#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i88 s VAL 2 N 0.00 4.65 -0.39 1.12 1.01 -1.26 -5.03 120.40 120.50 1i88 s VAL 2 Ca 0.00 1.89 -0.18 0.00 0.00 0.00 0.00 61.98 63.69 1i88 s VAL 2 Cb 0.00 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 32.15 1i88 s VAL 2 CO 0.00 0.31 0.52 -0.55 0.00 0.00 0.00 175.10 175.38 1i88 s SER 3 N 0.15 6.28 0.21 3.32 0.15 -1.26 -4.93 113.70 117.63 1i88 s SER 3 Ca 0.44 -0.27 -0.01 0.00 0.70 0.00 0.00 55.95 56.81 1i88 s SER 3 Cb -0.22 -2.27 0.18 0.00 -1.71 0.00 0.00 66.02 62.01 1i88 s SER 3 CO 0.27 -0.58 1.56 0.58 1.20 0.00 0.00 173.24 176.27 1i88 h VAL 4 N 5.71 1.32 -0.68 4.45 2.07 -1.99 -2.43 116.25 124.69 1i88 h VAL 4 Ca -0.27 -1.70 -0.03 0.00 0.82 0.00 0.00 66.70 65.52 1i88 h VAL 4 Cb 1.11 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.55 1i88 h VAL 4 CO 0.81 0.53 0.29 0.77 0.02 0.00 0.00 177.57 179.99 1i88 h SER 5 N 0.41 0.90 -0.43 0.57 4.64 -1.99 0.11 113.55 117.75 1i88 h SER 5 Ca 0.02 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 1i88 h SER 5 Cb 1.00 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.84 1i88 h SER 5 CO 0.09 0.79 0.24 -0.33 -0.87 0.00 0.00 176.83 176.75 1i88 h GLU 6 N 0.98 0.60 -0.25 4.77 5.08 -1.94 -1.56 114.58 122.25 1i88 h GLU 6 Ca 0.23 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1i88 h GLU 6 Cb 0.15 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1i88 h GLU 6 CO -0.02 0.47 0.16 0.82 -1.00 0.00 0.00 179.01 179.43 1i88 h ILE 7 N 0.57 1.08 -0.46 3.13 2.04 -0.90 -1.67 117.51 121.29 1i88 h ILE 7 Ca 0.15 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1i88 h ILE 7 Cb 0.04 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1i88 h ILE 7 CO -0.03 0.08 0.30 -0.09 0.00 0.00 0.00 178.15 178.41 1i88 h ARG 8 N 0.32 0.61 -0.84 2.37 9.65 -0.58 0.72 114.38 126.63 1i88 h ARG 8 Ca 0.09 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.92 1i88 h ARG 8 Cb -0.01 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.39 1i88 h ARG 8 CO -0.02 0.42 0.50 -0.22 2.80 0.00 0.00 179.97 183.44 1i88 h LYS 9 N 0.63 1.14 0.00 0.20 1.63 -1.16 -2.42 116.57 116.59 1i88 h LYS 9 Ca 0.17 -0.11 -0.06 0.00 -0.85 0.00 0.00 60.65 59.80 1i88 h LYS 9 Cb -0.06 -0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 31.32 1i88 h LYS 9 CO -0.04 0.81 -0.29 0.00 -3.45 0.00 0.00 179.45 176.49 1i88 h ALA 10 N 1.27 0.93 0.00 5.00 0.00 -0.85 -3.29 119.26 122.31 1i88 h ALA 10 Ca 0.30 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 1i88 h ALA 10 Cb -0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1i88 h ALA 10 CO -0.05 0.36 -0.80 0.37 0.00 0.00 0.00 179.25 179.12 1i88 h GLN 11 N 0.00 0.00 -6.68 0.00 4.15 -0.38 -3.45 115.11 108.75 1i88 h GLN 11 Ca -0.00 0.00 -0.47 0.00 0.77 0.00 0.00 58.65 58.95 1i88 h GLN 11 Cb 0.94 0.00 0.02 0.00 0.21 0.00 0.00 27.48 28.65 1i88 h GLN 11 CO 0.04 0.47 -0.09 -0.98 -1.93 0.00 0.00 178.83 176.33 1i88 s ARG 12 N -2.94 3.31 0.73 1.69 1.70 -1.07 0.08 118.95 122.46 1i88 s ARG 12 Ca 0.02 -0.30 -0.05 0.00 -0.47 0.00 0.00 55.73 54.93 1i88 s ARG 12 Cb 0.08 -2.56 0.11 0.00 -0.57 0.00 0.00 34.95 32.01 1i88 s ARG 12 CO 0.77 -0.11 1.02 0.00 -1.08 0.00 0.00 175.30 175.91 1i88 s ALA 13 N -2.50 3.32 -0.15 7.88 0.00 -1.02 -3.88 121.76 125.40 1i88 s ALA 13 Ca 0.45 -1.34 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 1i88 s ALA 13 Cb -0.10 -2.32 -0.07 0.00 0.00 0.00 0.00 23.12 20.63 1i88 s ALA 13 CO 0.39 -1.47 -0.19 -1.91 0.00 0.00 0.00 175.76 172.57 1i88 n GLU 14 N -2.95 0.33 -2.61 0.00 4.07 -1.26 -4.85 120.64 113.37 1i88 n GLU 14 Ca 0.12 0.14 -0.24 0.00 -0.06 0.00 0.00 57.16 57.12 1i88 n GLU 14 Cb 0.60 -1.08 0.12 0.00 -0.06 0.00 0.00 31.44 31.02 1i88 n GLU 14 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1i88 s GLY 15 N -5.30 1.75 0.43 8.31 0.00 -1.26 -5.03 107.32 106.22 1i88 s GLY 15 Ca -0.21 -1.86 -0.24 0.00 0.00 0.00 0.00 44.72 42.40 1i88 s GLY 15 CO 0.28 -1.24 1.22 2.56 0.00 0.00 0.00 173.10 175.92 1i88 s PRO 16 N -5.19 3.87 0.22 2.90 0.04 -1.26 -4.60 135.00 130.98 1i88 s PRO 16 Ca 0.68 1.93 -0.31 0.00 0.04 0.00 0.00 61.00 63.34 1i88 s PRO 16 Cb -0.04 -2.58 -0.11 0.00 0.04 0.00 0.00 34.50 31.81 1i88 s PRO 16 CO 0.45 -0.50 1.63 0.00 0.04 0.00 0.00 177.00 178.62 1i88 s ALA 17 N -1.41 3.83 -0.05 8.56 0.00 -1.26 -4.43 121.76 127.00 1i88 s ALA 17 Ca 0.60 1.51 0.04 0.00 0.00 0.00 0.00 51.96 54.11 1i88 s ALA 17 Cb -0.33 -3.66 -0.00 0.00 0.00 0.00 0.00 23.12 19.14 1i88 s ALA 17 CO 0.41 -0.89 -0.18 0.99 0.00 0.00 0.00 175.76 176.09 1i88 s THR 18 N 0.79 1.51 -0.22 0.00 2.01 0.29 -0.72 115.64 119.29 1i88 s THR 18 Ca 0.70 -0.75 -0.29 0.00 0.31 0.00 0.00 61.69 61.65 1i88 s THR 18 Cb -0.47 -1.30 0.01 0.00 0.01 0.00 0.00 72.50 70.75 1i88 s THR 18 CO 0.37 0.43 1.06 -0.63 -0.69 0.00 0.00 174.62 175.15 1i88 s ILE 19 N 0.07 4.65 -0.56 1.82 1.01 0.58 -0.99 121.20 127.78 1i88 s ILE 19 Ca -0.05 1.99 0.12 0.00 0.00 0.00 0.00 60.65 62.72 1i88 s ILE 19 Cb -0.12 -4.29 -0.14 0.00 0.01 0.00 0.00 42.46 37.92 1i88 s ILE 19 CO 0.03 -0.17 0.52 0.18 0.00 0.00 0.00 174.94 175.49 1i88 n LEU 20 N 6.30 0.56 -3.60 2.97 4.77 0.92 -0.63 117.00 128.28 1i88 n LEU 20 Ca 0.12 -0.47 -0.11 0.00 -0.03 0.00 0.00 56.01 55.52 1i88 n LEU 20 Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 1i88 n LEU 20 CO 0.52 0.14 0.73 0.00 -1.33 0.00 0.00 177.39 177.45 1i88 s ALA 21 N -2.21 -1.93 -0.02 -1.18 0.00 -1.23 -4.57 121.76 110.61 1i88 s ALA 21 Ca 0.04 1.69 0.01 0.00 0.00 0.00 0.00 51.96 53.70 1i88 s ALA 21 Cb 0.09 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.27 1i88 s ALA 21 CO 0.51 -0.28 -0.01 0.42 0.00 0.00 0.00 175.76 176.40 1i88 s ILE 22 N -0.55 0.20 0.01 0.00 1.01 -1.26 -1.81 121.20 118.81 1i88 s ILE 22 Ca -0.00 0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.69 1i88 s ILE 22 Cb -0.02 -0.27 -0.01 0.00 0.01 0.00 0.00 42.46 42.17 1i88 s ILE 22 CO -0.01 0.13 -0.05 -0.83 0.00 0.00 0.00 174.94 174.18 1i88 s GLY 23 N 0.77 0.29 0.20 6.18 0.00 -0.18 -4.63 107.32 109.96 1i88 s GLY 23 Ca -0.08 -0.40 0.04 0.00 0.00 0.00 0.00 44.72 44.28 1i88 s GLY 23 CO -0.01 -0.41 -0.03 -0.51 0.00 0.00 0.00 173.10 172.14 1i88 s THR 24 N -0.64 1.02 0.03 0.90 -4.23 -1.26 -0.17 115.64 111.28 1i88 s THR 24 Ca -0.04 -2.03 -0.25 0.00 -1.18 0.00 0.00 61.69 58.19 1i88 s THR 24 Cb -0.05 -2.16 0.06 0.00 1.34 0.00 0.00 72.50 71.69 1i88 s THR 24 CO -0.00 -0.48 0.58 0.00 -0.54 0.00 0.00 174.62 174.18 1i88 s ALA 25 N -3.43 -1.50 0.06 3.99 0.00 0.11 -4.57 121.76 116.43 1i88 s ALA 25 Ca 0.24 0.81 -0.06 0.00 0.00 0.00 0.00 51.96 52.95 1i88 s ALA 25 Cb 0.05 0.33 -0.01 0.00 0.00 0.00 0.00 23.12 23.48 1i88 s ALA 25 CO 0.05 -0.49 0.12 -0.80 0.00 0.00 0.00 175.76 174.64 1i88 s ASN 26 N -1.82 0.19 0.77 0.00 -0.87 -1.26 -0.88 114.94 111.08 1i88 s ASN 26 Ca -0.06 -0.64 -0.14 0.00 -1.57 0.00 0.00 52.86 50.45 1i88 s ASN 26 Cb -0.01 0.27 0.06 0.00 -0.02 0.00 0.00 41.25 41.56 1i88 s ASN 26 CO 0.01 -0.61 1.21 -2.84 -2.57 0.00 0.00 177.10 172.30 1i88 s PRO 27 N -3.28 1.86 0.39 -0.60 0.02 -1.26 -4.92 135.00 127.21 1i88 s PRO 27 Ca 0.01 1.77 0.18 0.00 0.02 0.00 0.00 61.00 62.98 1i88 s PRO 27 Cb 0.03 -1.80 0.80 0.00 0.02 0.00 0.00 34.50 33.54 1i88 s PRO 27 CO -0.08 -2.05 1.81 0.00 -0.33 0.00 0.00 177.00 176.34 1i88 h ALA 28 N -0.62 1.15 -1.72 -1.55 0.00 -1.97 -3.42 119.26 111.12 1i88 h ALA 28 Ca -0.47 -0.32 -0.55 0.00 0.00 0.00 0.00 54.91 53.57 1i88 h ALA 28 Cb 1.30 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1i88 h ALA 28 CO 0.48 0.44 1.20 1.21 0.00 0.00 0.00 179.25 182.58 1i88 s ASN 29 N -6.56 5.94 -0.19 0.00 2.47 -1.26 -4.97 114.94 110.36 1i88 s ASN 29 Ca -0.01 0.79 -0.18 0.00 0.42 0.00 0.00 52.86 53.88 1i88 s ASN 29 Cb 0.12 -2.53 -0.04 0.00 -1.45 0.00 0.00 41.25 37.35 1i88 s ASN 29 CO 0.69 -1.76 0.48 0.00 -3.72 0.00 0.00 177.10 172.78 1i88 s VAL 31 N 1.42 3.26 0.33 0.00 1.01 0.12 -4.99 120.40 121.55 1i88 s VAL 31 Ca 0.23 -1.50 -0.29 0.00 0.00 0.00 0.00 61.98 60.43 1i88 s VAL 31 Cb -0.15 -2.96 -0.10 0.00 0.00 0.00 0.00 36.38 33.16 1i88 s VAL 31 CO 0.09 -0.28 1.31 -1.61 0.00 0.00 0.00 175.10 174.61 1i88 s GLU 32 N 1.26 4.34 0.12 2.72 0.41 -1.26 -1.79 118.70 124.51 1i88 s GLU 32 Ca -0.01 2.21 -0.01 0.00 -0.41 0.00 0.00 54.97 56.75 1i88 s GLU 32 Cb -0.20 -3.06 -0.13 0.00 -1.78 0.00 0.00 34.13 28.96 1i88 s GLU 32 CO -0.01 -0.20 1.28 0.37 -0.49 0.00 0.00 175.26 176.21 1i88 h GLN 33 N 3.35 0.27 -0.89 1.61 5.75 -1.19 -3.05 115.11 120.97 1i88 h GLN 33 Ca -0.49 -0.35 0.16 0.00 -0.15 0.00 0.00 58.65 57.82 1i88 h GLN 33 Cb 1.23 0.11 -0.10 0.00 1.07 0.00 0.00 27.48 29.79 1i88 h GLN 33 CO 0.65 1.08 0.48 0.66 -2.65 0.00 0.00 178.83 179.05 1i88 h SER 34 N 0.13 0.59 -0.46 -0.69 4.64 -1.88 -1.53 113.55 114.35 1i88 h SER 34 Ca -0.08 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1i88 h SER 34 Cb 1.69 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 1i88 h SER 34 CO 0.16 0.23 0.00 0.35 -0.87 0.00 0.00 176.83 176.71 1i88 n THR 35 N -4.85 1.55 -0.20 2.95 -2.24 -1.25 -4.67 114.28 105.57 1i88 n THR 35 Ca 0.19 -1.26 -0.09 0.00 -2.27 0.00 0.00 64.05 60.62 1i88 n THR 35 Cb 0.47 0.22 0.02 0.00 -2.10 0.00 0.00 70.33 68.94 1i88 n THR 35 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1i88 h TYR 36 N 2.84 1.03 -0.73 4.78 3.20 -1.15 -2.59 116.97 124.35 1i88 h TYR 36 Ca 0.00 -0.15 0.14 0.00 3.14 0.00 0.00 58.73 61.86 1i88 h TYR 36 Cb 1.14 -0.28 -0.09 0.00 1.54 0.00 0.00 36.73 39.04 1i88 h TYR 36 CO 0.48 0.90 0.27 -1.35 -1.64 0.00 0.00 178.16 176.83 1i88 h PRO 37 N 0.86 0.40 -0.33 1.82 0.11 -1.83 0.32 132.00 133.35 1i88 h PRO 37 Ca 0.17 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.20 1i88 h PRO 37 Cb 0.44 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1i88 h PRO 37 CO 0.01 0.26 -0.01 -0.44 -0.21 0.00 0.00 178.00 177.62 1i88 h ASP 38 N 0.41 0.58 0.17 -2.05 3.32 -1.87 0.18 116.42 117.15 1i88 h ASP 38 Ca 0.40 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 1i88 h ASP 38 Cb 0.61 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 1i88 h ASP 38 CO -0.41 0.75 -0.09 0.15 -1.72 0.00 0.00 179.24 177.92 1i88 h PHE 39 N 0.38 -0.24 -0.61 4.55 3.57 -0.92 -1.56 116.94 122.11 1i88 h PHE 39 Ca 0.09 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.51 1i88 h PHE 39 Cb 0.47 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 1i88 h PHE 39 CO 0.04 -0.15 0.06 -0.92 -2.23 0.00 0.00 178.31 175.11 1i88 h TYR 40 N -0.25 1.11 0.00 0.41 3.20 -0.38 -1.17 116.97 119.90 1i88 h TYR 40 Ca -0.02 -0.17 -0.11 0.00 3.14 0.00 0.00 58.73 61.58 1i88 h TYR 40 Cb 0.20 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 1i88 h TYR 40 CO -0.08 0.96 -0.51 0.74 -1.64 0.00 0.00 178.16 177.64 1i88 h PHE 41 N 0.93 0.00 -0.02 -3.82 -1.00 -0.94 -2.32 116.94 109.78 1i88 h PHE 41 Ca 0.18 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.93 1i88 h PHE 41 Cb 0.48 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.04 1i88 h PHE 41 CO 0.04 0.51 -0.10 -0.22 -1.61 0.00 0.00 178.31 176.92 1i88 h LYS 42 N 0.00 0.11 0.00 1.51 3.64 -1.07 -0.58 116.57 120.17 1i88 h LYS 42 Ca -0.01 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1i88 h LYS 42 Cb 0.91 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1i88 h LYS 42 CO 0.07 0.76 -0.10 0.97 -2.27 0.00 0.00 179.45 178.87 1i88 h ILE 43 N -0.52 0.38 -0.65 2.00 6.09 -1.17 -1.84 117.51 121.81 1i88 h ILE 43 Ca -0.01 -0.57 0.00 0.00 -1.37 0.00 0.00 64.86 62.91 1i88 h ILE 43 Cb 0.78 1.41 0.00 0.00 0.47 0.00 0.00 36.82 39.48 1i88 h ILE 43 CO 0.02 0.10 0.00 0.35 -3.07 0.00 0.00 178.15 175.55 1i88 n THR 44 N -3.42 0.88 -3.79 2.19 -2.24 -0.88 -4.91 114.28 102.12 1i88 n THR 44 Ca -0.01 -0.87 -0.27 0.00 -2.27 0.00 0.00 64.05 60.62 1i88 n THR 44 Cb 0.26 0.43 0.05 0.00 -2.10 0.00 0.00 70.33 68.97 1i88 n THR 44 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1i88 n ASN 45 N 1.39 -5.14 -0.09 3.42 4.13 -0.69 -4.86 115.26 113.41 1i88 n ASN 45 Ca 0.22 -0.70 0.07 0.00 1.68 0.00 0.00 54.58 55.85 1i88 n ASN 45 Cb 0.55 -4.32 0.09 0.00 -1.54 0.00 0.00 39.78 34.57 1i88 n ASN 45 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1i88 n SER 46 N -2.91 1.97 0.29 6.41 7.64 -0.24 -4.79 113.62 121.99 1i88 n SER 46 Ca 0.01 -2.68 0.15 0.00 1.01 0.00 0.00 58.87 57.35 1i88 n SER 46 Cb 0.55 -0.30 0.89 0.00 -1.01 0.00 0.00 64.21 64.34 1i88 n SER 46 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1i88 h GLU 47 N 0.00 0.00 0.00 1.43 4.57 -1.86 -0.02 114.58 118.69 1i88 h GLU 47 