.34 0.00 0.00 178.44 179.19 1i01 h ILE 159 N 0.62 1.27 -0.67 4.05 2.04 -1.23 -1.29 117.51 122.30 1i01 h ILE 159 Ca 0.14 -1.35 -0.05 0.00 1.00 0.00 0.00 64.86 64.60 1i01 h ILE 159 Cb 0.39 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 1i01 h ILE 159 CO 0.01 0.47 0.22 1.23 0.00 0.00 0.00 178.15 180.08 1i01 h GLY 160 N 0.89 1.11 0.97 5.37 0.00 -1.11 -1.50 103.07 108.81 1i01 h GLY 160 Ca 0.12 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 1i01 h GLY 160 CO 0.06 0.60 0.13 -2.75 0.00 0.00 0.00 176.54 174.59 1i01 h PHE 161 N 0.97 0.81 -0.55 5.60 3.57 -0.71 -2.37 116.94 124.26 1i01 h PHE 161 Ca 0.22 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 1i01 h PHE 161 Cb 0.28 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 1i01 h PHE 161 CO 0.02 0.72 0.16 0.77 -2.23 0.00 0.00 178.31 177.76 1i01 h SER 162 N 0.67 0.80 -0.75 0.41 0.02 -0.99 0.11 113.55 113.82 1i01 h SER 162 Ca 0.16 -0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.83 1i01 h SER 162 Cb 0.31 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 1i01 h SER 162 CO -0.00 0.81 0.24 0.11 -1.14 0.00 0.00 176.83 176.84 1i01 h LYS 163 N 0.76 1.17 -0.22 3.45 1.57 -1.22 0.17 116.57 122.25 1i01 h LYS 163 Ca 0.18 -0.25 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1i01 h LYS 163 Cb 0.29 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1i01 h LYS 163 CO -0.00 0.99 -0.13 1.03 -0.57 0.00 0.00 179.45 180.77 1i01 h SER 164 N 1.12 0.49 -0.41 0.86 0.87 -1.17 -2.60 113.55 112.71 1i01 h SER 164 Ca 0.24 -0.42 -0.09 0.00 -1.23 0.00 0.00 61.79 60.29 1i01 h SER 164 Cb 0.31 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 1i01 h SER 164 CO -0.01 0.81 -0.06 0.25 -0.53 0.00 0.00 176.83 177.29 1i01 h LEU 165 N 0.18 0.82 -0.72 2.23 5.85 -0.63 -2.65 115.31 120.38 1i01 h LEU 165 Ca 0.05 -0.23 0.07 0.00 0.84 0.00 0.00 57.88 58.61 1i01 h LEU 165 Cb 0.63 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 1i01 h LEU 165 CO 0.04 0.92 0.40 0.00 -0.34 0.00 0.00 178.44 179.46 1i01 h ALA 166 N 1.16 0.99 0.00 1.25 0.00 -0.55 -0.98 119.26 121.13 1i01 h ALA 166 Ca 0.14 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1i01 h ALA 166 Cb 0.55 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1i01 h ALA 166 CO 0.03 0.07 -0.34 -0.09 0.00 0.00 0.00 179.25 178.92 1i01 h ARG 167 N 0.72 0.00 0.21 0.00 2.43 -1.17 -1.90 114.38 114.67 1i01 h ARG 167 Ca 0.33 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 59.19 1i01 h ARG 167 Cb 0.24 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.82 1i01 h ARG 167 CO -0.21 0.34 -1.41 1.49 -1.51 0.00 0.00 179.97 178.68 1i01 h GLU 168 N 0.00 0.44 -0.26 0.20 4.81 -0.88 -3.37 114.58 115.52 1i01 h GLU 168 Ca -0.00 -0.75 0.00 0.00 -0.13 0.00 0.00 59.36 58.47 1i01 h GLU 168 Cb 0.66 0.28 0.00 0.00 0.63 0.00 0.00 28.75 30.32 1i01 h GLU 168 CO 0.04 1.36 0.00 1.33 -0.73 0.00 0.00 179.01 181.01 1i01 n VAL 169 N -3.64 0.47 -0.37 0.32 0.24 -0.63 -4.64 118.33 110.07 1i01 n VAL 169 Ca -0.14 -0.74 0.01 0.00 -2.04 0.00 0.00 64.34 61.44 1i01 n VAL 169 Cb 1.08 0.95 0.16 0.00 -1.47 0.00 0.00 33.84 34.55 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 3.17 1.36 0.00 2.33 0.00 -1.47 -1.98 119.26 122.68 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 0.77 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1i01 h ALA 170 CO 0.00 0.51 0.00 0.66 0.00 0.00 0.00 179.25 180.42 1i01 h SER 171 N 1.23 0.00 -0.06 0.00 4.64 -1.87 -2.42 113.55 115.08 1i01 h SER 171 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1i01 h SER 171 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1i01 h SER 171 CO -0.15 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.35 1i01 n ARG 172 N -2.42 1.75 -0.83 4.77 5.12 -0.75 -4.93 116.66 119.37 1i01 n ARG 172 Ca 0.01 -1.09 0.00 0.00 -1.93 0.00 0.00 57.85 54.84 1i01 n ARG 172 Cb 0.21 -1.46 0.00 0.00 -1.16 0.00 0.00 32.46 30.05 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 1.18 0.65 3.38 -0.13 0.00 -0.91 -3.48 105.19 105.89 1i01 n GLY 173 Ca 0.18 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 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 3.00 -0.01 -0.61 1.01 -1.21 -1.92 121.20 119.46 1i01 s ILE 174 Ca 0.00 -0.69 0.03 0.00 0.00 0.00 0.00 60.65 59.99 1i01 s ILE 174 Cb 0.00 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 1i01 s ILE 174 CO 0.00 0.54 -0.06 0.42 0.00 0.00 0.00 174.94 175.83 1i01 s THR 175 N 0.18 3.69 -0.17 2.92 -4.23 -0.69 -3.95 115.64 113.39 1i01 s THR 175 Ca -0.08 -0.71 0.00 0.00 -1.18 0.00 0.00 61.69 59.73 1i01 s THR 175 Cb -0.15 -2.59 0.04 0.00 1.34 0.00 0.00 72.50 71.14 1i01 s THR 175 CO 0.05 0.43 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.79 1i01 s VAL 176 N -0.97 1.34 0.25 2.29 1.01 -1.26 -1.13 120.40 121.94 1i01 s VAL 176 Ca 0.16 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1i01 s VAL 176 Cb -0.11 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.80 1i01 s VAL 176 CO 0.06 0.23 0.07 0.20 0.00 0.00 0.00 175.10 175.67 1i01 s ASN 177 N 1.55 1.41 -0.03 3.32 0.01 -0.09 -0.12 114.94 120.98 1i01 s ASN 177 Ca 0.01 -1.34 0.03 0.00 -0.71 0.00 0.00 52.86 50.86 1i01 s ASN 177 Cb -0.15 0.11 -0.00 0.00 0.41 0.00 0.00 41.25 41.62 1i01 s ASN 177 CO -0.08 -0.67 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.02 1i01 s VAL 178 N -3.65 1.03 -0.20 1.60 1.01 -0.32 -1.57 120.40 118.30 1i01 s VAL 178 Ca 0.35 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 1i01 s VAL 178 Cb 0.08 -0.90 -0.00 0.00 0.00 0.00 0.00 36.38 35.56 1i01 s VAL 178 CO 0.12 0.31 -0.08 -0.69 0.00 0.00 0.00 175.10 174.76 1i01 s VAL 179 N 0.06 3.13 -0.54 2.92 1.01 -0.27 0.10 120.40 126.80 1i01 s VAL 179 Ca -0.02 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 1i01 s VAL 179 Cb -0.09 -2.40 0.14 0.00 0.00 0.00 0.00 36.38 34.03 1i01 s VAL 179 CO 0.01 0.45 0.40 0.00 0.00 0.00 0.00 175.10 175.96 1i01 s ALA 180 N 