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1i88 h GLU 47 Cb 0.93 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.52 1i88 h GLU 47 CO 0.00 0.01 0.00 -2.39 -1.18 0.00 0.00 179.01 175.45 1i88 n HIS 48 N -3.85 0.15 -2.27 0.92 1.44 -1.26 -4.24 115.22 106.11 1i88 n HIS 48 Ca -0.03 0.05 -0.43 0.00 -2.01 0.00 0.00 57.72 55.30 1i88 n HIS 48 Cb 0.10 -0.58 0.00 0.00 0.12 0.00 0.00 29.99 29.63 1i88 n HIS 48 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1i88 n LYS 49 N -1.63 3.30 0.05 -1.40 4.76 -0.02 -4.84 118.16 118.39 1i88 n LYS 49 Ca 0.06 -3.27 -0.11 0.00 -2.87 0.00 0.00 58.31 52.12 1i88 n LYS 49 Cb 0.30 -3.12 -0.05 0.00 -1.84 0.00 0.00 35.03 30.32 1i88 n LYS 49 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1i88 h THR 50 N 4.16 0.78 -0.56 -0.18 2.02 -1.83 -1.36 112.91 115.94 1i88 h THR 50 Ca 0.44 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.55 1i88 h THR 50 Cb 0.70 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 1i88 h THR 50 CO 1.63 0.00 0.06 -0.08 0.37 0.00 0.00 175.52 177.50 1i88 h GLU 51 N -0.16 0.91 -0.39 6.66 4.57 -1.96 -2.16 114.58 122.05 1i88 h GLU 51 Ca 0.03 -0.23 -0.09 0.00 -1.18 0.00 0.00 59.36 57.89 1i88 h GLU 51 Cb 0.19 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 1i88 h GLU 51 CO -0.08 0.87 -0.11 1.25 -1.18 0.00 0.00 179.01 179.76 1i88 h LEU 52 N 0.86 0.67 -0.92 1.64 5.85 -1.90 -1.48 115.31 120.03 1i88 h LEU 52 Ca 0.17 -0.19 -0.09 0.00 0.84 0.00 0.00 57.88 58.62 1i88 h LEU 52 Cb 0.42 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1i88 h LEU 52 CO 0.01 0.81 -0.13 0.50 -0.34 0.00 0.00 178.44 179.29 1i88 h LYS 53 N 0.63 0.65 -0.31 1.25 3.64 -1.02 -0.85 116.57 120.55 1i88 h LYS 53 Ca 0.11 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1i88 h LYS 53 Cb 0.55 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1i88 h LYS 53 CO 0.03 0.76 0.17 0.93 -2.27 0.00 0.00 179.45 179.08 1i88 h GLU 54 N 0.59 0.43 -0.86 1.90 5.08 -0.71 0.27 114.58 121.30 1i88 h GLU 54 Ca 0.10 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1i88 h GLU 54 Cb 0.57 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 1i88 h GLU 54 CO 0.04 0.36 0.52 0.87 -1.00 0.00 0.00 179.01 179.80 1i88 h LYS 55 N 0.39 1.16 -0.45 2.33 1.57 -0.79 -1.47 116.57 119.30 1i88 h LYS 55 Ca 0.11 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.70 1i88 h LYS 55 Cb 0.05 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1i88 h LYS 55 CO -0.02 0.80 -0.06 0.35 -0.57 0.00 0.00 179.45 179.96 1i88 h PHE 56 N 1.17 0.92 -0.76 -1.35 3.57 -0.80 -1.08 116.94 118.62 1i88 h PHE 56 Ca 0.31 -0.18 0.08 0.00 3.53 0.00 0.00 57.97 61.70 1i88 h PHE 56 Cb -0.06 -0.23 -0.06 0.00 2.79 0.00 0.00 35.95 38.38 1i88 h PHE 56 CO -0.00 0.91 0.43 0.37 -2.23 0.00 0.00 178.31 177.79 1i88 h GLN 57 N 0.67 0.73 -0.63 1.11 5.75 -0.01 -0.27 115.11 122.46 1i88 h GLN 57 Ca 0.12 -0.04 -0.07 0.00 -0.15 0.00 0.00 58.65 58.50 1i88 h GLN 57 Cb 0.58 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.94 1i88 h GLN 57 CO 0.03 0.49 0.11 -0.09 -2.65 0.00 0.00 178.83 176.72 1i88 h ARG 58 N 0.76 1.04 -0.54 1.69 2.43 -0.92 0.32 114.38 119.16 1i88 h ARG 58 Ca 0.35 -0.27 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1i88 h ARG 58 Cb 0.27 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1i88 h ARG 58 CO -0.22 0.96 0.33 0.52 -1.51 0.00 0.00 179.97 180.06 1i88 h MET 59 N 0.96 0.74 -0.63 0.20 2.86 -0.61 -0.80 114.93 117.65 1i88 h MET 59 Ca 0.19 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1i88 h MET 59 Cb 0.42 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 1i88 h MET 59 CO 0.01 0.53 0.14 0.00 1.06 0.00 0.00 176.91 178.65 1i88 h ASP 61 N 0.93 0.96 0.84 0.00 3.32 -0.58 -2.72 116.42 119.17 1i88 h ASP 61 Ca 0.20 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1i88 h ASP 61 Cb 0.37 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1i88 h ASP 61 CO 0.00 0.82 -0.37 0.29 -1.72 0.00 0.00 179.24 178.26 1i88 n LYS 62 N -4.32 0.12 0.23 3.56 5.02 -0.34 -4.32 118.16 118.12 1i88 n LYS 62 Ca 0.07 0.05 0.10 0.00 -2.02 0.00 0.00 58.31 56.51 1i88 n LYS 62 Cb 0.14 -1.59 0.65 0.00 -0.02 0.00 0.00 35.03 34.21 1i88 n LYS 62 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1i88 h SER 63 N 0.00 0.00 -1.81 4.39 4.64 -0.88 -3.45 113.55 116.44 1i88 h SER 63 Ca 0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 1i88 h SER 63 Cb 0.60 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.66 1i88 h SER 63 CO 0.00 0.00 -0.35 0.23 -0.87 0.00 0.00 176.83 175.84 1i88 n MET 64 N -4.50 -1.13 -4.43 4.77 2.81 -1.26 -4.43 117.12 108.95 1i88 n MET 64 Ca -0.02 0.76 -0.34 0.00 -1.81 0.00 0.00 57.70 56.30 1i88 n MET 64 Cb 0.15 -5.03 -0.13 0.00 -0.71 0.00 0.00 33.22 27.50 1i88 n MET 64 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1i88 s ILE 65 N -2.69 3.57 -0.10 2.02 1.01 -1.26 -3.53 121.20 120.23 1i88 s ILE 65 Ca 0.00 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.20 1i88 s ILE 65 Cb 0.00 -2.56 -0.25 0.00 0.01 0.00 0.00 42.46 39.66 1i88 s ILE 65 CO 0.00 0.49 0.45 0.29 0.00 0.00 0.00 174.94 176.16 1i88 n LYS 66 N 3.74 0.71 -3.46 2.79 5.02 0.12 -4.67 118.16 122.41 1i88 n LYS 66 Ca -0.18 0.26 -0.11 0.00 -2.02 0.00 0.00 58.31 56.26 1i88 n LYS 66 Cb 0.52 -1.73 -0.02 0.00 -0.02 0.00 0.00 35.03 33.78 1i88 n LYS 66 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1i88 s ARG 67 N -2.57 1.31 0.08 1.97 1.70 -1.06 -0.71 118.95 119.67 1i88 s ARG 67 Ca -0.16 -0.51 0.01 0.00 -0.47 0.00 0.00 55.73 54.60 1i88 s ARG 67 Cb 0.07 0.59 -0.04 0.00 -0.57 0.00 0.00 34.95 35.00 1i88 s ARG 67 CO 0.79 -0.58 -0.06 1.03 -1.08 0.00 0.00 175.30 175.40 1i88 s ARG 68 N -3.75 0.71 -0.13 3.89 0.52 -0.74 -2.99 118.95 116.47 1i88 s ARG 68 Ca 0.02 -1.19 -0.02 0.00 -0.52 0.00 0.00 55.73 54.02 1i88 s ARG 68 Cb -0.01 -0.11 -0.02 0.00 0.52 0.00 0.00 34.95 35.32 1i88 s ARG 68 CO -0.11 -0.03 -0.06 0.71 0.02 0.00 0.00 175.30 175.82 1i88 s TYR 69 N -3.25 2.96 -0.02 -0.53 1.51 -1.26 0.14 117.35 116.90 1i88 s TYR 69 Ca 0.06 -0.32 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1i88 s TYR 69 Cb 0.03 -1.89 0.01 0.00 -0.11 0.00 0.00 41.96 40.01 1i88 s TYR 69 CO -0.05 -0.01 -0.01 -1.64 -1.11 0.00 0.00 175.55 172.73 1i88 s MET 70 N 0.14 0.30 0.18 -0.62 -1.94 -0.39 -1.35 119.30 115.61 1i88 s MET 70 Ca -0.03 -0.01 -0.12 0.00 -1.71 0.00 0.00 55.69 53.83 1i88 s MET 70 Cb -0.14 -0.39 0.08 0.00 2.01 0.00 0.00 34.83 36.39 1i88 s MET 70 CO 0.03 -0.05 1.76 -0.92 -0.01 0.00 0.00 175.02 175.83 1i88 h TYR 71 N 6.76 0.89 -3.31 -0.03 3.20 -1.92 -3.38 116.97 119.18 1i88 h TYR 71 Ca -0.36 -0.05 -0.53 0.00 3.14 0.00 0.00 58.73 60.93 1i88 h TYR 71 Cb 1.16 -0.27 0.06 0.00 1.54 0.00 0.00 36.73 39.21 1i88 h TYR 71 CO 0.47 0.69 0.79 -0.51 -1.64 0.00 0.00 178.16 177.95 1i88 s LEU 72 N -9.84 4.38 0.35 2.82 1.43 -1.26 -5.00 118.68 111.57 1i88 s LEU 72 Ca -0.13 2.69 0.04 0.00 -1.03 0.00 0.00 54.13 55.71 1i88 s LEU 72 Cb 0.13 -3.62 -0.07 0.00 0.03 0.00 0.00 46.19 42.66 1i88 s LEU 72 CO 0.79 -0.74 0.05 0.42 0.23 0.00 0.00 176.35 177.10 1i88 s THR 73 N 0.13 1.36 0.25 5.49 -4.23 -1.26 -5.02 115.64 112.36 1i88 s THR 73 Ca 0.61 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.06 1i88 s THR 73 Cb -0.43 -2.82 0.23 0.00 1.34 0.00 0.00 72.50 70.83 1i88 s THR 73 CO 0.42 0.00 1.88 -0.08 -0.54 0.00 0.00 174.62 176.31 1i88 h GLU 74 N 2.00 1.10 -0.36 3.99 4.81 -1.99 -0.44 114.58 123.69 1i88 h GLU 74 Ca -0.41 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 58.70 1i88 h GLU 74 Cb 1.25 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 1i88 h GLU 74 CO 0.72 0.73 0.03 1.49 -0.73 0.00 0.00 179.01 181.25 1i88 h GLU 75 N 1.14 0.62 -0.63 1.92 4.57 -1.99 -0.35 114.58 119.86 1i88 h GLU 75 Ca 0.37 -0.18 -0.06 0.00 -1.18 0.00 0.00 59.36 58.31 1i88 h GLU 75 Cb 0.04 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.54 1i88 h GLU 75 CO -0.13 0.71 0.15 0.82 -1.18 0.00 0.00 179.01 179.38 1i88 h ILE 76 N 0.45 1.25 -0.34 2.32 2.04 -1.88 -2.62 117.51 118.74 1i88 h ILE 76 Ca 0.11 -0.93 -0.08 0.00 1.00 0.00 0.00 64.86 64.96 1i88 h ILE 76 Cb 0.41 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1i88 h ILE 76 CO 0.01 0.35 -0.13 -0.07 0.00 0.00 0.00 178.15 178.32 1i88 h LEU 77 N 0.93 0.58 -1.66 1.44 3.38 -0.89 -2.52 115.31 116.57 1i88 h LEU 77 Ca 0.20 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1i88 h LEU 77 Cb 0.36 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1i88 h LEU 77 CO 0.00 0.74 -0.18 0.11 0.09 0.00 0.00 178.44 179.20 1i88 h LYS 78 N 0.54 0.00 -0.00 1.13 1.57 -0.73 -1.47 116.57 117.60 1i88 h LYS 78 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1i88 h LYS 78 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1i88 h LYS 78 CO 0.03 0.18 -0.16 0.39 -0.57 0.00 0.00 179.45 179.33 1i88 n GLU 79 N -3.71 0.61 -3.23 3.15 1.02 -0.97 -4.36 120.64 113.15 1i88 n GLU 79 Ca -0.02 -0.24 -0.24 0.00 -0.02 0.00 0.00 57.16 56.64 1i88 n GLU 79 Cb 0.30 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.16 1i88 n GLU 79 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1i88 n ASN 80 N -0.98 1.34 0.18 1.62 3.02 -0.56 -4.94 115.26 114.93 1i88 n ASN 80 Ca 0.13 -2.97 0.14 0.00 -0.03 0.00 0.00 54.58 51.86 1i88 n ASN 80 Cb 0.30 -0.64 0.73 0.00 -0.61 0.00 0.00 39.78 39.56 1i88 n ASN 80 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1i88 h PRO 81 N 3.85 0.00 0.00 3.52 0.13 -1.76 -0.75 132.00 136.98 1i88 h PRO 81 Ca 0.11 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.17 1i88 h PRO 81 Cb 0.82 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 1i88 h PRO 81 CO 0.57 0.00 -0.30 -0.91 -0.23 0.00 0.00 178.00 177.13 1i88 h ASN 82 N 0.00 0.00 1.16 1.44 -0.26 -1.91 -1.82 115.58 114.20 1i88 h ASN 82 Ca 0.09 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.73 1i88 h ASN 82 Cb 0.40 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.65 1i88 h ASN 82 CO -0.00 0.30 -0.46 0.58 -1.06 0.00 0.00 177.43 176.79 1i88 h VAL 83 N 0.00 0.89 0.00 2.81 2.07 -1.46 -3.20 116.25 117.36 1i88 h VAL 83 Ca -0.00 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.59 1i88 h VAL 83 Cb 0.62 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 1i88 h VAL 83 CO 0.04 0.45 0.00 0.00 0.02 0.00 0.00 177.57 178.08 1i88 s GLU 85 N -3.18 3.34 0.17 0.00 2.02 -0.98 -2.43 118.70 117.63 1i88 s GLU 85 Ca 0.08 1.08 -0.14 0.00 0.02 0.00 0.00 54.97 56.01 1i88 s GLU 85 Cb 0.07 -2.04 0.06 0.00 0.10 0.00 0.00 34.13 32.32 1i88 s GLU 85 CO 0.64 -0.79 1.81 -0.92 0.02 0.00 0.00 175.26 176.03 1i88 h TYR 86 N 0.19 0.68 -2.00 1.61 3.20 -1.86 -2.25 116.97 116.55 1i88 h TYR 86 Ca -0.46 0.00 -0.42 0.00 3.14 0.00 0.00 58.73 60.99 1i88 h TYR 86 Cb 1.21 -0.22 -0.32 0.00 1.54 0.00 0.00 36.73 38.94 1i88 h TYR 86 CO 0.61 0.46 -0.76 1.41 -1.64 0.00 0.00 178.16 178.24 1i88 s MET 87 N -6.03 0.77 0.06 1.82 1.75 -1.26 -4.59 119.30 111.81 1i88 s MET 87 Ca -0.13 -1.30 0.04 0.00 -1.25 0.00 0.00 55.69 53.05 1i88 s MET 87 Cb 0.12 -0.89 -0.03 0.00 2.84 0.00 0.00 34.83 36.88 1i88 s MET 87 CO 0.75 -1.27 -0.11 0.00 -0.65 0.00 0.00 175.02 173.74 1i88 s ALA 88 N 0.92 0.89 -0.05 4.11 0.00 -1.26 -5.06 121.76 121.32 1i88 s ALA 88 Ca 0.23 -0.88 -0.34 0.00 0.00 0.00 0.00 51.96 50.98 1i88 s ALA 88 Cb -0.09 -0.04 -0.12 0.00 0.00 0.00 0.00 23.12 22.87 1i88 s ALA 88 CO -0.07 0.08 1.84 -2.30 0.00 0.00 0.00 175.76 175.32 1i88 n PRO 89 N 1.41 2.20 0.00 0.00 -0.02 -1.26 -4.30 135.00 133.04 1i88 n PRO 89 Ca -0.22 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1i88 n PRO 89 Cb 0.54 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 1i88 n PRO 89 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1i88 n SER 90 N 6.23 0.00 -0.29 2.55 3.41 0.05 -4.86 113.62 120.72 1i88 n SER 90 Ca 0.22 -0.95 -0.05 0.00 -0.26 0.00 0.00 58.87 57.82 1i88 n SER 90 Cb 0.30 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.31 1i88 n SER 90 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1i88 h LEU 91 N 0.00 1.06 -0.72 1.04 5.85 -1.22 -1.78 115.31 119.55 1i88 h LEU 91 Ca 0.00 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1i88 h LEU 91 Cb 0.83 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1i88 h LEU 91 CO 0.00 0.92 0.47 0.44 -0.34 0.00 0.00 178.44 179.93 1i88 h ASP 92 N 1.14 0.82 -0.45 1.25 3.32 -1.94 0.27 116.42 120.83 1i88 h ASP 92 Ca 0.27 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.17 1i88 h ASP 92 Cb 0.15 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1i88 h ASP 92 CO -0.03 0.59 -0.22 0.00 -1.72 0.00 0.00 179.24 177.85 1i88 h ALA 93 N 1.27 0.71 -0.35 3.45 0.00 -1.89 -1.30 119.26 121.15 1i88 h ALA 93 Ca 0.27 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1i88 h ALA 93 Cb -0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1i88 h ALA 93 CO -0.06 0.67 -0.04 0.00 0.00 0.00 0.00 179.25 179.81 1i88 h ARG 94 N 0.84 0.65 -0.80 0.00 3.08 -0.76 -2.89 114.38 114.50 1i88 h ARG 94 Ca 0.11 -0.23 0.02 0.00 0.07 0.00 0.00 59.98 59.95 1i88 h ARG 94 Cb 0.80 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 1i88 h ARG 94 CO 0.07 0.79 0.52 1.96 -1.07 0.00 0.00 179.97 182.23 1i88 h GLN 95 N 0.45 1.00 -0.53 0.04 1.08 -0.37 -1.18 115.11 115.60 1i88 h GLN 95 Ca 0.09 -0.06 0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1i88 h GLN 95 Cb 0.53 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.70 1i88 h GLN 95 CO 0.03 0.66 0.35 -0.44 -0.95 0.00 0.00 178.83 178.48 1i88 h ASP 96 N 1.03 0.51 0.19 1.46 3.32 -1.10 0.13 116.42 121.96 1i88 h ASP 96 Ca 0.31 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 1i88 h ASP 96 Cb -0.04 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.39 1i88 h ASP 96 CO -0.09 0.35 -0.09 0.24 -1.72 0.00 0.00 179.24 177.92 1i88 h MET 97 N 0.59 -0.25 0.00 3.56 2.86 -1.18 -3.37 114.93 117.14 1i88 h MET 97 Ca 0.22 0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.79 1i88 h MET 97 Cb 0.12 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1i88 h MET 97 CO -0.06 0.15 -0.40 -0.39 1.06 0.00 0.00 176.91 177.28 1i88 h VAL 98 N -0.79 0.74 0.00 -2.22 -1.51 -0.81 -0.70 116.25 110.96 1i88 h VAL 98 Ca -0.03 -1.83 -0.04 0.00 -1.23 0.00 0.00 66.70 63.57 1i88 h VAL 98 Cb 0.52 2.20 -0.01 0.00 -2.13 0.00 0.00 31.29 31.87 1i88 h VAL 98 CO 0.04 0.39 -0.20 0.58 -1.23 0.00 0.00 177.57 177.15 1i88 h VAL 99 N 0.00 1.08 0.01 7.19 2.07 -1.15 -1.12 116.25 124.32 1i88 h VAL 99 Ca -0.00 -0.72 -0.24 0.00 0.82 0.00 0.00 66.70 66.55 1i88 h VAL 99 Cb 1.17 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 32.30 1i88 h VAL 99 CO 0.05 0.20 -1.33 0.58 0.02 0.00 0.00 177.57 177.10 1i88 h VAL 100 N 0.00 0.89 -0.20 2.57 2.07 -1.68 -3.41 116.25 116.49 1i88 h VAL 100 Ca -0.00 -2.19 -0.09 0.00 0.82 0.00 0.00 66.70 65.23 1i88 h VAL 100 Cb 0.38 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1i88 h VAL 100 CO 0.03 0.36 -0.28 -0.08 0.02 0.00 0.00 177.57 177.61 1i88 h GLU 101 N -0.91 0.39 0.19 1.57 4.57 -1.02 -1.99 114.58 117.37 1i88 h GLU 101 Ca -0.36 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 57.66 1i88 h GLU 101 Cb 1.37 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.94 1i88 h GLU 101 CO -0.19 0.64 -0.09 0.28 -1.18 0.00 0.00 179.01 178.48 1i88 h VAL 102 N 0.34 0.83 -0.06 0.32 2.07 -1.45 -0.63 116.25 117.68 1i88 h VAL 102 Ca 0.05 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.38 1i88 h VAL 102 Cb 0.68 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1i88 h VAL 102 CO 0.05 0.02 -0.38 1.55 0.02 0.00 0.00 177.57 178.83 1i88 h PRO 103 N -0.30 0.11 -0.12 1.57 0.13 -1.77 -1.18 132.00 130.44 1i88 h PRO 103 Ca -0.03 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1i88 h PRO 103 Cb 0.23 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 1i88 h PRO 103 CO 0.04 0.48 0.05 -0.09 -0.23 0.00 0.00 178.00 178.26 1i88 h ARG 104 N 0.10 0.17 -0.42 0.86 2.43 -0.99 0.10 114.38 116.63 1i88 h ARG 104 Ca 0.01 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.01 1i88 h ARG 104 Cb 0.72 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 1i88 h ARG 104 CO 0.05 0.25 -0.30 1.25 -1.51 0.00 0.00 179.97 179.72 1i88 h LEU 105 N 0.05 0.96 -0.86 3.80 5.85 -1.04 -2.61 115.31 121.46 1i88 h LEU 105 Ca 0.04 -0.40 0.01 0.00 0.84 0.00 0.00 57.88 58.37 1i88 h LEU 105 Cb 0.14 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1i88 h LEU 105 CO -0.00 1.18 0.56 1.23 -0.34 0.00 0.00 178.44 181.07 1i88 h GLY 106 N 0.86 1.22 0.81 3.75 0.00 -1.03 -2.42 103.07 106.27 1i88 h GLY 106 Ca 0.08 -0.47 0.03 0.00 0.00 0.00 0.00 47.33 46.98 1i88 h GLY 106 CO 0.08 0.46 0.21 1.70 0.00 0.00 0.00 176.54 178.98 1i88 h LYS 107 N 1.17 0.40 -0.43 4.80 3.64 -0.44 0.68 116.57 126.39 1i88 h LYS 107 Ca 0.31 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.72 1i88 h LYS 107 Cb -0.12 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.57 1i88 h LYS 107 CO -0.07 0.27 0.18 0.93 -2.27 0.00 0.00 179.45 178.49 1i88 h GLU 108 N 0.42 0.35 -0.50 1.90 5.08 -1.11 0.03 114.58 120.75 1i88 h GLU 108 Ca 0.17 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.38 1i88 h GLU 108 Cb 0.07 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1i88 h GLU 108 CO -0.11 0.23 -0.19 0.00 -1.00 0.00 0.00 179.01 177.94 1i88 h ALA 109 N 1.26 0.69 -0.57 3.43 0.00 -1.09 -2.30 119.26 120.69 1i88 h ALA 109 Ca 0.19 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1i88 h ALA 109 Cb 0.15 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1i88 h ALA 109 CO -0.17 0.67 0.19 0.00 0.00 0.00 0.00 179.25 179.93 1i88 h ALA 110 N 0.88 0.74 -0.84 0.00 0.00 -0.48 -0.92 119.26 118.64 1i88 h ALA 110 Ca 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1i88 h ALA 110 Cb 0.77 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1i88 h ALA 110 CO 0.06 0.40 0.49 0.28 0.00 0.00 0.00 179.25 180.48 1i88 h VAL 111 N 0.79 1.24 -0.34 0.00 2.07 -0.50 0.45 116.25 119.95 1i88 h VAL 111 Ca 0.18 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1i88 h VAL 111 Cb 0.27 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1i88 h VAL 111 CO -0.01 0.25 0.16 0.11 0.02 0.00 0.00 177.57 178.10 1i88 h LYS 112 N 1.16 0.49 -0.55 1.57 1.57 -1.07 -0.46 116.57 119.29 1i88 h LYS 112 Ca 0.30 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.96 1i88 h LYS 112 Cb -0.02 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 1i88 h LYS 112 CO -0.05 0.46 0.19 0.00 -0.57 0.00 0.00 179.45 179.48 1i88 h ALA 113 N 1.01 0.71 -0.68 3.86 0.00 -0.75 -2.08 119.26 121.33 1i88 h ALA 113 Ca 0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1i88 h ALA 113 Cb 0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1i88 h ALA 113 CO -0.01 0.36 0.24 0.82 0.00 0.00 0.00 179.25 180.66 1i88 h ILE 114 N 0.75 1.24 -0.40 0.00 2.04 -0.77 -0.23 117.51 120.14 1i88 h ILE 114 Ca 0.18 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1i88 h ILE 114 Cb 0.25 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1i88 h ILE 114 CO -0.01 0.31 0.25 0.50 0.00 0.00 0.00 178.15 179.21 1i88 h LYS 115 N 0.99 0.54 -0.25 2.37 3.64 -0.84 -0.55 116.57 122.47 1i88 h LYS 115 Ca 0.23 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 1i88 h LYS 115 Cb 0.23 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1i88 h LYS 115 CO -0.01 0.38 0.11 1.49 -2.27 0.00 0.00 179.45 179.15 1i88 h GLU 116 N 0.54 0.37 -0.62 1.90 4.81 -1.09 -2.82 114.58 117.67 1i88 h GLU 116 Ca 0.15 -0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.39 1i88 h GLU 116 Cb -0.02 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.23 1i88 h GLU 116 CO -0.03 0.38 0.30 2.35 -0.73 0.00 0.00 179.01 181.28 1i88 h TRP 117 N 0.27 0.55 0.00 0.92 7.01 -0.76 -3.46 115.95 120.48 1i88 h TRP 117 Ca 0.09 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.11 1i88 h TRP 117 Cb 0.14 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.05 1i88 h TRP 117 CO -0.02 0.22 0.00 0.41 -2.79 0.00 0.00 178.44 176.27 1i88 n GLY 118 N -1.28 1.38 3.95 2.65 0.00 -0.24 -4.87 105.19 106.77 1i88 n GLY 118 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1i88 n GLY 118 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1i88 s GLN 119 N -0.39 3.33 0.35 1.61 -1.52 -1.26 -5.07 119.66 116.71 1i88 s GLN 119 Ca 0.00 -0.83 -0.29 0.00 -1.95 0.00 0.00 55.36 52.29 1i88 s GLN 119 Cb 0.00 -2.83 -0.11 0.00 -0.22 0.00 0.00 33.01 29.85 1i88 s GLN 119 CO 0.00 0.39 1.51 -2.14 -0.25 0.00 0.00 175.29 174.80 1i88 s PRO 120 N -3.98 4.12 0.00 2.91 0.02 -1.26 -4.88 135.00 131.92 1i88 s PRO 120 Ca 0.35 2.57 0.14 0.00 0.02 0.00 0.00 61.00 64.08 1i88 s PRO 120 Cb -0.09 -2.98 0.68 0.00 0.02 0.00 0.00 34.50 32.13 1i88 s PRO 120 CO 0.29 -0.55 1.42 0.36 -0.33 0.00 0.00 177.00 178.18 1i88 n LYS 121 N 0.89 0.12 0.10 5.54 2.85 -1.26 -1.17 118.16 125.24 1i88 n LYS 121 Ca 0.03 0.19 0.11 0.00 -1.05 0.00 0.00 58.31 57.59 1i88 n LYS 121 Cb 0.39 -1.50 0.46 0.00 -0.65 0.00 0.00 35.03 33.72 1i88 n LYS 121 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1i88 n SER 122 N -1.37 0.56 -0.25 -5.58 3.41 -1.26 -1.50 113.62 107.62 1i88 n SER 122 Ca 0.05 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.42 1i88 n SER 122 Cb 0.14 -0.75 0.43 0.00 -0.26 0.00 0.00 64.21 63.76 1i88 n SER 122 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1i88 n LYS 123 N -2.10 0.90 -2.50 4.33 5.02 -0.32 -4.80 118.16 118.70 1i88 n LYS 123 Ca 0.03 -0.50 -0.43 0.00 -2.02 0.00 0.00 58.31 55.38 1i88 n LYS 123 Cb 0.24 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.74 1i88 n LYS 123 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1i88 s ILE 124 N -2.44 4.33 -0.13 -0.18 1.01 -0.56 -4.22 121.20 119.01 1i88 s ILE 124 Ca 0.26 1.57 0.19 0.00 0.00 0.00 0.00 60.65 62.67 1i88 s ILE 124 Cb 0.20 -4.17 -0.28 0.00 0.01 0.00 0.00 42.46 38.22 1i88 s ILE 124 CO 0.49 -0.32 0.26 0.35 0.00 0.00 0.00 174.94 175.73 1i88 n THR 125 N 5.73 0.86 -4.08 2.92 -2.24 -0.22 -4.76 114.28 112.50 1i88 n THR 125 Ca 0.14 -0.72 -0.14 0.00 -2.27 0.00 0.00 64.05 61.06 1i88 n THR 125 Cb 0.46 -0.30 -0.12 0.00 -2.10 0.00 0.00 70.33 68.27 1i88 n THR 125 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1i88 s HIS 126 N -2.89 0.61 -0.06 4.78 3.76 -1.04 -1.13 115.29 119.32 1i88 s HIS 126 Ca -0.09 -0.40 -0.00 0.00 -0.15 0.00 0.00 55.06 54.42 1i88 s HIS 126 Cb 0.09 -0.37 0.03 0.00 1.11 0.00 0.00 32.58 33.44 1i88 s HIS 126 CO 0.86 -0.07 -0.01 -1.17 -0.85 0.00 0.00 174.74 173.50 1i88 s LEU 127 N -1.23 0.87 -0.19 0.89 2.96 0.54 -1.15 118.68 121.37 1i88 s LEU 127 Ca -0.07 -0.09 -0.04 0.00 -0.22 0.00 0.00 54.13 53.70 1i88 s LEU 127 Cb -0.08 -0.43 -0.02 0.00 0.50 0.00 0.00 46.19 46.16 1i88 s LEU 127 CO 0.00 -0.14 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.23 1i88 s ILE 128 N 1.57 3.76 -0.10 6.68 1.01 0.10 -0.67 121.20 133.56 1i88 s ILE 128 Ca -0.01 -0.38 0.04 0.00 0.00 0.00 0.00 60.65 60.29 1i88 s ILE 128 Cb -0.13 -2.69 0.00 0.00 0.01 0.00 0.00 42.46 39.66 1i88 s ILE 128 CO -0.03 0.45 -0.22 -0.69 0.00 0.00 0.00 174.94 174.44 1i88 s VAL 129 N 0.92 1.91 -0.03 2.92 1.01 -0.60 -0.50 120.40 126.03 1i88 s VAL 129 Ca 0.00 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.08 1i88 s VAL 129 Cb -0.14 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1i88 s VAL 129 CO 0.01 0.53 -0.12 0.00 0.00 0.00 0.00 175.10 175.52 1i88 s THR 131 N 0.20 0.05 -0.47 0.00 -1.32 -0.56 -1.26 115.64 112.26 1i88 s THR 131 Ca -0.04 -0.39 0.05 0.00 -1.21 0.00 0.00 61.69 60.10 1i88 s THR 131 Cb -0.10 -1.01 0.14 0.00 -1.51 0.00 0.00 72.50 70.02 1i88 s THR 131 CO 0.01 -0.21 1.08 0.41 -2.21 0.00 0.00 174.62 173.70 1i88 n THR 132 N 0.28 0.90 -3.76 5.08 -1.04 -1.26 -1.58 114.28 112.89 1i88 n THR 132 Ca -0.18 -0.95 -0.34 0.00 -2.04 0.00 0.00 64.05 60.54 1i88 n THR 132 Cb 0.61 0.56 -0.10 0.00 -1.82 0.00 0.00 70.33 69.58 1i88 n THR 132 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1i88 s SER 133 N -0.94 5.21 0.00 8.00 0.01 -1.26 -4.76 113.70 119.96 1i88 s SER 133 Ca 0.11 -3.29 0.00 0.00 1.31 0.00 0.00 55.95 54.08 1i88 s SER 133 Cb 0.06 -1.80 0.00 0.00 0.21 0.00 0.00 66.02 64.49 1i88 s SER 133 CO 0.08 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.09 1i88 n GLY 134 N 2.85 -0.95 3.10 3.44 0.00 -1.26 -4.74 105.19 107.63 1i88 n GLY 134 Ca 0.13 -1.62 -0.10 0.00 0.00 0.00 0.00 46.02 44.43 1i88 n GLY 134 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1i88 s VAL 135 N -2.67 0.11 0.09 1.61 -7.23 -1.26 -4.72 120.40 106.32 1i88 s VAL 135 Ca 0.00 -0.90 -0.26 0.00 -1.81 0.00 0.00 61.98 59.01 1i88 s VAL 135 Cb 0.00 -0.63 0.08 0.00 0.56 0.00 0.00 36.38 36.39 1i88 s VAL 135 CO 0.00 -0.50 0.83 -0.62 -0.31 0.00 0.00 175.10 174.50 1i88 s ASP 136 N -1.74 -0.36 0.01 4.85 2.15 -1.26 -4.97 116.67 115.35 1i88 s ASP 136 Ca -0.10 -0.13 0.06 0.00 0.43 0.00 0.00 52.55 52.80 1i88 s ASP 136 Cb -0.05 0.48 -0.02 0.00 -0.30 0.00 0.00 42.92 43.03 1i88 s ASP 136 CO -0.02 -0.81 -0.17 -0.04 -0.17 0.00 0.00 175.17 173.96 1i88 s MET 137 N -3.35 1.26 0.09 4.34 -1.94 -1.26 -2.98 119.30 115.45 1i88 s MET 137 Ca 0.06 -0.72 -0.07 0.00 -1.71 0.00 0.00 55.69 53.25 1i88 s MET 137 Cb -0.01 -1.27 -0.05 0.00 2.01 0.00 0.00 34.83 35.51 1i88 s MET 137 CO -0.06 0.33 0.09 -2.30 -0.01 0.00 0.00 175.02 173.07 1i88 n PRO 138 N 2.29 0.00 -0.34 2.03 -0.02 -1.26 -5.15 135.00 132.55 1i88 n PRO 138 Ca -0.16 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.27 1i88 n PRO 138 Cb 0.54 -0.30 0.04 0.00 -0.02 0.00 0.00 33.50 33.75 1i88 n PRO 138 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i88 n GLY 139 N 0.66 -1.17 0.25 -1.23 0.00 -1.16 -4.86 105.19 97.68 1i88 n GLY 139 Ca 0.04 -1.68 0.11 0.00 0.00 0.00 0.00 46.02 44.49 1i88 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i88 h ALA 140 N -1.94 1.29 -0.35 4.61 0.00 -1.93 -1.67 119.26 119.26 1i88 h ALA 140 Ca -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1i88 h ALA 140 Cb 0.