1.32 3.49 0.62 5.51 0.00 -0.26 -0.48 121.76 131.96 1i01 s ALA 180 Ca 0.04 -2.81 -0.15 0.00 0.00 0.00 0.00 51.96 49.04 1i01 s ALA 180 Cb -0.14 -2.81 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 1i01 s ALA 180 CO -0.04 -1.99 1.06 -1.25 0.00 0.00 0.00 175.76 173.55 1i01 s PRO 181 N 0.83 3.20 0.00 0.00 0.04 -1.26 -1.67 135.00 136.14 1i01 s PRO 181 Ca 0.10 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1i01 s PRO 181 Cb -0.22 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.30 1i01 s PRO 181 CO -0.03 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.52 1i01 n GLY 182 N -1.09 0.59 3.64 0.56 0.00 -0.59 -4.11 105.19 104.19 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 3.19 0.02 1.61 0.40 -1.26 -2.08 117.98 123.60 1i01 s PHE 183 Ca 0.00 1.19 0.06 0.00 -0.60 0.00 0.00 56.93 57.58 1i01 s PHE 183 Cb 0.00 -3.57 -0.03 0.00 0.51 0.00 0.00 43.02 39.93 1i01 s PHE 183 CO 0.00 -0.70 -0.16 0.42 0.70 0.00 0.00 175.22 175.48 1i01 s ILE 184 N 3.50 2.90 0.02 0.64 1.09 -1.26 -1.11 121.20 126.98 1i01 s ILE 184 Ca 0.44 -1.08 -0.30 0.00 -1.10 0.00 0.00 60.65 58.61 1i01 s ILE 184 Cb -0.13 -2.21 -0.06 0.00 -1.06 0.00 0.00 42.46 39.00 1i01 s ILE 184 CO 0.14 0.38 1.53 -0.70 -0.10 0.00 0.00 174.94 176.19 1i01 s GLU 185 N -1.32 4.23 0.00 2.79 2.56 -0.11 -4.86 118.70 121.99 1i01 s GLU 185 Ca 0.14 2.13 0.00 0.00 0.00 0.00 0.00 54.97 57.25 1i01 s GLU 185 Cb -0.11 -3.64 0.00 0.00 2.00 0.00 0.00 34.13 32.38 1i01 s GLU 185 CO 0.05 -0.68 0.00 0.25 -0.56 0.00 0.00 175.26 174.32 1i01 n THR 186 N 4.81 0.00 0.00 -1.70 -2.24 -1.26 -4.65 114.28 109.24 1i01 n THR 186 Ca 0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1i01 n THR 186 Cb 0.42 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 1i01 n THR 186 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1i01 n SER 193 N -1.01 0.00 0.01 3.42 2.88 -1.26 -5.22 113.62 112.44 1i01 n SER 193 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 1i01 n SER 193 Cb 0.11 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.44 1i01 n SER 193 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1i01 h ASP 194 N 0.00 0.00 0.18 -3.46 3.04 -2.05 -2.39 116.42 111.74 1i01 h ASP 194 Ca 0.00 0.00 -0.14 0.00 -3.24 0.00 0.00 57.03 53.65 1i01 h ASP 194 Cb 0.00 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.28 1i01 h ASP 194 CO 0.00 0.99 -0.51 0.44 -2.04 0.00 0.00 179.24 178.12 1i01 h ASP 195 N 0.00 0.40 0.59 4.15 3.32 -2.06 -0.39 116.42 122.44 1i01 h ASP 195 Ca -0.18 -0.20 -0.19 0.00 0.02 0.00 0.00 57.03 56.47 1i01 h ASP 195 Cb 1.92 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 41.34 1i01 h ASP 195 CO 0.10 0.84 -0.86 1.56 -1.72 0.00 0.00 179.24 179.16 1i01 h GLN 196 N 0.29 0.18 0.40 3.56 4.20 -2.00 -2.90 115.11 118.84 1i01 h GLN 196 Ca 0.01 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.52 1i01 h GLN 196 Cb 1.00 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.82 1i01 h GLN 