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1i88 h ALA 140 CO 0.05 0.20 0.18 0.38 0.00 0.00 0.00 179.25 180.06 1i88 h ASP 141 N 0.00 0.45 -0.24 0.00 2.03 -1.92 0.53 116.42 117.27 1i88 h ASP 141 Ca -0.00 -0.11 -0.00 0.00 -0.73 0.00 0.00 57.03 56.18 1i88 h ASP 141 Cb 0.42 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 38.79 1i88 h ASP 141 CO 0.02 0.44 0.14 0.22 -1.03 0.00 0.00 179.24 179.03 1i88 h TYR 142 N 0.44 0.31 -0.83 4.15 3.20 -1.68 -1.46 116.97 121.10 1i88 h TYR 142 Ca 0.12 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.03 1i88 h TYR 142 Cb 0.10 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.21 1i88 h TYR 142 CO -0.02 0.24 0.52 1.96 -1.64 0.00 0.00 178.16 179.22 1i88 h GLN 143 N 0.29 0.97 -0.30 1.82 1.08 -1.18 -1.51 115.11 116.28 1i88 h GLN 143 Ca 0.08 -0.06 -0.13 0.00 -1.45 0.00 0.00 58.65 57.10 1i88 h GLN 143 Cb 0.02 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.22 1i88 h GLN 143 CO -0.02 0.64 -0.35 -0.07 -0.95 0.00 0.00 178.83 178.09 1i88 h LEU 144 N 1.00 0.71 -0.18 1.46 3.38 -0.72 0.95 115.31 121.92 1i88 h LEU 144 Ca 0.34 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1i88 h LEU 144 Cb 0.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1i88 h LEU 144 CO -0.13 0.99 -0.02 0.74 0.09 0.00 0.00 178.44 180.11 1i88 h THR 145 N 0.57 0.85 -0.15 0.22 2.02 -0.83 -0.34 112.91 115.24 1i88 h THR 145 Ca 0.06 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 1i88 h THR 145 Cb 0.86 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.08 1i88 h THR 145 CO 0.07 0.01 0.06 0.50 0.37 0.00 0.00 175.52 176.52 1i88 h LYS 146 N 0.03 0.23 -0.54 6.66 3.64 -1.05 -1.40 116.57 124.14 1i88 h LYS 146 Ca 0.08 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 1i88 h LYS 146 Cb 0.12 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1i88 h LYS 146 CO -0.16 0.33 0.08 -0.07 -2.27 0.00 0.00 179.45 177.36 1i88 h LEU 147 N 0.08 0.82 0.00 5.20 3.38 -0.66 -2.92 115.31 121.21 1i88 h LEU 147 Ca 0.05 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1i88 h LEU 147 Cb 0.19 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1i88 h LEU 147 CO -0.00 0.84 -0.67 0.18 0.09 0.00 0.00 178.44 178.88 1i88 n LEU 148 N -4.24 0.67 -1.55 1.67 4.77 -0.15 -4.97 117.00 113.20 1i88 n LEU 148 Ca 0.03 0.18 -0.09 0.00 -0.03 0.00 0.00 56.01 56.11 1i88 n LEU 148 Cb 0.27 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1i88 n LEU 148 CO 0.41 -0.03 0.05 0.61 -1.33 0.00 0.00 177.39 177.11 1i88 n GLY 149 N 1.35 0.29 3.76 -0.72 0.00 -0.61 -5.03 105.19 104.24 1i88 n GLY 149 Ca 0.03 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 1i88 n GLY 149 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i88 s LEU 150 N -3.25 2.79 0.62 0.99 1.43 -0.73 -4.86 118.68 115.67 1i88 s LEU 150 Ca 0.18 1.67 -0.19 0.00 -1.03 0.00 0.00 54.13 54.77 1i88 s LEU 150 Cb -0.08 -4.30 -0.02 0.00 0.03 0.00 0.00 46.19 41.82 1i88 s LEU 150 CO 0.23 -2.15 1.30 -0.13 0.23 0.00 0.00 176.35 175.82 1i88 s ARG 151 N -4.94 2.70 0.57 1.70 1.81 -1.26 -4.87 118.95 114.66 1i88 s ARG 151 Ca 0.61 2.07 0.34 0.00 -1.72 0.00 0.00 55.73 57.04 1i88 s ARG 151 Cb -0.17 -1.92 1.70 0.00 -0.45 0.00 0.00 34.95 34.11 1i88 s ARG 151 CO 0.56 -1.49 2.13 -1.00 -0.68 0.00 0.00 175.30 174.82 1i88 h PRO 152 N 0.74 0.00 -0.65 3.54 0.13 -1.95 -1.91 132.00 131.90 1i88 h PRO 152 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1i88 h PRO 152 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1i88 h PRO 152 CO 0.54 0.05 0.00 2.48 -0.23 0.00 0.00 178.00 180.84 1i88 n TYR 153 N -3.31 1.28 -1.86 1.56 0.18 -1.26 -4.93 117.16 108.81 1i88 n TYR 153 Ca -0.01 -0.48 -0.41 0.00 1.88 0.00 0.00 57.90 58.88 1i88 n TYR 153 Cb 0.21 -0.27 -0.01 0.00 -0.38 0.00 0.00 39.34 38.88 1i88 n TYR 153 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1i88 s VAL 154 N -1.97 2.25 -0.33 -3.48 0.11 -0.72 -4.94 120.40 111.33 1i88 s VAL 154 Ca 0.39 0.22 -0.23 0.00 -2.93 0.00 0.00 61.98 59.43 1i88 s VAL 154 Cb 0.27 -3.14 0.00 0.00 -1.53 0.00 0.00 36.38 31.98 1i88 s VAL 154 CO 0.16 0.04 0.78 -0.54 -3.33 0.00 0.00 175.10 172.21 1i88 s LYS 155 N -0.88 3.87 -0.00 1.54 1.02 -0.28 -4.88 119.74 120.12 1i88 s LYS 155 Ca 0.59 0.45 0.00 0.00 0.02 0.00 0.00 55.97 57.03 1i88 s LYS 155 Cb -0.46 -3.76 -0.04 0.00 -0.52 0.00 0.00 37.83 33.05 1i88 s LYS 155 CO 0.50 -0.75 0.06 1.03 -0.92 0.00 0.00 175.35 175.28 1i88 s ARG 156 N 3.00 3.01 -0.28 1.68 0.52 -1.26 -0.34 118.95 125.28 1i88 s ARG 156 Ca 0.32 -0.51 -0.01 0.00 -0.52 0.00 0.00 55.73 55.00 1i88 s ARG 156 Cb -0.14 -2.82 0.09 0.00 0.52 0.00 0.00 34.95 32.60 1i88 s ARG 156 CO 0.14 0.64 0.08 0.71 0.02 0.00 0.00 175.30 176.89 1i88 s TYR 157 N -1.18 1.57 -0.46 -0.53 1.51 0.16 -4.94 117.35 113.47 1i88 s TYR 157 Ca 0.22 -1.53 -0.17 0.00 -1.01 0.00 0.00 57.07 54.58 1i88 s TYR 157 Cb -0.12 -1.54 0.05 0.00 -0.11 0.00 0.00 41.96 40.24 1i88 s TYR 157 CO 0.13 -0.82 0.45 1.41 -1.11 0.00 0.00 175.55 175.62 1i88 s MET 158 N 1.67 3.04 -0.57 -0.62 1.75 -1.26 -1.55 119.30 121.76 1i88 s MET 158 Ca 0.07 -1.07 -0.14 0.00 -1.25 0.00 0.00 55.69 53.30 1i88 s MET 158 Cb -0.17 -4.07 0.14 0.00 2.84 0.00 0.00 34.83 33.57 1i88 s MET 158 CO -0.21 -1.01 0.50 -1.64 -0.65 0.00 0.00 175.02 172.01 1i88 s MET 159 N 2.01 2.93 0.13 4.11 -1.94 0.51 -5.00 119.30 122.05 1i88 s MET 159 Ca 0.09 -1.85 0.03 0.00 -1.71 0.00 0.00 55.69 52.25 1i88 s MET 159 Cb -0.21 -4.21 -0.04 0.00 2.01 0.00 0.00 34.83 32.39 1i88 s MET 159 CO 0.10 -1.29 0.16 0.71 -0.01 0.00 0.00 175.02 174.69 1i88 s TYR 160 N 1.29 3.27 -1.43 -0.03 2.02 -1.26 -1.50 117.35 119.71 1i88 s TYR 160 Ca 0.06 0.06 -0.02 0.00 -0.37 0.00 0.00 57.07 56.80 1i88 s TYR 160 Cb -0.26 -1.60 0.02 0.00 -0.40 0.00 0.00 41.96 39.72 1i88 s TYR 160 CO 0.00 0.53 0.47 0.94 -1.57 0.00 0.00 175.55 175.92 1i88 n GLN 161 N -0.13 -3.39 -0.06 -0.62 -0.06 -0.62 -4.91 117.38 107.59 1i88 n GLN 161 Ca -0.08 0.41 -0.18 0.00 -2.00 0.00 0.00 57.00 55.15 1i88 n GLN 161 Cb 0.53 -4.62 -0.13 0.00 -4.06 0.00 0.00 30.24 21.97 1i88 n GLN 161 CO 0.00 0.00 0.00 1.96 -0.20 0.00 0.00 177.06 178.82 1i88 h GLN 162 N -1.82 0.05 0.00 3.69 1.08 -1.82 -3.49 115.11 112.81 1i88 h GLN 162 Ca -0.63 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 56.48 1i88 h GLN 162 Cb 1.38 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.84 1i88 h GLN 162 CO 0.64 1.04 0.00 0.41 -0.95 0.00 0.00 178.83 179.97 1i88 n GLY 163 N 1.57 1.08 0.61 3.46 0.00 -1.26 -4.75 105.19 105.90 1i88 n GLY 163 Ca -0.21 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1i88 n GLY 163 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1i88 n PHE 165 N 0.00 0.00 1.06 1.61 1.16 -1.14 -4.24 117.46 115.90 1i88 n PHE 165 Ca 0.00 0.00 0.11 0.00 -1.87 0.00 0.00 57.45 55.69 1i88 n PHE 165 Cb 0.00 -0.13 0.56 0.00 -1.61 0.00 0.00 39.48 38.31 1i88 n PHE 165 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1i88 n ALA 166 N 0.15 2.15 -0.34 1.98 0.00 -1.26 -1.74 120.51 121.45 1i88 n ALA 166 Ca 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 53.44 53.30 1i88 n ALA 166 Cb 0.00 -1.36 0.09 0.00 0.00 0.00 0.00 19.45 18.18 1i88 n ALA 166 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1i88 h GLY 167 N 3.69 1.32 0.75 0.00 0.00 -1.83 -0.65 103.07 106.36 1i88 h GLY 167 Ca 0.00 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1i88 h GLY 167 CO 0.00 0.53 0.00 -1.33 0.00 0.00 0.00 176.54 175.74 1i88 h GLY 168 N 1.25 0.16 0.39 4.60 0.00 -1.64 -3.12 103.07 104.70 1i88 h GLY 168 Ca 0.33 -0.12 0.09 0.00 0.00 0.00 0.00 47.33 47.62 1i88 h GLY 168 CO -0.06 0.11 0.15 -0.84 0.00 0.00 0.00 176.54 175.90 1i88 h THR 169 N -0.12 0.75 -0.19 4.70 2.02 -1.43 -0.46 112.91 118.18 1i88 h THR 169 Ca 0.02 -0.10 -0.08 0.00 0.77 0.00 0.00 66.41 67.02 1i88 h THR 169 Cb 0.34 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1i88 h THR 169 CO 0.00 0.06 -0.22 -0.37 0.37 0.00 0.00 175.52 175.36 1i88 h VAL 170 N 0.30 1.24 -0.35 3.16 -1.51 -1.17 -0.16 116.25 117.77 1i88 h VAL 170 Ca 0.27 -1.12 -0.09 0.00 -1.23 0.00 0.00 66.70 64.53 1i88 h VAL 170 Cb 0.34 1.34 -0.01 0.00 -2.13 0.00 0.00 31.29 30.83 1i88 h VAL 170 CO -0.31 0.35 -0.14 -0.07 -1.23 0.00 0.00 177.57 176.17 1i88 h LEU 171 N 0.31 0.73 -0.78 4.19 3.38 -1.31 0.33 115.31 122.16 1i88 h LEU 171 Ca 0.05 -0.39 0.03 0.00 0.09 0.00 0.00 57.88 57.66 1i88 h LEU 171 Cb 0.57 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 1i88 h LEU 171 CO 0.04 0.96 0.49 -0.09 0.09 0.00 0.00 178.44 179.93 1i88 h ARG 172 N 0.50 0.94 -0.03 1.13 2.43 -0.70 0.02 114.38 118.67 1i88 h ARG 172 Ca 0.08 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1i88 h ARG 172 Cb 0.67 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1i88 h ARG 172 CO 0.05 0.62 -0.02 1.25 -1.51 0.00 0.00 179.97 180.35 1i88 h LEU 173 N 0.96 0.07 -1.42 3.80 5.85 -0.98 -3.23 115.31 120.37 1i88 h LEU 173 Ca 0.31 -0.47 0.05 0.00 0.84 0.00 0.00 57.88 58.61 1i88 h LEU 173 Cb 0.01 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1i88 h LEU 173 CO -0.11 0.52 0.44 0.00 -0.34 0.00 0.00 178.44 178.95 1i88 h ALA 174 N 0.55 1.69 -0.34 1.25 0.00 -0.63 -2.19 119.26 119.60 1i88 h ALA 174 Ca 0.00 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1i88 h ALA 174 Cb 0.50 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1i88 h ALA 174 CO 0.01 0.22 0.11 -0.22 0.00 0.00 0.00 179.25 179.36 1i88 h LYS 175 N 0.73 0.24 -0.31 0.00 3.64 -1.01 -1.05 116.57 118.81 1i88 h LYS 175 Ca 0.28 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.51 1i88 h LYS 175 Cb 0.17 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1i88 h LYS 175 CO -0.08 0.16 -0.35 -0.44 -2.27 0.00 0.00 179.45 176.47 1i88 h ASP 176 N 0.25 0.73 -0.29 4.20 3.32 -1.44 -1.52 116.42 121.66 1i88 h ASP 176 Ca 0.15 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 1i88 h ASP 176 Cb 0.13 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1i88 h ASP 176 CO -0.17 1.01 0.11 -0.07 -1.72 0.00 0.00 179.24 178.41 1i88 h LEU 177 N 0.58 0.41 -0.34 1.55 3.38 -1.10 -2.19 115.31 117.60 1i88 h LEU 177 Ca 0.06 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 1i88 h LEU 177 Cb 0.87 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1i88 h LEU 177 CO 0.08 0.47 -0.17 0.00 0.09 0.00 0.00 178.44 178.91 1i88 h ALA 178 N 0.95 0.48 0.00 1.53 0.00 -1.18 -3.21 119.26 117.83 1i88 h ALA 178 Ca 0.10 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1i88 h ALA 178 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1i88 h ALA 178 CO -0.01 0.40 -0.49 0.93 0.00 0.00 0.00 179.25 180.08 1i88 h GLU 179 N 0.49 0.00 -0.01 0.00 5.08 -1.25 -3.19 114.58 115.69 1i88 h GLU 179 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1i88 h GLU 179 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1i88 h GLU 179 CO 0.05 0.49 -0.14 -1.71 -1.00 0.00 0.00 179.01 176.70 1i88 n ASN 180 N -3.47 1.47 -3.70 1.42 5.15 -0.83 -2.43 115.26 112.87 1i88 n ASN 180 Ca 0.00 -1.29 -0.27 0.00 -0.60 0.00 0.00 54.58 52.43 1i88 n ASN 180 Cb 0.62 0.09 -0.17 0.00 -0.53 0.00 0.00 39.78 39.79 1i88 n ASN 180 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1i88 s ASN 181 N -2.24 2.59 0.19 1.20 0.01 -1.21 -4.00 114.94 111.49 1i88 s ASN 181 Ca 0.30 -0.68 -0.32 0.00 -0.71 0.00 0.00 52.86 51.45 1i88 s ASN 181 Cb 0.20 -0.47 -0.12 0.00 0.41 0.00 0.00 41.25 41.27 1i88 s ASN 181 CO 0.43 -0.31 1.73 1.17 -1.51 0.00 0.00 177.10 178.61 1i88 n LYS 182 N 5.13 2.74 -0.34 -0.60 4.81 0.11 -1.45 118.16 128.56 1i88 n LYS 182 Ca -0.08 0.99 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1i88 n LYS 182 Cb 0.48 -2.84 0.00 0.00 0.02 0.00 0.00 35.03 32.69 1i88 n LYS 182 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i88 n GLY 183 N 3.96 1.96 3.76 3.14 0.00 -1.26 -4.93 105.19 111.82 1i88 n GLY 183 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1i88 n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i88 s ALA 184 N -3.20 3.53 -0.16 4.61 0.00 -0.53 -4.92 121.76 121.09 1i88 s ALA 184 Ca 0.00 1.24 -0.01 0.00 0.00 0.00 0.00 51.96 53.19 1i88 s ALA 184 Cb 0.00 -3.49 0.04 0.00 0.00 0.00 0.00 23.12 19.67 1i88 s ALA 184 CO 0.00 -0.63 -0.05 1.03 0.00 0.00 0.00 175.76 176.11 1i88 s ARG 185 N -1.21 1.43 -0.23 0.00 1.81 -1.26 -4.21 118.95 115.27 1i88 s ARG 185 Ca 0.52 -0.46 -0.09 0.00 -1.72 0.00 0.00 55.73 53.98 1i88 s ARG 185 Cb -0.39 -1.92 -0.04 0.00 -0.45 0.00 0.00 34.95 32.14 1i88 s ARG 185 CO 0.48 -0.40 0.10 0.08 -0.68 0.00 0.00 175.30 174.88 1i88 s VAL 186 N 1.65 4.82 -0.26 3.52 1.01 0.51 -1.06 120.40 130.59 1i88 s VAL 186 Ca 0.01 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 1i88 s VAL 186 Cb -0.15 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 1i88 s VAL 186 CO -0.08 0.36 0.41 -0.22 0.00 0.00 0.00 175.10 175.58 1i88 s LEU 187 N 1.15 4.05 -0.19 3.92 2.96 -0.30 -0.55 118.68 129.72 1i88 s LEU 187 Ca 0.05 0.37 -0.03 0.00 -0.22 0.00 0.00 54.13 54.30 1i88 s LEU 187 Cb -0.14 -2.50 -0.01 0.00 0.50 0.00 0.00 46.19 44.04 1i88 s LEU 187 CO 0.04 -0.20 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.12 1i88 s VAL 188 N 2.07 3.43 -0.13 1.68 1.01 0.05 -0.72 120.40 127.80 1i88 s VAL 188 Ca 0.17 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 1i88 s VAL 188 Cb -0.16 -2.53 0.03 0.00 0.00 0.00 0.00 36.38 33.73 1i88 s VAL 188 CO 0.10 0.46 -0.05 -0.69 0.00 0.00 0.00 175.10 174.91 1i88 s VAL 189 N 1.01 0.90 -0.20 2.92 1.01 0.35 -0.42 120.40 125.97 1i88 s VAL 189 Ca 0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 1i88 s VAL 189 Cb -0.15 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1i88 s VAL 189 CO 0.00 0.25 0.05 0.00 0.00 0.00 0.00 175.10 175.39 1i88 s SER 191 N 0.71 1.65 -0.07 0.00 0.15 -0.39 -0.85 113.70 114.90 1i88 s SER 191 Ca 0.02 -0.21 0.03 0.00 0.70 0.00 0.00 55.95 56.50 1i88 s SER 191 Cb -0.13 -0.20 0.01 0.00 -1.71 0.00 0.00 66.02 63.98 1i88 s SER 191 CO 0.02 -0.29 -0.16 -1.61 1.20 0.00 0.00 173.24 172.40 1i88 s GLU 192 N 2.14 2.07 -0.05 5.44 0.41 -0.03 -4.41 118.70 124.27 1i88 s GLU 192 Ca 0.04 -0.57 0.01 0.00 -0.41 0.00 0.00 54.97 54.04 1i88 s GLU 192 Cb -0.14 -1.67 0.02 0.00 -1.78 0.00 0.00 34.13 30.56 1i88 s GLU 192 CO -0.05 0.11 -0.07 0.08 -0.49 0.00 0.00 175.26 174.84 1i88 s VAL 193 N 0.46 0.69 -2.04 2.63 1.01 -1.26 -1.42 120.40 120.46 1i88 s VAL 193 Ca -0.14 -0.23 0.12 0.00 0.00 0.00 0.00 61.98 61.73 1i88 s VAL 193 Cb -0.16 -0.67 0.31 0.00 0.00 0.00 0.00 36.38 35.87 1i88 s VAL 193 CO 0.05 0.25 1.39 0.35 0.00 0.00 0.00 175.10 177.14 1i88 n THR 194 N 3.89 0.09 0.29 3.92 -2.24 -1.26 -3.90 114.28 115.07 1i88 n THR 194 Ca -0.24 -0.11 0.16 0.00 -2.27 0.00 0.00 64.05 61.59 1i88 n THR 194 Cb 0.51 -0.03 0.91 0.00 -2.10 0.00 0.00 70.33 69.63 1i88 n THR 194 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i88 h ALA 195 N 3.47 1.33 0.00 6.98 0.00 -1.95 -0.48 119.26 128.60 1i88 h ALA 195 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1i88 h ALA 195 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1i88 h ALA 195 CO 0.00 0.05 -0.46 0.28 0.00 0.00 0.00 179.25 179.11 1i88 n VAL 196 N -3.61 0.31 0.18 0.00 0.31 -1.25 -4.21 118.33 110.06 1i88 n VAL 196 Ca -0.02 -0.21 0.04 0.00 -0.01 0.00 0.00 64.34 64.13 1i88 n VAL 196 Cb 0.14 -0.16 -0.05 0.00 -0.91 0.00 0.00 33.84 32.85 1i88 n VAL 196 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1i88 n THR 197 N -1.99 0.00 -1.77 2.52 5.66 -0.61 -0.55 114.28 117.54 1i88 n THR 197 Ca 0.04 -0.25 -0.41 0.00 -3.05 0.00 0.00 64.05 60.38 1i88 n THR 197 Cb 0.41 0.67 -0.01 0.00 -1.55 0.00 0.00 70.33 69.84 1i88 n THR 197 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 1i88 s PHE 198 N -2.12 2.74 0.25 1.09 2.19 -0.29 -4.90 117.98 116.94 1i88 s PHE 198 Ca 0.00 0.77 -0.21 0.00 0.33 0.00 0.00 56.93 57.82 1i88 s PHE 198 Cb 0.05 -4.08 0.03 0.00 -1.31 0.00 0.00 43.02 37.71 1i88 s PHE 198 CO 0.32 -3.63 0.69 -0.98 1.83 0.00 0.00 175.22 173.44 1i88 s ARG 199 N -0.53 1.67 0.94 10.12 1.70 -1.26 -4.83 118.95 126.77 1i88 s ARG 199 Ca 0.63 -0.88 -0.13 0.00 -0.47 0.00 0.00 55.73 54.88 1i88 s ARG 199 Cb -0.48 0.60 0.16 0.00 -0.57 0.00 0.00 34.95 34.66 1i88 s ARG 199 CO 0.48 -0.76 1.16 0.20 -1.08 0.00 0.00 175.30 175.30 1i88 s GLY 200 N -2.88 1.60 0.19 3.88 0.00 -0.84 -4.86 107.32 104.40 1i88 s GLY 200 Ca 0.09 -0.64 -0.13 0.00 0.00 0.00 0.00 44.72 44.04 1i88 s GLY 200 CO 0.03 -0.03 0.58 2.56 0.00 0.00 0.00 173.10 176.23 1i88 s PRO 201 N -5.36 3.95 -0.03 2.90 0.04 -1.26 -4.07 135.00 131.16 1i88 s PRO 201 Ca 0.65 0.47 0.00 0.00 0.04 0.00 0.00 61.00 62.17 1i88 s PRO 201 Cb -0.13 -2.81 0.03 0.00 0.04 0.00 0.00 34.50 31.62 1i88 s PRO 201 CO 0.53 0.40 -0.01 0.45 0.04 0.00 0.00 177.00 178.42 1i88 s SER 202 N -1.93 0.57 0.00 6.66 0.15 -1.26 -4.75 113.70 113.14 1i88 s SER 202 Ca 0.42 -0.05 0.21 0.00 0.70 0.00 0.00 55.95 57.23 1i88 s SER 202 Cb -0.14 -0.28 1.09 0.00 -1.71 0.00 0.00 66.02 64.99 1i88 s SER 202 CO 0.20 -0.09 1.67 -0.90 1.20 0.00 0.00 173.24 175.32 1i88 n ASP 203 N 4.14 0.00 -0.90 5.45 5.68 -1.26 -1.44 116.55 128.23 1i88 n ASP 203 Ca -0.26 -0.10 0.09 0.00 -0.50 0.00 0.00 54.79 54.03 1i88 n ASP 203 Cb 0.50 -0.25 0.15 0.00 -1.14 0.00 0.00 41.12 40.39 1i88 n ASP 203 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1i88 n THR 204 N -1.25 0.41 -3.15 2.12 -2.24 -1.26 -4.63 114.28 104.28 1i88 n THR 204 Ca 0.11 -0.71 -0.21 0.00 -2.27 0.00 0.00 64.05 60.97 1i88 n THR 204 Cb 0.16 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 1i88 n THR 204 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1i88 n HIS 205 N 1.13 1.20 0.24 4.78 8.25 -0.52 -4.94 115.22 125.37 1i88 n HIS 205 Ca 0.15 -3.84 0.12 0.00 -0.26 0.00 0.00 57.72 53.89 1i88 n HIS 205 Cb 0.51 -0.43 0.55 0.00 1.12 0.00 0.00 29.99 31.73 1i88 n HIS 205 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1i88 h LEU 206 N 3.21 0.00 -0.53 2.41 3.38 -1.82 -2.20 115.31 119.76 1i88 h LEU 206 Ca 0.11 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.98 1i88 h LEU 206 Cb 0.83 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1i88 h LEU 206 CO 0.59 0.15 -0.05 -2.24 0.09 0.00 0.00 178.44 176.97 1i88 h ASP 207 N 0.00 0.96 -0.56 -0.43 2.03 -1.92 -2.08 116.42 114.43 1i88 h ASP 207 Ca -0.00 -0.33 -0.04 0.00 -0.73 0.00 0.00 57.03 55.93 1i88 h ASP 207 Cb 0.65 -0.26 -0.02 0.00 -0.83 0.00 0.00 39.33 38.86 1i88 h ASP 207 CO 0.02 1.06 0.19 -1.28 -1.03 0.00 0.00 179.24 178.20 1i88 h SER 208 N 0.84 0.80 -0.99 4.15 0.87 -1.51 -3.05 113.55 114.66 1i88 h SER 208 Ca 0.14 -0.20 0.05 0.00 -1.23 0.00 0.00 61.79 60.55 1i88 h SER 208 Cb 0.60 -0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 62.29 1i88 h SER 208 CO 0.04 0.78 0.65 0.25 -0.53 0.00 0.00 176.83 178.02 1i88 h LEU 209 N 0.77 1.06 -0.84 2.23 5.85 -1.17 -2.50 115.31 120.72 1i88 h LEU 209 Ca 0.18 -0.00 0.14 0.00 0.84 0.00 0.00 57.88 59.04 1i88 h LEU 209 Cb 0.26 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 40.96 1i88 h LEU 209 CO -0.01 0.71 0.43 0.58 -0.34 0.00 0.00 178.44 179.82 1i88 h VAL 210 N 1.23 0.74 -0.85 1.05 2.07 -1.26 -0.48 116.25 118.74 1i88 h VAL 210 Ca 0.41 -0.21 0.10 0.00 0.82 0.00 0.00 66.70 67.81 1i88 h VAL 210 Cb 0.06 0.06 -0.06 0.00 -1.52 0.00 0.00 31.29 29.82 1i88 h VAL 210 CO -0.14 0.11 0.55 1.23 0.02 0.00 0.00 177.57 179.35 1i88 h GLY 211 N 0.63 1.18 2.00 2.17 0.00 -1.52 -1.55 103.07 105.98 1i88 h GLY 211 Ca 0.45 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 1i88 h GLY 211 CO -0.35 0.18 -0.03 1.46 0.00 0.00 0.00 176.54 177.79 1i88 h GLN 212 N 0.80 0.00 0.00 4.80 1.08 -1.11 -1.39 115.11 119.29 1i88 h GLN 212 Ca 0.40 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.59 1i88 h GLN 212 Cb 0.46 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.89 1i88 h GLN 212 CO -0.17 0.03 -0.56 0.00 -0.95 0.00 0.00 178.83 177.18 1i88 h ALA 213 N 1.97 0.72 0.00 3.87 0.00 -1.26 -3.42 119.26 121.14 1i88 h ALA 213 Ca -0.00 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 1i88 h ALA 213 Cb 0.37 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1i88 h ALA 213 CO 0.00 0.02 -1.80 1.28 0.00 0.00 0.00 179.25 178.75 1i88 n LEU 214 N -2.87 2.85 -4.72 0.00 4.77 -0.75 -4.91 117.00 111.37 1i88 n LEU 214 Ca 0.02 -0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.52 1i88 n LEU 214 Cb 0.55 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1i88 n LEU 214 CO 0.37 0.71 0.74 -0.36 -1.33 0.00 0.00 177.39 177.52 1i88 s PHE 215 N -2.28 3.64 0.30 -1.77 0.40 -0.60 -0.93 117.98 116.74 1i88 s PHE 215 Ca -0.19 1.63 0.02 0.00 -0.60 0.00 0.00 56.93 57.79 1i88 s PHE 215 Cb 0.05 -3.19 -0.05 0.00 0.51 0.00 0.00 43.02 40.34 1i88 s PHE 215 CO 0.32 -0.31 0.09 0.20 0.70 0.00 0.00 175.22 176.22 1i88 s GLY 216 N 0.60 1.95 0.04 4.36 0.00 -0.46 -4.84 107.32 108.98 1i88 s GLY 216 Ca 0.52 -1.88 0.00 0.00 0.00 0.00 0.00 44.72 43.36 1i88 s GLY 216 CO 0.30 -1.69 0.17 0.99 0.00 0.00 0.00 173.10 172.86 1i88 s ASP 217 N -3.40 6.13 0.00 1.64 1.01 -0.46 -4.14 116.67 117.45 1i88 s ASP 217 Ca 0.36 0.22 0.00 0.00 0.71 0.00 0.00 52.55 53.84 1i88 s ASP 217 Cb 0.08 -1.84 0.00 0.00 1.01 0.00 0.00 42.92 42.17 1i88 s ASP 217 CO 0.15 0.20 0.00 0.61 0.21 0.00 0.00 175.17 176.33 1i88 n GLY 218 N 0.53 1.07 3.04 0.21 0.00 -0.51 -4.52 105.19 105.02 1i88 n GLY 218 Ca -0.08 -0.59 -0.17 0.00 0.00 0.00 0.00 46.02 45.18 1i88 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i88 s ALA 219 N -2.00 0.73 0.01 4.61 0.00 -0.06 -0.85 121.76 124.19 1i88 s ALA 219 Ca 0.00 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 51.46 1i88 s ALA 219 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 1i88 s ALA 219 CO 0.00 0.13 -0.10 0.00 0.00 0.00 0.00 175.76 175.79 1i88 s ALA 220 N -0.59 0.79 0.02 0.00 0.00 -0.03 -0.71 121.76 121.24 1i88 s ALA 220 Ca -0.00 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 51.51 1i88 s ALA 220 Cb -0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1i88 s ALA 220 CO 0.00 0.17 -0.12 0.00 0.00 0.00 0.00 175.76 175.81 1i88 s ALA 221 N -0.42 1.03 0.14 0.00 0.00 0.76 -1.16 121.76 122.11 1i88 s ALA 221 Ca 0.02 -0.69 0.07 0.00 0.00 0.00 0.00 51.96 51.35 1i88 s ALA 221 Cb -0.05 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 1i88 s ALA 221 CO -0.00 0.20 -0.15 -0.51 0.00 0.00 0.00 175.76 175.30 1i88 s LEU 222 N -0.87 2.44 -0.19 0.00 1.43 0.44 -1.01 118.68 120.92 1i88 s LEU 222 Ca 0.02 -0.86 -0.03 0.00 -1.03 0.00 0.00 54.13 52.22 1i88 s LEU 222 Cb -0.07 -0.64 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 1i88 s LEU 222 CO 0.01 -0.12 -0.05 -0.63 0.23 0.00 0.00 176.35 175.78 1i88 s ILE 223 N -2.26 3.52 -0.07 -0.59 -1.09 -0.75 -0.77 121.20 119.20 1i88 s ILE 223 Ca 0.13 -0.47 0.05 0.00 -2.23 0.00 0.00 60.65 58.13 1i88 s ILE 223 Cb -0.04 -2.57 -0.01 0.00 -1.58 0.00 0.00 42.46 38.27 1i88 s ILE 223 CO 0.04 0.46 -0.23 -0.69 -1.23 0.00 0.00 174.94 173.29 1i88 s VAL 224 N 0.95 1.95 0.06 2.92 1.01 0.28 -0.06 120.40 127.53 1i88 s VAL 224 Ca -0.00 -0.99 -0.25 0.00 0.00 0.00 0.00 61.98 60.73 1i88 s VAL 224 Cb -0.15 -1.67 0.06 0.00 0.00 0.00 0.00 36.38 34.63 1i88 s VAL 224 CO 0.01 0.54 0.60 -0.83 0.00 0.00 0.00 175.10 175.42 1i88 s GLY 225 N 0.05 -0.55 0.35 4.51 0.00 -0.16 -0.37 107.32 111.16 1i88 s GLY 225 Ca -0.09 0.77 0.03 0.00 0.00 0.00 0.00 44.72 45.43 1i88 s GLY 225 CO 0.05 0.44 0.52 -0.56 0.00 0.00 0.00 173.10 173.55 1i88 s SER 226 N -2.06 6.04 -0.98 1.64 0.01 -1.26 -0.55 113.70 116.53 1i88 s SER 226 Ca -0.04 0.10 -0.09 0.00 1.31 0.00 0.00 55.95 57.23 1i88 s SER 226 Cb -0.01 -1.56 -0.03 0.00 0.21 0.00 0.00 66.02 64.64 1i88 s SER 226 CO -0.03 -0.43 0.80 0.47 0.41 0.00 0.00 173.24 174.47 1i88 n ASP 227 N -1.75 -6.37 -4.77 2.44 8.00 -1.26 -4.79 116.55 108.04 1i88 n ASP 227 Ca -0.02 -0.67 -0.40 0.00 0.71 0.00 0.00 54.79 54.40 1i88 n ASP 227 Cb 0.57 -4.35 -0.00 0.00 -0.02 0.00 0.00 41.12 37.32 1i88 n ASP 227 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 1i88 s PRO 228 N -4.61 4.06 -0.28 -0.24 0.02 -1.26 -4.92 135.00 127.76 1i88 s PRO 228 Ca 0.32 2.30 -0.29 0.00 0.02 0.00 0.00 61.00 63.34 1i88 s