196 CO 0.09 0.93 -0.29 -0.09 -0.67 0.00 0.00 178.83 178.80 1i01 h ARG 197 N 0.10 -0.65 -0.05 1.46 9.65 -0.90 -2.00 114.38 121.99 1i01 h ARG 197 Ca -0.04 0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.90 1i01 h ARG 197 Cb 1.48 0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 30.21 1i01 h ARG 197 CO 0.13 -0.43 0.04 0.00 2.80 0.00 0.00 179.97 182.50 1i01 h ALA 198 N -0.15 1.84 -0.17 2.80 0.00 -1.10 0.66 119.26 123.14 1i01 h ALA 198 Ca -0.04 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1i01 h ALA 198 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1i01 h ALA 198 CO 0.01 -0.06 -0.44 0.78 0.00 0.00 0.00 179.25 179.54 1i01 h GLY 199 N 0.00 0.46 0.16 0.00 0.00 -1.17 -1.29 103.07 101.23 1i01 h GLY 199 Ca 0.02 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 1i01 h GLY 199 CO -0.00 0.42 -0.04 -2.22 0.00 0.00 0.00 176.54 174.70 1i01 h ILE 200 N 0.34 0.85 -0.88 2.60 2.04 -0.56 -3.31 117.51 118.60 1i01 h ILE 200 Ca 0.02 -1.42 0.21 0.00 1.00 0.00 0.00 64.86 64.67 1i01 h ILE 200 Cb 0.92 1.54 -0.06 0.00 -0.74 0.00 0.00 36.82 38.48 1i01 h ILE 200 CO 0.08 0.26 0.59 -0.07 0.00 0.00 0.00 178.15 179.01 1i01 h LEU 201 N -0.95 0.32 -1.74 1.44 4.07 -0.96 0.22 115.31 117.71 1i01 h LEU 201 Ca -0.01 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.98 1i01 h LEU 201 Cb 0.51 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.22 1i01 h LEU 201 CO 0.02 0.13 0.00 0.00 -1.08 0.00 0.00 178.44 177.51 1i01 h ALA 202 N 1.61 1.00 -0.19 1.53 0.00 -1.32 -0.67 119.26 121.22 1i01 h ALA 202 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1i01 h ALA 202 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1i01 h ALA 202 CO -0.14 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.15 1i01 n GLN 203 N -2.76 1.97 -4.07 0.00 6.02 0.76 -4.78 117.38 114.51 1i01 n GLN 203 Ca -0.00 -1.44 -0.33 0.00 -0.01 0.00 0.00 57.00 55.22 1i01 n GLN 203 Cb 0.17 -1.44 -0.15 0.00 1.02 0.00 0.00 30.24 29.84 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 -1.77 2.23 0.29 5.09 1.01 -0.26 -4.56 120.40 122.42 1i01 s VAL 204 Ca 0.34 -1.31 0.03 0.00 0.00 0.00 0.00 61.98 61.03 1i01 s VAL 204 Cb 0.19 -2.16 0.28 0.00 0.00 0.00 0.00 36.38 34.69 1i01 s VAL 204 CO 0.29 0.20 1.79 -0.65 0.00 0.00 0.00 175.10 176.72 1i01 h PRO 205 N 7.86 0.76 0.00 2.72 0.11 -1.82 0.22 132.00 141.84 1i01 h PRO 205 Ca -0.30 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1i01 h PRO 205 Cb 1.08 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1i01 h PRO 205 CO 0.54 0.50 0.00 0.00 -0.21 0.00 0.00 178.00 178.83 1i01 n ALA 206 N -2.36 1.56 -1.27 -0.75 0.00 -1.07 -4.91 120.51 111.70 1i01 n ALA 206 Ca 0.20 0.10 -0.09 0.00 0.00 0.00 0.00 53.44 53.65 1i01 n ALA 206 Cb 0.47 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 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 -0.22 1.08 3.53 0.00 0.00 0.76 -5.01 105.19 105.32 1i01 n GLY 207 Ca 0.02 -0.45 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.65 1.43 0.32 1.61 1.70 -1.26 -4.99 118.95 115.11 1i01 s ARG 208 Ca 0.00 -1.12 -0.07 0.00 -0.47 0.00 0.00 55.73 54.07 1i01 s ARG 208 Cb 0.00 0.47 -0.06 0.00 -0.57 0.00 0.00 34.95 34.79 1i01 s ARG 208 CO 0.00 -0.59 0.61 -0.51 -1.08 0.00 0.00 175.30 173.73 1i01 s LEU 209 N -2.97 4.01 0.51 -1.89 1.43 -1.26 -4.98 118.68 113.52 1i01 s LEU 209 Ca 0.17 0.83 -0.08 0.00 -1.03 0.00 0.00 54.13 54.02 1i01 s LEU 209 Cb -0.00 -3.66 -0.04 0.00 0.03 0.00 0.00 46.19 42.52 1i01 s LEU 209 CO 0.04 -0.24 0.86 -0.83 0.23 0.00 0.00 176.35 176.40 1i01 s GLY 210 N -3.12 1.64 0.22 -3.19 0.00 -0.27 -4.78 107.32 97.81 1i01 s GLY 210 Ca 0.46 -0.32 -0.03 0.00 0.00 0.00 0.00 44.72 44.83 1i01 s GLY 210 CO 0.30 -0.12 0.44 -0.32 0.00 0.00 0.00 173.10 173.40 1i01 s GLY 211 N -3.93 1.90 0.40 0.20 0.00 -1.26 -0.94 107.32 103.70 1i01 s GLY 211 Ca 0.50 -0.69 0.10 0.00 0.00 0.00 0.00 44.72 44.63 1i01 s GLY 211 CO 0.44 -0.62 1.98 0.00 0.00 0.00 0.00 173.10 174.91 1i01 h ALA 212 N 2.06 1.84 0.00 3.20 0.00 -1.94 -1.07 119.26 123.36 1i01 h ALA 212 Ca -0.47 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1i01 h ALA 212 Cb 1.19 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1i01 h ALA 212 CO 0.68 0.05 -0.17 0.37 0.00 0.00 0.00 179.25 180.18 1i01 h GLN 213 N 0.57 0.00 -0.17 0.00 5.75 -1.93 -2.33 115.11 117.01 1i01 h GLN 213 Ca 0.28 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.68 1i01 h GLN 213 Cb 0.34 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.88 1i01 h GLN 213 CO -0.08 0.17 -0.31 0.93 -2.65 0.00 0.00 178.83 176.89 1i01 h GLU 214 N 0.00 0.33 -0.18 1.69 5.08 -1.58 0.42 114.58 120.34 1i01 h GLU 214 Ca -0.00 -0.13 -0.22 0.00 -1.00 0.00 0.00 59.36 58.01 1i01 h GLU 214 Cb 0.32 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.56 1i01 h GLU 214 CO 0.02 0.61 -0.74 0.82 -1.00 0.00 0.00 179.01 178.72 1i01 h ILE 215 N 0.29 1.28 -0.49 3.13 5.03 -1.46 -3.03 117.51 122.26 1i01 h ILE 215 Ca 0.04 -1.94 -0.02 0.00 -0.12 0.00 0.00 64.86 62.82 1i01 h ILE 215 Cb 0.70 1.92 -0.02 0.00 -3.03 0.00 0.00 36.82 36.38 1i01 h ILE 215 CO 0.05 0.62 0.21 0.00 -0.68 0.00 0.00 178.15 178.35 1i01 h ALA 216 N 0.59 1.45 -0.63 1.87 0.00 -0.97 -1.34 119.26 120.22 1i01 h ALA 216 Ca -0.04 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1i01 h ALA 216 Cb 1.37 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1i01 h ALA 216 CO 0.15 0.43 0.10 -0.91 0.00 0.00 0.00 179.25 179.03 1i01 h ASN 217 N 0.70 0.99 -0.42 0.00 2.35 -0.87 0.09 115.58 118.42 1i01 h ASN 217 Ca 0.17 -0.26 -0.06 0.00 -0.55 0.00 0.00 56.30 55.60 1i01 h ASN 217 Cb 0.12 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 1i01 h ASN 217 CO -0.02 1.00 0.03 0.00 -1.65 0.00 0.00 177.43 176.79 1i01 h ALA 218 N 1.03 0.57 -0.29 -0.83 0.00 -1.33 -1.61 119.26 116.79 1i01 h ALA 218 Ca 0.19 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1i01 h ALA 218 Cb 0.43 