PRO 228 Cb -0.08 -2.87 0.00 0.00 0.02 0.00 0.00 34.50 31.58 1i88 s PRO 228 CO 0.79 -0.47 1.26 0.08 -0.33 0.00 0.00 177.00 178.34 1i88 s VAL 229 N -1.19 4.21 0.19 3.83 1.01 -1.26 -4.96 120.40 122.23 1i88 s VAL 229 Ca 0.55 1.39 -0.33 0.00 0.00 0.00 0.00 61.98 63.59 1i88 s VAL 229 Cb -0.41 -4.17 -0.15 0.00 0.00 0.00 0.00 36.38 31.65 1i88 s VAL 229 CO 0.54 -0.43 1.31 -2.65 0.00 0.00 0.00 175.10 173.87 1i88 n PRO 230 N 7.15 1.57 -0.86 2.72 -0.02 -1.26 -0.73 135.00 143.57 1i88 n PRO 230 Ca 0.14 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1i88 n PRO 230 Cb 0.46 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1i88 n PRO 230 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1i88 n GLU 231 N 2.06 -1.26 -0.02 -0.52 -0.58 -1.26 -4.60 120.64 114.47 1i88 n GLU 231 Ca 0.14 0.32 -0.05 0.00 -0.42 0.00 0.00 57.16 57.15 1i88 n GLU 231 Cb 0.27 -4.66 -0.02 0.00 -0.57 0.00 0.00 31.44 26.47 1i88 n GLU 231 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1i88 n ILE 232 N -2.07 0.55 -3.65 -3.67 -0.00 -0.96 -5.01 119.36 104.56 1i88 n ILE 232 Ca 0.00 0.03 -0.25 0.00 -0.00 0.00 0.00 62.75 62.53 1i88 n ILE 232 Cb 0.32 -1.62 -0.02 0.00 -0.00 0.00 0.00 39.64 38.32 1i88 n ILE 232 CO 0.00 0.00 0.00 -1.61 -0.00 0.00 0.00 176.55 174.94 1i88 s GLU 233 N -2.12 3.50 -0.33 0.38 2.02 0.09 -4.99 118.70 117.25 1i88 s GLU 233 Ca -0.07 -0.42 0.00 0.00 0.02 0.00 0.00 54.97 54.50 1i88 s GLU 233 Cb 0.02 -2.79 0.10 0.00 0.10 0.00 0.00 34.13 31.56 1i88 s GLU 233 CO 0.09 0.33 0.10 0.21 0.02 0.00 0.00 175.26 176.01 1i88 s LYS 234 N -3.76 0.89 0.34 1.61 2.20 -1.26 -4.68 119.74 115.08 1i88 s LYS 234 Ca 0.38 -1.29 -0.28 0.00 -0.36 0.00 0.00 55.97 54.42 1i88 s LYS 234 Cb -0.10 -2.22 -0.12 0.00 -1.51 0.00 0.00 37.83 33.88 1i88 s LYS 234 CO 0.31 -0.99 1.38 -2.30 -0.36 0.00 0.00 175.35 173.38 1i88 n PRO 235 N 4.64 2.31 -0.04 4.03 -0.02 -1.26 -4.58 135.00 140.08 1i88 n PRO 235 Ca -0.00 0.81 -0.08 0.00 -2.02 0.00 0.00 63.50 62.21 1i88 n PRO 235 Cb 0.41 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.41 1i88 n PRO 235 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1i88 n ILE 236 N 0.62 0.65 -3.95 4.25 5.41 0.19 -4.91 119.36 121.62 1i88 n ILE 236 Ca 0.05 -0.04 -0.10 0.00 1.00 0.00 0.00 62.75 63.66 1i88 n ILE 236 Cb 0.36 -1.66 -0.10 0.00 -0.71 0.00 0.00 39.64 37.53 1i88 n ILE 236 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1i88 s PHE 237 N -2.19 0.20 -0.05 1.39 0.08 -1.21 -3.51 117.98 112.69 1i88 s PHE 237 Ca -0.12 -0.44 0.01 0.00 0.12 0.00 0.00 56.93 56.50 1i88 s PHE 237 Cb 0.04 -0.15 -0.03 0.00 -0.57 0.00 0.00 43.02 42.31 1i88 s PHE 237 CO 0.15 -0.25 -0.06 -1.21 -0.10 0.00 0.00 175.22 173.76 1i88 s GLU 238 N -1.70 2.74 -0.02 0.44 2.02 -0.01 -0.31 118.70 121.86 1i88 s GLU 238 Ca -0.13 -0.57 -0.14 0.00 0.02 0.00 0.00 54.97 54.15 1i88 s GLU 238 Cb -0.07 -2.60 -0.05 0.00 0.10 0.00 0.00 34.13 31.51 1i88 s GLU 238 CO -0.01 0.66 0.39 -1.64 0.02 0.00 0.00 175.26 174.67 1i88 s MET 239 N -0.96 3.91 0.00 1.61 -1.94 0.10 -0.53 119.30 121.49 1i88 s MET 239 Ca 0.14 0.36 0.00 0.00 -1.71 0.00 0.00 55.69 54.48 1i88 s MET 239 Cb -0.11 -3.23 0.00 0.00 2.01 0.00 0.00 34.83 33.50 1i88 s MET 239 CO 0.03 0.66 0.00 0.28 -0.01 0.00 0.00 175.02 175.98 1i88 n VAL 240 N 1.96 0.00 -3.57 -6.03 0.31 -0.16 -4.16 118.33 106.68 1i88 n VAL 240 Ca -0.14 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.04 1i88 n VAL 240 Cb 0.52 -0.83 -0.06 0.00 -0.91 0.00 0.00 33.84 32.57 1i88 n VAL 240 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1i88 s TRP 241 N -1.91 -0.62 0.13 3.52 -0.00 -1.23 -5.01 118.94 113.82 1i88 s TRP 241 Ca 0.00 1.23 0.01 0.00 -0.00 0.00 0.00 56.10 57.34 1i88 s TRP 241 Cb 0.00 0.38 -0.04 0.00 -0.00 0.00 0.00 33.47 33.81 1i88 s TRP 241 CO 0.00 -0.47 -0.02 0.95 -0.00 0.00 0.00 176.95 177.41 1i88 s THR 242 N -0.65 0.59 0.13 5.86 -4.23 -1.26 -0.52 115.64 115.55 1i88 s THR 242 Ca -0.05 -1.94 -0.18 0.00 -1.18 0.00 0.00 61.69 58.34 1i88 s THR 242 Cb -0.02 -1.89 0.04 0.00 1.34 0.00 0.00 72.50 71.97 1i88 s THR 242 CO 0.05 -0.67 0.45 0.00 -0.54 0.00 0.00 174.62 173.91 1i88 s ALA 243 N -3.71 -1.11 -0.01 3.99 0.00 -0.21 -4.99 121.76 115.72 1i88 s ALA 243 Ca 0.18 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1i88 s ALA 243 Cb 0.06 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.91 1i88 s ALA 243 CO -0.01 -0.66 0.01 -1.14 0.00 0.00 0.00 175.76 173.96 1i88 s GLN 244 N -3.71 -0.00 0.13 0.00 0.74 -1.26 -0.85 119.66 114.71 1i88 s GLN 244 Ca 0.02 0.07 -0.08 0.00 0.05 0.00 0.00 55.36 55.42 1i88 s GLN 244 Cb 0.01 -0.12 -0.01 0.00 1.10 0.00 0.00 33.01 34.00 1i88 s GLN 244 CO -0.12 -0.07 0.23 -0.08 -0.55 0.00 0.00 175.29 174.70 1i88 s THR 245 N 0.45 0.10 -0.22 -0.34 -1.32 -0.25 -4.99 115.64 109.06 1i88 s THR 245 Ca -0.04 -1.37 -0.05 0.00 -1.21 0.00 0.00 61.69 59.03 1i88 s THR 245 Cb -0.06 -1.68 -0.02 0.00 -1.51 0.00 0.00 72.50 69.24 1i88 s THR 245 CO -0.01 -0.45 -0.01 -0.63 -2.21 0.00 0.00 174.62 171.31 1i88 s ILE 246 N -3.94 3.74 0.39 5.08 1.01 -1.26 -0.80 121.20 125.42 1i88 s ILE 246 Ca 0.13 -0.37 -0.26 0.00 0.00 0.00 0.00 60.65 60.15 1i88 s ILE 246 Cb 0.04 -2.71 -0.09 0.00 0.01 0.00 0.00 42.46 39.72 1i88 s ILE 246 CO -0.04 0.41 1.16 0.00 0.00 0.00 0.00 174.94 176.47 1i88 s ALA 247 N 1.31 3.19 0.63 9.38 0.00 0.26 -5.00 121.76 131.53 1i88 s ALA 247 Ca 0.04 0.96 -0.17 0.00 0.00 0.00 0.00 51.96 52.79 1i88 s ALA 247 Cb -0.15 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.59 1i88 s ALA 247 CO 0.00 -0.48 1.15 -1.25 0.00 0.00 0.00 175.76 175.18 1i88 s PRO 248 N -2.21 2.85 -1.44 0.00 0.04 -1.26 -3.53 135.00 129.45 1i88 s PRO 248 Ca 0.55 1.58 -0.10 0.00 0.04 0.00 0.00 61.00 63.08 1i88 s PRO 248 Cb -0.31 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.33 1i88 s PRO 248 CO 0.39 -1.25 0.99 -0.25 0.04 0.00 0.00 177.00 176.92 1i88 n ASP 249 N -2.05 -5.75 -0.00 6.66 8.00 -1.26 -4.84 116.55 117.30 1i88 n ASP 249 Ca 0.12 -0.56 0.00 0.00 0.71 0.00 0.00 54.79 55.06 1i88 n ASP 249 Cb 0.51 -4.57 0.00 0.00 -0.02 0.00 0.00 41.12 37.04 1i88 n ASP 249 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1i88 n SER 250 N -2.83 1.31 -4.68 -2.24 3.41 -1.23 -5.04 113.62 102.31 1i88 n SER 250 Ca -0.00 -1.67 -0.45 0.00 -0.26 0.00 0.00 58.87 56.49 1i88 n SER 250 Cb 0.56 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.46 1i88 n SER 250 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1i88 n GLU 251 N -0.34 2.46 -1.00 4.33 2.13 -1.26 -1.35 120.64 125.61 1i88 n GLU 251 Ca 0.00 0.89 0.00 0.00 0.66 0.00 0.00 57.16 58.72 1i88 n GLU 251 Cb 0.34 -2.73 0.00 0.00 0.27 0.00 0.00 31.44 29.32 1i88 n GLU 251 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1i88 n GLY 252 N 3.97 0.61 0.20 8.31 0.00 -1.26 -4.94 105.19 112.08 1i88 n GLY 252 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 1i88 n GLY 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i88 h ALA 253 N 0.00 0.57 -3.13 4.61 0.00 -1.52 -3.23 119.26 116.56 1i88 h ALA 253 Ca 0.00 0.09 -0.58 0.00 0.00 0.00 0.00 54.91 54.42 1i88 h ALA 253 Cb 0.01 0.09 -0.40 0.00 0.00 0.00 0.00 17.79 17.49 1i88 h ALA 253 CO 0.00 -0.27 -0.76 0.42 0.00 0.00 0.00 179.25 178.64 1i88 s ILE 254 N -6.14 0.81 -0.14 0.00 1.01 -1.26 -1.84 121.20 113.63 1i88 s ILE 254 Ca -0.13 -1.34 -0.03 0.00 0.00 0.00 0.00 60.65 59.16 1i88 s ILE 254 Cb 0.15 -1.61 -0.02 0.00 0.01 0.00 0.00 42.46 40.99 1i88 s ILE 254 CO 0.73 -0.67 -0.06 -1.81 0.00 0.00 0.00 174.94 173.13 1i88 s ASP 255 N 1.65 4.60 -0.15 3.58 1.01 -1.22 -4.31 116.67 121.84 1i88 s ASP 255 Ca 0.09 -0.17 -0.02 0.00 0.71 0.00 0.00 52.55 53.17 1i88 s ASP 255 Cb -0.17 -1.71 0.05 0.00 1.01 0.00 0.00 42.92 42.10 1i88 s ASP 255 CO -0.26 0.18 -0.00 -0.69 0.21 0.00 0.00 175.17 174.61 1i88 s VAL 256 N 0.29 0.66 -0.01 -1.27 1.01 -1.26 -1.90 120.40 117.92 1i88 s VAL 256 Ca -0.05 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1i88 s VAL 256 Cb -0.14 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 1i88 s VAL 256 CO 0.04 0.02 -0.04 -1.00 0.00 0.00 0.00 175.10 174.12 1i88 s HIS 257 N 1.82 2.98 -0.39 5.22 0.09 -1.04 -4.91 115.29 119.07 1i88 s HIS 257 Ca 0.01 0.03 -0.15 0.00 -0.00 0.00 0.00 55.06 54.95 1i88 s HIS 257 Cb -0.15 -1.65 0.01 0.00 -0.00 0.00 0.00 32.58 30.78 1i88 s HIS 257 CO -0.07 0.41 0.33 -1.17 -0.00 0.00 0.00 174.74 174.24 1i88 s LEU 258 N -1.40 4.82 0.00 0.89 2.96 -1.26 -1.74 118.68 122.96 1i88 s LEU 258 Ca 0.17 -0.64 0.02 0.00 -0.22 0.00 0.00 54.13 53.46 1i88 s LEU 258 Cb -0.11 -2.23 -0.01 0.00 0.50 0.00 0.00 46.19 44.34 1i88 s LEU 258 CO 0.08 -0.42 0.06 0.54 -1.32 0.00 0.00 176.35 175.29 1i88 n ARG 259 N 5.28 0.87 0.30 1.98 5.12 -0.20 -4.99 116.66 125.03 1i88 n ARG 259 Ca -0.10 -2.42 0.17 0.00 -1.93 0.00 0.00 57.85 53.57 1i88 n ARG 259 Cb 0.48 1.05 0.93 0.00 -1.16 0.00 0.00 32.46 33.76 1i88 n ARG 259 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1i88 h GLU 260 N 0.00 0.00 -0.64 5.56 5.08 -1.96 -0.05 114.58 122.57 1i88 h GLU 260 Ca -0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1i88 h GLU 260 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1i88 h GLU 260 CO 0.39 0.03 0.00 0.00 -1.00 0.00 0.00 179.01 178.44 1i88 n ALA 261 N -2.24 3.10 0.00 3.43 0.00 -1.26 -0.77 120.51 122.78 1i88 n ALA 261 Ca -0.02 -1.28 0.00 0.00 0.00 0.00 0.00 53.44 52.13 1i88 n ALA 261 Cb 0.13 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1i88 n ALA 261 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i88 n GLY 262 N 0.86 -1.83 3.65 0.00 0.00 -0.03 -4.67 105.19 103.17 1i88 n GLY 262 Ca 0.20 -1.91 -0.40 0.00 0.00 0.00 0.00 46.02 43.91 1i88 n GLY 262 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i88 s LEU 263 N 0.00 4.12 -0.17 0.99 2.96 0.29 -1.03 118.68 125.84 1i88 s LEU 263 Ca 0.00 0.77 -0.03 0.00 -0.22 0.00 0.00 54.13 54.65 1i88 s LEU 263 Cb 0.00 -2.85 -0.02 0.00 0.50 0.00 0.00 46.19 43.82 1i88 s LEU 263 CO 0.00 -0.29 -0.05 0.42 -1.32 0.00 0.00 176.35 175.11 1i88 s THR 264 N 2.03 3.60 -0.23 3.68 -4.23 -0.71 -4.37 115.64 115.41 1i88 s THR 264 Ca 0.27 -0.45 -0.14 0.00 -1.18 0.00 0.00 61.69 60.19 1i88 s THR 264 Cb -0.16 -2.58 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 1i88 s THR 264 CO 0.10 0.48 0.33 0.12 -0.54 0.00 0.00 174.62 175.10 1i88 s PHE 265 N 0.69 3.32 0.25 3.99 5.36 -1.26 -2.48 117.98 127.86 1i88 s PHE 265 Ca -0.03 0.46 0.11 0.00 -0.96 0.00 0.00 56.93 56.51 1i88 s PHE 265 Cb -0.15 -2.47 -0.05 0.00 -0.34 0.00 0.00 43.02 40.01 1i88 s PHE 265 CO 0.02 -0.05 -0.20 -1.01 -1.46 0.00 0.00 175.22 172.53 1i88 s HIS 266 N 1.44 2.18 -0.03 10.12 3.76 -0.80 -3.80 115.29 128.17 1i88 s HIS 266 Ca 0.15 -0.38 -0.01 0.00 -0.15 0.00 0.00 55.06 54.67 1i88 s HIS 266 Cb -0.15 -0.98 0.03 0.00 1.11 0.00 0.00 32.58 32.59 1i88 s HIS 266 CO 0.08 0.61 0.04 -0.51 -0.85 0.00 0.00 174.74 174.11 1i88 s LEU 267 N -3.30 0.62 -0.00 0.89 1.43 -1.26 -3.37 118.68 113.68 1i88 s LEU 267 Ca 0.27 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 1i88 s LEU 267 Cb -0.05 -0.12 -0.02 0.00 0.03 0.00 0.00 46.19 46.04 1i88 s LEU 267 CO 0.13 -0.19 0.05 0.18 0.23 0.00 0.00 176.35 176.75 1i88 n LEU 268 N 4.74 0.04 -4.31 1.79 4.77 -0.77 -4.95 117.00 118.32 1i88 n LEU 268 Ca -0.16 -0.35 -0.19 0.00 -0.03 0.00 0.00 56.01 55.29 1i88 n LEU 268 Cb 0.50 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.50 1i88 n LEU 268 CO 0.14 0.01 -0.16 -0.54 -1.33 0.00 0.00 177.39 175.52 1i88 s LYS 269 N -1.42 1.67 -0.89 3.23 1.02 -1.26 -4.92 119.74 117.18 1i88 s LYS 269 Ca 0.00 -1.96 -0.24 0.00 0.02 0.00 0.00 55.97 53.79 1i88 s LYS 269 Cb 0.01 0.13 0.05 0.00 -0.52 0.00 0.00 37.83 37.49 1i88 s LYS 269 CO 0.06 -0.55 1.34 0.34 -0.92 0.00 0.00 175.35 175.61 1i88 s ASP 270 N -3.37 6.35 0.09 2.83 -1.08 -1.26 -4.90 116.67 115.33 1i88 s ASP 270 Ca 0.37 -1.05 -0.21 0.00 -0.52 0.00 0.00 52.55 51.15 1i88 s ASP 270 Cb 0.04 -2.55 -0.10 0.00 -1.46 0.00 0.00 42.92 38.85 1i88 s ASP 270 CO 0.22 -1.62 1.63 0.58 0.52 0.00 0.00 175.17 176.50 1i88 h VAL 271 N 6.40 1.15 -0.88 1.11 2.07 -1.99 -0.47 116.25 123.64 1i88 h VAL 271 Ca -0.02 -0.45 0.10 0.00 0.82 0.00 0.00 66.70 67.15 1i88 h VAL 271 Cb 1.03 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 31.86 1i88 h VAL 271 CO 1.34 0.14 0.53 -0.65 0.02 0.00 0.00 177.57 178.95 1i88 h PRO 272 N 0.12 0.85 -0.30 1.57 0.11 -1.90 0.86 132.00 133.31 1i88 h PRO 272 Ca 0.06 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1i88 h PRO 272 Cb 0.16 