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1i01 h ALA 218 CO 0.01 0.32 0.12 0.28 0.00 0.00 0.00 179.25 179.99 1i01 h VAL 219 N 0.57 1.17 -0.99 0.00 2.07 -1.08 -1.84 116.25 116.17 1i01 h VAL 219 Ca 0.12 -0.53 0.07 0.00 0.82 0.00 0.00 66.70 67.18 1i01 h VAL 219 Cb 0.44 0.98 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 1i01 h VAL 219 CO 0.02 0.18 0.64 0.00 0.02 0.00 0.00 177.57 178.42 1i01 h ALA 220 N 0.97 1.44 0.01 1.67 0.00 -0.85 -0.57 119.26 121.91 1i01 h ALA 220 Ca 0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1i01 h ALA 220 Cb 0.17 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1i01 h ALA 220 CO -0.01 0.41 -0.00 0.35 0.00 0.00 0.00 179.25 180.00 1i01 h PHE 221 N 1.14 -0.01 0.00 0.00 3.57 -0.94 -2.57 116.94 118.13 1i01 h PHE 221 Ca 0.43 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.89 1i01 h PHE 221 Cb 0.20 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1i01 h PHE 221 CO -0.00 0.20 -0.17 -0.07 -2.23 0.00 0.00 178.31 176.04 1i01 h LEU 222 N -0.21 0.00 0.00 0.59 3.38 -0.85 -2.50 115.31 115.71 1i01 h LEU 222 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i01 h LEU 222 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1i01 h LEU 222 CO 0.00 0.17 -0.08 0.00 0.09 0.00 0.00 178.44 178.61 1i01 h ALA 223 N 1.83 0.96 -2.18 1.53 0.00 -1.00 -3.44 119.26 116.96 1i01 h ALA 223 Ca -0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 1i01 h ALA 223 Cb 0.39 0.00 0.15 0.00 0.00 0.00 0.00 17.79 18.33 1i01 h ALA 223 CO 0.02 0.00 0.36 -1.54 0.00 0.00 0.00 179.25 178.09 1i01 s SER 224 N -6.13 3.03 0.18 0.00 1.04 -0.94 -4.94 113.70 105.93 1i01 s SER 224 Ca 0.06 0.50 0.24 0.00 0.48 0.00 0.00 55.95 57.23 1i01 s SER 224 Cb 0.05 -0.71 0.91 0.00 0.10 0.00 0.00 66.02 66.37 1i01 s SER 224 CO 0.68 -2.81 1.74 0.47 0.98 0.00 0.00 173.24 174.30 1i01 n ASP 225 N -3.86 0.57 0.07 7.02 8.00 -1.26 -3.08 116.55 124.01 1i01 n ASP 225 Ca 0.13 0.59 0.12 0.00 0.71 0.00 0.00 54.79 56.34 1i01 n ASP 225 Cb 0.60 -0.73 0.47 0.00 -0.02 0.00 0.00 41.12 41.43 1i01 n ASP 225 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1i01 n GLU 226 N -2.07 0.14 -0.75 -1.24 1.02 -1.26 -2.92 120.64 113.55 1i01 n GLU 226 Ca 0.04 0.21 -0.02 0.00 -0.02 0.00 0.00 57.16 57.38 1i01 n GLU 226 Cb 0.32 -1.70 0.20 0.00 -0.02 0.00 0.00 31.44 30.25 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 -1.67 4.15 0.28 0.62 0.00 -1.18 -4.69 120.51 118.02 1i01 n ALA 227 Ca 0.05 -3.19 0.15 0.00 0.00 0.00 0.00 53.44 50.45 1i01 n ALA 227 Cb 0.33 -0.63 0.85 0.00 0.00 0.00 0.00 19.45 20.00 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 1.00 1.30 -0.64 0.00 0.00 -1.69 -2.05 119.26 117.18 1i01 h ALA 228 Ca 0.16 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1i01 h ALA 228 Cb 1.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1i01 h ALA 228 CO 0.28 0.08 0.00 0.98 0.00 0.00 0.00 179.25 180.59 1i01 n TYR 229 N -3.60 0.85 -3.74 0.00 9.36 -1.26 -4.85 117.16 113.92 1i01 n TYR 229 Ca -0.02 -0.44 -0.37 0.00 3.32 0.00 0.00 57.90 60.39 1i01 n TYR 229 Cb 0.17 -0.00 -0.12 0.00 -0.63 0.00 0.00 39.34 38.76 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 -1.12 4.30 -0.12 2.97 1.01 -0.77 -5.07 121.20 122.39 1i01 s ILE 230 Ca 0.46 -0.29 -0.23 0.00 0.00 0.00 0.00 60.65 60.59 1i01 s ILE 230 Cb 0.25 -3.07 0.06 0.00 0.01 0.00 0.00 42.46 39.70 1i01 s ILE 230 CO 0.33 0.26 0.57 0.28 0.00 0.00 0.00 174.94 176.38 1i01 s THR 231 N 1.60 0.01 -0.30 2.92 -1.32 -1.26 -4.69 115.64 112.59 1i01 s THR 231 Ca 0.06 -0.09 0.00 0.00 -1.21 0.00 0.00 61.69 60.45 1i01 s THR 231 Cb -0.16 -0.84 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 1i01 s THR 231 CO 0.04 -0.05 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 1i01 n GLY 232 N 1.85 0.60 3.88 6.08 0.00 0.82 -4.95 105.19 113.48 1i01 n GLY 232 Ca -0.17 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 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 -1.75 3.32 -0.34 1.61 2.56 -1.26 -4.75 118.70 118.09 1i01 s GLU 233 Ca 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 54.97 54.49 1i01 s GLU 233 Cb 0.00 -2.99 0.07 0.00 2.00 0.00 0.00 34.13 33.21 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 -1.42 3.25 -0.43 -1.70 2.01 -1.26 -1.18 115.64 114.91 1i01 s THR 234 Ca 0.31 -1.56 -0.20 0.00 0.31 0.00 0.00 61.69 60.55 1i01 s THR 234 Cb -0.13 -2.99 0.02 0.00 0.01 0.00 0.00 72.50 69.42 1i01 s THR 234 CO 0.24 -0.32 0.62 -0.22 -0.69 0.00 0.00 174.62 174.24 1i01 s LEU 235 N 1.24 4.52 -0.04 4.42 2.96 0.12 -4.91 118.68 126.99 1i01 s LEU 235 Ca 0.00 -0.33 -0.25 0.00 -0.22 0.00 0.00 54.13 53.33 1i01 s LEU 235 Cb -0.21 -2.69 -0.04 0.00 0.50 0.00 0.00 46.19 43.75 1i01 s LEU 235 CO -0.01 -0.73 0.75 -1.00 -1.32 0.00 0.00 176.35 174.03 1i01 s HIS 236 N 2.72 3.61 -0.60 5.38 3.76 -1.26 -1.10 115.29 127.80 1i01 s HIS 236 Ca 0.21 1.35 0.04 0.00 -0.15 0.00 0.00 55.06 56.52 1i01 s HIS 236 Cb -0.14 -2.85 0.17 0.00 1.11 0.00 0.00 32.58 30.86 1i01 s HIS 236 CO 0.18 0.10 0.43 0.08 -0.85 0.00 0.00 174.74 174.68 1i01 s VAL 237 N 0.70 2.11 -0.01 -0.90 1.01 -0.67 -4.88 120.40 117.75 1i01 s VAL 237 Ca 0.40 -3.71 0.02 0.00 0.00 0.00 0.00 61.98 58.69 1i01 s VAL 237 Cb -0.19 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 33.82 1i01 s VAL 237 CO 0.20 -1.06 0.79 -0.46 0.00 0.00 0.00 175.10 174.57 1i01 n ASN 238 N 2.33 0.84 -1.85 3.32 2.04 -1.26 -1.55 115.26 119.13 1i01 n ASN 238 Ca 0.21 -1.65 -0.18 0.00 -0.44 0.00 0.00 54.58 52.53 1i01 n ASN 238 Cb 0.38 -0.07 -0.02 0.00 -2.53 0.00 0.00 39.78 37.54 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 -0.29 0.14 1.13 4.83 0.00 -1.26 -2.59 105.19 107.16 1i01 n GLY 239 Ca 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.97 0.91 0.00 -0.02 0.00 -1.26 -2.61 105.19 101.24 1i01 n GLY 240 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1i01 n GLY 240 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19