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 1i88 h PRO 272 CO -0.01 0.56 0.05 0.78 -0.21 0.00 0.00 178.00 179.18 1i88 h GLY 273 N 0.87 0.54 0.90 -0.55 0.00 -1.84 -0.50 103.07 102.48 1i88 h GLY 273 Ca 0.43 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 1i88 h GLY 273 CO -0.25 0.33 0.07 -2.22 0.00 0.00 0.00 176.54 174.47 1i88 h ILE 274 N 0.32 1.22 0.04 2.60 2.04 -0.45 -1.23 117.51 122.06 1i88 h ILE 274 Ca 0.09 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 1i88 h ILE 274 Cb 0.34 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1i88 h ILE 274 CO 0.01 0.25 -0.02 0.58 0.00 0.00 0.00 178.15 178.97 1i88 h VAL 275 N 0.36 0.98 -0.10 1.67 2.07 -0.80 -2.17 116.25 118.26 1i88 h VAL 275 Ca 0.10 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.51 1i88 h VAL 275 Cb 0.31 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1i88 h VAL 275 CO 0.00 0.02 -0.14 0.77 0.02 0.00 0.00 177.57 178.23 1i88 h SER 276 N -0.08 0.14 0.72 0.57 4.64 -1.02 -0.41 113.55 118.11 1i88 h SER 276 Ca -0.01 -0.03 -0.09 0.00 -0.47 0.00 0.00 61.79 61.20 1i88 h SER 276 Cb 0.07 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1i88 h SER 276 CO 0.01 0.31 -0.43 0.11 -0.87 0.00 0.00 176.83 175.96 1i88 h LYS 277 N 0.15 0.00 -0.01 4.77 1.57 -0.98 -3.30 116.57 118.77 1i88 h LYS 277 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1i88 h LYS 277 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1i88 h LYS 277 CO 0.02 0.43 -0.28 0.09 -0.57 0.00 0.00 179.45 179.14 1i88 n ASN 278 N -3.66 1.57 -0.02 0.86 3.02 -0.81 -4.61 115.26 111.61 1i88 n ASN 278 Ca -0.01 -1.29 -0.06 0.00 -0.03 0.00 0.00 54.58 53.19 1i88 n ASN 278 Cb 0.52 0.43 0.12 0.00 -0.61 0.00 0.00 39.78 40.25 1i88 n ASN 278 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1i88 h ILE 279 N 1.71 1.28 -0.64 2.41 6.09 -1.18 -2.85 117.51 124.34 1i88 h ILE 279 Ca 0.00 -1.44 0.00 0.00 -1.37 0.00 0.00 64.86 62.05 1i88 h ILE 279 Cb 0.50 1.43 -0.03 0.00 0.47 0.00 0.00 36.82 39.19 1i88 h ILE 279 CO 0.00 0.46 0.40 0.74 -3.07 0.00 0.00 178.15 176.68 1i88 h THR 280 N 0.50 1.18 -0.78 2.19 2.02 -1.81 -0.33 112.91 115.87 1i88 h THR 280 Ca 0.06 -0.37 0.01 0.00 0.77 0.00 0.00 66.41 66.88 1i88 h THR 280 Cb 0.81 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 67.46 1i88 h THR 280 CO 0.07 0.18 0.52 0.50 0.37 0.00 0.00 175.52 177.15 1i88 h LYS 281 N 0.86 1.02 -0.59 6.66 3.64 -1.83 0.90 116.57 127.23 1i88 h LYS 281 Ca 0.23 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 1i88 h LYS 281 Cb -0.05 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.51 1i88 h LYS 281 CO -0.05 0.67 0.17 0.00 -2.27 0.00 0.00 179.45 177.97 1i88 h ALA 282 N 1.29 0.78 -0.55 5.00 0.00 -1.17 -2.29 119.26 122.31 1i88 h ALA 282 Ca 0.29 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1i88 h ALA 282 Cb -0.10 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1i88 h ALA 282 CO -0.07 0.46 0.26 -0.07 0.00 0.00 0.00 179.25 179.83 1i88 h LEU 283 N 0.84 0.73 -0.74 0.00 3.38 -0.43 -2.46 115.31 116.64 1i88 h LEU 283 Ca 0.19 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1i88 h LEU 283 Cb 0.32 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1i88 h LEU 283 CO -0.00 0.66 0.20 -0.37 0.09 0.00 0.00 178.44 179.02 1i88 h VAL 284 N 0.75 1.26 -0.18 1.22 -1.51 -0.72 0.19 116.25 117.26 1i88 h VAL 284 Ca 0.19 -0.95 -0.00 0.00 -1.23 0.00 0.00 66.70 64.71 1i88 h VAL 284 Cb 0.13 0.48 -0.01 0.00 -2.13 0.00 0.00 31.29 29.77 1i88 h VAL 284 CO -0.02 0.37 0.11 -0.08 -1.23 0.00 0.00 177.57 176.72 1i88 h GLU 285 N 1.10 0.25 -0.37 5.19 4.81 -1.32 0.10 114.58 124.34 1i88 h GLU 285 Ca 0.23 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.34 1i88 h GLU 285 Cb 0.35 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1i88 h GLU 285 CO -0.00 0.20 -0.15 0.00 -0.73 0.00 0.00 179.01 178.33 1i88 h ALA 286 N 1.03 0.52 0.00 2.92 0.00 -1.15 -3.42 119.26 119.17 1i88 h ALA 286 Ca 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1i88 h ALA 286 Cb 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1i88 h ALA 286 CO -0.01 0.43 -1.61 1.19 0.00 0.00 0.00 179.25 179.24 1i88 n PHE 287 N -4.31 0.00 -0.37 0.00 3.72 0.66 -4.46 117.46 112.70 1i88 n PHE 287 Ca -0.02 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.36 1i88 n PHE 287 Cb 0.39 -0.32 0.10 0.00 -0.94 0.00 0.00 39.48 38.71 1i88 n PHE 287 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1i88 h GLU 288 N 0.00 1.29 0.00 -1.08 4.57 -0.95 -1.09 114.58 117.32 1i88 h GLU 288 Ca 0.00 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1i88 h GLU 288 Cb 0.71 -0.29 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1i88 h GLU 288 CO 0.00 0.86 -0.02 -1.35 -1.18 0.00 0.00 179.01 177.33 1i88 h PRO 289 N 1.33 0.00 -0.01 0.92 0.11 -1.78 -0.96 132.00 131.61 1i88 h PRO 289 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 1i88 h PRO 289 Cb -0.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 30.97 1i88 h PRO 289 CO -0.07 0.02 -0.29 1.28 -0.21 0.00 0.00 178.00 178.72 1i88 n LEU 290 N -3.67 1.35 -0.19 2.35 4.77 -0.46 -4.95 117.00 116.19 1i88 n LEU 290 Ca -0.03 -0.42 -0.02 0.00 -0.03 0.00 0.00 56.01 55.51 1i88 n LEU 290 Cb 0.11 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1i88 n LEU 290 CO 0.26 0.25 -0.02 0.61 -1.33 0.00 0.00 177.39 177.16 1i88 n GLY 291 N 1.35 0.57 3.46 -0.72 0.00 -0.37 -5.02 105.19 104.47 1i88 n GLY 291 Ca 0.12 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 1i88 n GLY 291 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i88 s ILE 292 N -2.09 4.02 0.00 -0.61 1.01 -0.90 -4.93 121.20 117.70 1i88 s ILE 292 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.36 1i88 s ILE 292 Cb 0.00 -2.81 0.00 0.00 0.01 0.00 0.00 42.46 39.66 1i88 s ILE 292 CO 0.00 0.43 0.03 -1.54 0.00 0.00 0.00 174.94 173.86 1i88 n SER 293 N 4.19 0.06 -4.49 3.58 3.41 -1.26 -4.13 113.62 114.99 1i88 n SER 293 Ca -0.17 -0.40 -0.43 0.00 -0.26 0.00 0.00 58.87 57.61 1i88 n SER 293 Cb 0.52 0.61 -0.05 0.00 -0.26 0.00 0.00 64.21 65.04 1i88 n SER 293 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i88 s ASP 294 N -0.61 6.27 0.00 4.04 2.15 -1.26 -4.91 116.67 122.34 1i88 s ASP 294 Ca 0.00 -0.65 0.25 0.00 0.43 0.00 0.00 52.55 52.58 1i88 s ASP 294 Cb 0.00 -2.40 1.40 0.00 -0.30 0.00 0.00 42.92 41.62 1i88 s ASP 294 CO 0.00 -1.21 1.86 -1.22 -0.17 0.00 0.00 175.17 174.43 1i88 n TYR 295 N 7.24 0.00 1.05 -5.34 4.01 -1.26 -1.34 117.16 121.52 1i88 n TYR 295 Ca -0.02 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.85 1i88 n TYR 295 Cb 0.46 -0.14 0.31 0.00 -0.31 0.00 0.00 39.34 39.66 1i88 n TYR 295 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1i88 n ASN 296 N -1.14 0.54 -0.55 7.72 3.02 -1.26 -3.94 115.26 119.65 1i88 n ASN 296 Ca 0.16 -0.30 0.14 0.00 -0.03 0.00 0.00 54.58 54.54 1i88 n ASN 296 Cb 0.14 0.17 0.45 0.00 -0.61 0.00 0.00 39.78 39.93 1i88 n ASN 296 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1i88 n SER 297 N -1.36 1.73 -4.54 6.41 3.41 -0.45 -4.86 113.62 113.96 1i88 n SER 297 Ca 0.07 -1.56 -0.24 0.00 -0.26 0.00 0.00 58.87 56.88 1i88 n SER 297 Cb 0.34 0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 64.20 1i88 n SER 297 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1i88 s ILE 298 N -2.02 2.88 0.28 -1.33 -4.36 -1.25 -4.70 121.20 110.69 1i88 s ILE 298 Ca 0.36 -2.17 -0.11 0.00 -0.26 0.00 0.00 60.65 58.47 1i88 s ILE 298 Cb 0.21 -2.51 -0.08 0.00 1.25 0.00 0.00 42.46 41.33 1i88 s ILE 298 CO 0.34 -0.36 0.63 0.72 0.24 0.00 0.00 174.94 176.51 1i88 s PHE 299 N -2.36 3.41 -0.03 1.37 -0.71 -0.28 -4.94 117.98 114.44 1i88 s PHE 299 Ca 0.30 1.00 0.06 0.00 -1.04 0.00 0.00 56.93 57.25 1i88 s PHE 299 Cb -0.06 -2.37 -0.01 0.00 -1.21 0.00 0.00 43.02 39.37 1i88 s PHE 299 CO 0.17 0.18 -0.22 -1.58 -1.34 0.00 0.00 175.22 172.43 1i88 s TRP 300 N -1.92 2.03 -0.14 3.49 0.52 -1.26 -0.91 118.94 120.76 1i88 s TRP 300 Ca 0.50 -0.47 -0.02 0.00 0.02 0.00 0.00 56.10 56.13 1i88 s TRP 300 Cb -0.11 -1.33 0.04 0.00 -1.15 0.00 0.00 33.47 30.93 1i88 s TRP 300 CO 0.20 -0.10 0.02 0.42 0.02 0.00 0.00 176.95 177.52 1i88 s ILE 301 N -0.34 0.46 -0.04 2.03 1.09 -0.13 -4.74 121.20 119.54 1i88 s ILE 301 Ca 0.04 -0.24 0.04 0.00 -1.10 0.00 0.00 60.65 59.39 1i88 s ILE 301 Cb -0.10 -0.80 -0.00 0.00 -1.06 0.00 0.00 42.46 40.49 1i88 s ILE 301 CO 0.01 0.01 -0.17 0.00 -0.10 0.00 0.00 174.94 174.69 1i88 s ALA 302 N 1.91 1.50 0.09 9.38 0.00 -1.26 -0.93 121.76 132.44 1i88 s ALA 302 Ca 0.02 -0.68 -0.31 0.00 0.00 0.00 0.00 51.96 50.99 1i88 s ALA 302 Cb -0.15 -0.49 -0.10 0.00 0.00 0.00 0.00 23.12 22.38 1i88 s ALA 302 CO -0.07 0.27 1.85 -1.58 0.00 0.00 0.00 175.76 176.23 1i88 s HIS 303 N 0.02 1.93 -1.27 0.00 2.46 -0.20 -4.85 115.29 113.38 1i88 s HIS 303 Ca -0.03 -0.10 -0.09 0.00 0.47 0.00 0.00 55.06 55.31 1i88 s HIS 303 Cb -0.11 -4.17 0.17 0.00 -0.13 0.00 0.00 32.58 28.34 1i88 s HIS 303 CO 0.02 -4.94 1.91 -0.35 -2.47 0.00 0.00 174.74 168.91 1i88 n PRO 304 N 6.21 3.77 -0.26 2.88 -0.04 -1.26 -4.74 135.00 141.57 1i88 n PRO 304 Ca 0.18 -3.58 0.06 0.00 -0.04 0.00 0.00 63.50 60.12 1i88 n PRO 304 Cb 0.39 -2.87 0.19 0.00 -0.04 0.00 0.00 33.50 31.18 1i88 n PRO 304 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1i88 h GLY 305 N 7.48 1.14 -2.61 0.55 0.00 -1.93 -3.44 103.07 104.25 1i88 h GLY 305 Ca 0.42 -0.12 0.02 0.00 0.00 0.00 0.00 47.33 47.65 1i88 h GLY 305 CO 1.60 -0.14 0.23 -0.32 0.00 0.00 0.00 176.54 177.91 1i88 s GLY 306 N -3.50 -0.40 0.45 4.60 0.00 -1.26 -4.93 107.32 102.28 1i88 s GLY 306 Ca -0.12 0.19 0.14 0.00 0.00 0.00 0.00 44.72 44.93 1i88 s GLY 306 CO 0.76 0.07 2.01 -0.56 0.00 0.00 0.00 173.10 175.38 1i88 h PRO 307 N 2.00 0.04 -0.12 2.90 0.13 -1.84 -2.85 132.00 132.25 1i88 h PRO 307 Ca -0.28 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.78 1i88 h PRO 307 Cb 1.28 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1i88 h PRO 307 CO 0.32 0.17 -0.21 0.00 -0.23 0.00 0.00 178.00 178.05 1i88 h ALA 308 N 1.83 1.41 -0.19 -0.56 0.00 -1.95 -0.78 119.26 119.03 1i88 h ALA 308 Ca 0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1i88 h ALA 308 Cb 0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1i88 h ALA 308 CO 0.02 0.41 0.12 0.82 0.00 0.00 0.00 179.25 180.61 1i88 h ILE 309 N 0.20 1.08 -0.37 0.00 2.04 -1.84 -0.56 117.51 118.05 1i88 h ILE 309 Ca 0.03 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1i88 h ILE 309 Cb 0.49 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1i88 h ILE 309 CO 0.03 0.07 0.19 -0.07 0.00 0.00 0.00 178.15 178.38 1i88 h LEU 310 N 0.23 0.48 -0.66 1.44 3.38 -1.49 -0.86 115.31 117.83 1i88 h LEU 310 Ca 0.07 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1i88 h LEU 310 Cb 0.02 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1i88 h LEU 310 CO -0.01 0.45 0.28 0.44 0.09 0.00 0.00 178.44 179.69 1i88 h ASP 311 N 0.47 0.89 0.49 -0.43 3.32 -1.06 -0.98 116.42 119.13 1i88 h ASP 311 Ca 0.13 -0.16 -0.16 0.00 0.02 0.00 0.00 57.03 56.86 1i88 h ASP 311 Cb 0.09 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1i88 h ASP 311 CO -0.02 0.81 -0.69 1.56 -1.72 0.00 0.00 179.24 179.18 1i88 h GLN 312 N 0.92 0.17 -0.23 3.56 4.20 -0.97 -1.27 115.11 121.49 1i88 h GLN 312 Ca 0.22 -0.14 -0.06 0.00 0.06 0.00 0.00 58.65 58.74 1i88 h GLN 312 Cb 0.18 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1i88 h GLN 312 CO -0.02 0.79 -0.08 0.28 -0.67 0.00 0.00 178.83 179.13 1i88 h VAL 313 N 0.12 1.29 -0.31 -0.54 2.07 -0.97 -0.54 116.25 117.37 1i88 h VAL 313 Ca -0.02 -1.11 0.05 0.00 0.82 0.00 0.00 66.70 66.44 1i88 h VAL 313 Cb 1.23 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 32.49 1i88 h VAL 313 CO 0.10 0.34 0.02 -0.08 0.02 0.00 0.00 177.57 177.98 1i88 h GLU 314 N 0.20 0.11 -0.49 1.57 4.81 -1.09 -1.44 114.58 118.25 1i88 h GLU 314 Ca 0.06 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.20 1i88 h GLU 314 Cb 0.56 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 1i88 h GLU 314 CO 0.03 0.07 -0.01 1.96 -0.73 0.00 0.00 179.01 180.34 1i88 h GLN 315 N 0.12 0.86 -0.34 1.92 4.20 -1.17 0.01 115.11 120.71 1i88 h GLN 315 Ca 0.15 -0.28 0.02 0.00 0.06 0.00 0.00 58.65 58.60 1i88 h GLN 315 Cb 0.19 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.87 1i88 h GLN 315 CO -0.24 0.90 0.18 -0.22 -0.67 0.00 0.00 178.83 178.79 1i88 h LYS 316 N 0.72 0.36 -0.00 1.46 1.63 -0.75 -2.94 116.57 117.04 1i88 h LYS 316 Ca 0.14 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 1i88 h LYS 316 Cb 0.52 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 1i88 h LYS 316 CO 0.03 0.24 -0.47 1.28 -3.45 0.00 0.00 179.45 177.07 1i88 n LEU 317 N -4.93 0.69 -3.20 5.20 4.77 -0.57 -4.94 117.00 114.03 1i88 n LEU 317 Ca 0.00 -0.11 -0.18 0.00 -0.03 0.00 0.00 56.01 55.68 1i88 n LEU 317 Cb 0.07 -0.20 0.07 0.00 -2.33 0.00 0.00 43.42 41.04 1i88 n LEU 317 CO 0.31 0.16 0.17 0.00 -1.33 0.00 0.00 177.39 176.69 1i88 n ALA 318 N -1.26 -1.44 -1.77 -1.18 0.00 -0.13 -4.97 120.51 109.77 1i88 n ALA 318 Ca 0.07 0.18 -0.39 0.00 0.00 0.00 0.00 53.44 53.30 1i88 n ALA 318 Cb 0.34 -3.73 -0.01 0.00 0.00 0.00 0.00 19.45 16.05 1i88 n ALA 318 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1i88 s LEU 319 N -6.25 4.19 0.55 0.00 1.43 -0.47 -4.94 118.68 113.18 1i88 s LEU 319 Ca 0.29 2.45 -0.20 0.00 -1.03 0.00 0.00 54.13 55.64 1i88 s LEU 319 Cb -0.13 -3.99 -0.05 0.00 0.03 0.00 0.00 46.19 42.05 1i88 s LEU 319 CO 0.64 -0.76 1.23 -0.54 0.23 0.00 0.00 176.35 177.16 1i88 s LYS 320 N -2.30 3.19 0.36 1.70 1.02 -1.26 -4.86 119.74 117.59 1i88 s LYS 320 Ca 0.57 1.91 0.12 0.00 0.02 0.00 0.00 55.97 58.60 1i88 s LYS 320 Cb -0.33 -2.11 0.93 0.00 -0.52 0.00 0.00 37.83 35.79 1i88 s LYS 320 CO 0.42 -1.05 1.80 -1.35 -0.92 0.00 0.00 175.35 174.25 1i88 h PRO 321 N 1.28 0.56 0.00 -1.68 0.11 -1.98 -1.69 132.00 128.61 1i88 h PRO 321 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1i88 h PRO 321 Cb 1.29 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1i88 h PRO 321 CO 0.57 0.37 0.00 0.93 -0.21 0.00 0.00 178.00 179.66 1i88 h GLU 322 N 0.57 0.00 -0.75 1.05 5.08 -2.02 -3.18 114.58 115.33 1i88 h GLU 322 Ca 0.54 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.98 1i88 h GLU 322 Cb 1.10 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.29 1i88 h GLU 322 CO -0.29 0.00 0.42 0.87 -1.00 0.00 0.00 179.01 179.01 1i88 h LYS 323 N 0.00 0.73 -0.28 2.33 1.79 -1.66 -1.64 116.57 117.83 1i88 h LYS 323 Ca 0.00 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1i88 h LYS 323 Cb 0.33 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1i88 h LYS 323 CO 0.00 0.48 0.00 -1.33 -1.08 0.00 0.00 179.45 177.52 1i88 n MET 324 N -4.76 1.57 -0.02 3.15 2.81 -1.20 -4.44 117.12 114.23 1i88 n MET 324 Ca 0.11 -0.82 -0.09 0.00 -1.81 0.00 0.00 57.70 55.08 1i88 n MET 324 Cb 0.22 -1.22 -0.04 0.00 -0.71 0.00 0.00 33.22 31.47 1i88 n MET 324 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1i88 h ASN 325 N 1.31 -0.11 -0.64 7.83 2.35 -1.45 0.72 115.58 125.59 1i88 h ASN 325 Ca 0.00 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.76 1i88 h ASN 325 Cb 0.35 0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.78 1i88 h ASN 325 CO 0.01 -0.03 0.26 0.00 -1.65 0.00 0.00 177.43 176.02 1i88 h ALA 326 N 1.15 0.83 -0.12 -0.83 0.00 -1.82 -0.07 119.26 118.39 1i88 h ALA 326 Ca 0.07 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1i88 h ALA 326 Cb 0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1i88 h ALA 326 CO -0.15 0.43 0.05 1.15 0.00 0.00 0.00 179.25 180.73 1i88 h THR 327 N 0.89 0.98 0.00 0.00 2.02 -1.71 -2.07 112.91 113.02 1i88 h THR 327 Ca 0.21 -0.04 -0.08 0.00 0.77 0.00 0.00 66.41 67.27 1i88 h THR 327 Cb 0.19 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 1i88 h THR 327 CO -0.02 0.02 -0.40 0.03 0.37 0.00 0.00 175.52 175.52 1i88 h ARG 328 N 0.11 0.00 -0.41 6.66 3.08 -0.66 -1.91 114.38 121.25 1i88 h ARG 328 Ca 0.05 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.02 1i88 h ARG 328 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1i88 h ARG 328 CO -0.05 0.40 -0.05 1.49 -1.07 0.00 0.00 179.97 180.70 1i88 h GLU 329 N 0.00 0.75 -0.36 0.04 4.57 -0.62 0.01 114.58 118.97 1i88 h GLU 329 Ca -0.00 -0.26 -0.03 0.00 -1.18 0.00 0.00 59.36 57.88 1i88 h GLU 329 Cb 0.78 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 1i88 h GLU 329 CO 0.05 0.86 0.11 0.28 -1.18 0.00 0.00 179.01 179.13 1i88 h VAL 330 N 0.58 1.21 -0.74 0.32 2.07 -1.14 -0.91 116.25 117.63 1i88 h VAL 330 Ca 0.11 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 66.98 1i88 h VAL 330 Cb 0.55 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 1i88 h VAL 330 CO 0.03 0.24 0.45 0.25 0.02 0.00 0.00 177.57 178.56 1i88 h LEU 331 N 0.44 0.71 -0.65 2.57 5.85 -1.19 -0.17 115.31 122.87 1i88 h LEU 331 Ca 0.12 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1i88 h LEU 331 Cb 0.26 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1i88 h LEU 331 CO -0.00 0.47 0.32 -1.28 -0.34 0.00 0.00 178.44 177.61 1i88 h SER 332 N 0.85 0.84 1.20 1.25 0.87 -0.59 -0.32 113.55 117.65 1i88 h SER 332 Ca 0.32 -0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.71 1i88 h SER 332 Cb 0.11 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1i88 h SER 332 CO -0.15 0.73 -0.82 -0.33 -0.53 0.00 0.00 176.83 175.73 1i88 h GLU 333 N 0.90 0.00 0.00 2.24 4.39 -0.82 0.35 114.58 121.64 1i88 h GLU 333 Ca 0.22 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.92 1i88 h GLU 333 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1i88 h GLU 333 CO -0.03 0.09 -0.05 0.66 -1.16 0.00 0.00 179.01 178.52 1i88 n TYR 334 N -2.85 0.00 -4.32 4.33 4.01 -0.11 -4.45 117.16 113.78 1i88 n TYR 334 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1i88 n TYR 334 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 1i88 n TYR 334 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i88 n GLY 335 N 0.37 -1.33 3.49 2.72 0.00 -0.13 -4.46 105.19 105.86 1i88 n GLY 335 Ca 0.00 -1.24 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 1i88 n GLY 335 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i88 s ASN 336 N -4.00 6.24 -0.46 1.61 3.84 -0.10 -4.50 114.94 117.56 1i88 s ASN 336 Ca 0.00 -0.70 0.01 0.00 0.21 0.00 0.00 52.86 52.38 1i88 s ASN 336 Cb 0.00 -2.43 0.49 0.00 -0.55 0.00 0.00 41.25 38.76 1i88 s ASN 336 CO 0.00 -1.38 1.89 0.23 -2.79 0.00 0.00 177.10 175.05 1i88 n MET 337 N 7.72 2.23 0.00 0.43 2.81 -1.26 -1.36 117.12 127.69 1i88 n MET 337 Ca -0.01 -2.67 0.00 0.00 -1.81 0.00 0.00 57.70 53.21 1i88 n MET 337 Cb 0.46 -2.05 0.00 0.00 -0.71 0.00 0.00 33.22 30.93 1i88 n MET 337 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1i88 n SER 338 N -0.76 0.00 0.17 7.83 2.88 -1.26 -2.15 113.62 120.34 1i88 n SER 338 Ca 0.52 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 58.15 1i88 n SER 338 Cb 1.13 0.00 0.60 0.00 -0.75 0.00 0.00 64.21 65.19 1i88 n SER 338 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1i88 h SER 339 N 0.00 0.10 0.81 -3.46 4.64 -1.95 -1.90 113.55 111.79 1i88 h SER 339 Ca 0.00 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1i88 h SER 339 Cb 0.00 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1i88 h SER 339 CO 0.00 0.07 -0.10 0.00 -0.87 0.00 0.00 176.83 175.93 1i88 h ALA 340 N 1.91 1.05 -0.47 5.18 0.00 -1.72 -3.19 119.26 122.02 1i88 h ALA 340 Ca 0.06 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1i88 h ALA 340 Cb 0.12 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1i88 h ALA 340 CO -0.01 0.12 0.11 0.00 0.00 0.00 0.00 179.25 179.48 1i88 h VAL 342 N 0.26 1.17 -0.18 0.00 3.04 -1.80 -1.04 116.25 117.70 1i88 h VAL 342 Ca 0.23 -0.72 -0.19 0.00 -1.01 0.00 0.00 66.70 65.02 1i88 h VAL 342 Cb 0.29 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.66 1i88 h VAL 342 CO -0.29 0.23 -0.65 -0.07 -1.01 0.00 0.00 177.57 175.78 1i88 h LEU 343 N 0.31 0.78 -1.11 3.16 3.38 -1.61 -1.20 115.31 119.01 1i88 h LEU 343 Ca 0.07 -0.46 0.02 0.00 0.09 0.00 0.00 57.88 57.59 1i88 h LEU 343 Cb 0.32 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1i88 h LEU 343 CO 0.01 1.23 0.60 -0.26 0.09 0.00 0.00 178.44 180.11 1i88 h PHE 344 N 0.49 1.14 -0.38 1.13 -1.00 -0.57 -1.88 116.94 115.86 1i88 h PHE 344 Ca -0.02 0.03 -0.11 0.00 2.81 0.00 0.00 57.97 60.68 1i88 h PHE 344 Cb 1.24 -0.38 -0.01 0.00 3.61 0.00 0.00 35.95 40.40 1i88 h PHE 344 CO 0.06 0.70 -0.22 0.82 -1.61 0.00 0.00 178.31 178.06 1i88 h ILE 345 N 1.21 1.27 -0.70 -0.55 2.04 -0.97 -1.13 117.51 118.69 1i88 h ILE 345 Ca 0.34 -1.33 -0.00 0.00 1.00 0.00 0.00 64.86 64.87 1i88 h ILE 345 Cb -0.10 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1i88 h ILE 345 CO -0.08 0.44 0.42 -0.07 0.00 0.00 0.00 178.15 178.86 1i88 h LEU 346 N 0.67 0.84 -0.18 1.44 3.38 -0.90 -0.46 115.31 120.10 1i88 h LEU 346 Ca 0.09 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1i88 h LEU 346 Cb 0.73 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1i88 h LEU 346 CO 0.06 0.66 0.10 -0.78 0.09 0.00 0.00 178.44 178.57 1i88 h ASP 347 N 0.96 0.22 -0.36 -0.43 3.58 -0.90 -1.77 116.42 117.73 1i88 h ASP 347 Ca 0.25 -0.07 0.03 0.00 0.42 0.00 0.00 57.03 57.66 1i88 h ASP 347 Cb -0.03 -0.06 -0.03 0.00 1.72 0.00 0.00 39.33 40.93 1i88 h ASP 347 CO -0.05 0.23 0.17 -0.08 -2.88 0.00 0.00 179.24 176.63 1i88 h GLU 348 N 0.20 0.34 -0.03 0.28 4.57 -0.96 -0.47 114.58 118.50 1i88 h GLU 348 Ca 0.06 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1i88 h GLU 348 Cb 0.05 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 1i88 h GLU 348 CO -0.01 0.22 0.02 1.98 -1.18 0.00 0.00 179.01 180.04 1i88 h MET 349 N 0.35 0.04 -0.17 1.92 4.05 -0.92 -0.20 114.93 120.01 1i88 h MET 349 Ca 0.15 -0.00 -0.14 0.00 -0.28 0.00 0.00 59.70 59.43 1i88 h MET 349 Cb 0.08 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.86 1i88 h MET 349 CO -0.12 0.05 -0.49 0.07 0.23 0.00 0.00 176.91 176.65 1i88 h ARG 350 N 0.03 0.45 -0.21 0.39 -0.00 -1.24 0.07 114.38 113.87 1i88 h ARG 350 Ca 0.01 -0.26 -0.05 0.00 -0.00 0.00 0.00 59.98 59.69 1i88 h ARG 350 Cb 0.01 0.02 -0.01 0.00 -0.00 0.00 0.00 29.97 30.00 1i88 h ARG 350 CO -0.00 0.84 -0.07 0.87 -0.00 0.00 0.00 179.97 181.61 1i88 h LYS 351 N 0.35 0.41 -0.51 0.08 1.57 -0.94 -1.23 116.57 116.30 1i88 h LYS 351 Ca 0.02 -0.17 -0.10 0.00 -1.87 0.00 0.00 60.65 58.53 1i88 h LYS 351 Cb 0.99 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.26 1i88 h LYS 351 CO 0.09 0.67 -0.07 0.87 -0.57 0.00 0.00 179.45 180.44 1i88 h LYS 352 N 0.12 0.92 -0.66 3.15 1.79 -0.95 0.20 116.57 121.14 1i88 h LYS 352 Ca 0.05 -0.31 -0.05 0.00 -2.18 0.00 0.00 60.65 58.16 1i88 h LYS 352 Cb 0.53 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.08 1i88 h LYS 352 CO 0.02 0.96 0.21 0.77 -1.08 0.00 0.00 179.45 180.33 1i88 h SER 353 N 0.83 0.96 -0.15 0.86 0.02 -0.88 -1.44 113.55 113.76 1i88 h SER 353 Ca 0.14 -0.21 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 1i88 h SER 353 Cb 0.59 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1i88 h SER 353 CO 0.04 0.92 -0.46 0.71 -1.14 0.00 0.00 176.83 176.90 1i88 h THR 354 N 0.96 1.35 -0.63 -2.27 1.35 -1.13 -0.10 112.91 112.44 1i88 h THR 354 Ca 0.21 -1.73 0.03 0.00 -0.55 0.00 0.00 66.41 64.37 1i88 h THR 354 Cb 0.30 2.04 -0.04 0.00 -1.73 0.00 0.00 68.15 68.72 1i88 h THR 354 CO -0.01 0.53 0.39 -0.61 -0.25 0.00 0.00 175.52 175.57 1i88 h GLN 355 N 0.21 0.74 -0.45 4.72 4.15 -0.88 -2.56 115.11 121.04 1i88 h GLN 355 Ca -0.02 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1i88 h GLN 355 Cb 1.08 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.60 1i88 h GLN 355 CO 0.10 0.49 0.00 0.09 -1.93 0.00 0.00 178.83 177.58 1i88 n ASN 356 N -4.71 2.21 -3.69 -0.69 5.03 -0.55 -4.93 115.26 107.92 1i88 n ASN 356 Ca 0.06 -2.09 -0.25 0.00 0.87 0.00 0.00 54.58 53.16 1i88 n ASN 356 Cb 0.08 -0.31 0.06 0.00 -1.02 0.00 0.00 39.78 38.59 1i88 n ASN 356 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1i88 n GLY 357 N 0.92 -0.51 3.90 7.41 0.00 -0.97 -4.99 105.19 110.95 1i88 n GLY 357 Ca 0.12 0.22 -0.29 0.00 0.00 0.00 0.00 46.02 46.08 1i88 n GLY 357 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i88 s LEU 358 N -7.22 2.49 0.43 0.99 1.43 -0.07 -4.97 118.68 111.77 1i88 s LEU 358 Ca 0.55 0.77 0.24 0.00 -1.03 0.00 0.00 54.13 54.67 1i88 s LEU 358 Cb -0.26 -3.25 0.50 0.00 0.03 0.00 0.00 46.19 43.22 1i88 s LEU 358 CO 0.76 -1.94 1.67 0.11 0.23 0.00 0.00 176.35 177.18 1i88 h LYS 359 N -1.08 0.00 -4.28 1.70 1.57 -1.86 -3.42 116.57 109.19 1i88 h LYS 359 Ca -0.46 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.16 1i88 h LYS 359 Cb 1.33 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.49 1i88 h LYS 359 CO 0.65 0.00 -0.57 0.95 -0.57 0.00 0.00 179.45 179.91 1i88 s THR 360 N -3.25 0.10 -0.60 -0.16 -4.23 -1.26 -0.82 115.64 105.42 1i88 s THR 360 Ca 0.07 -1.77 0.23 0.00 -1.18 0.00 0.00 61.69 59.04 1i88 s THR 360 Cb 0.06 -1.95 0.24 0.00 1.34 0.00 0.00 72.50 72.20 1i88 s THR 360 CO 0.65 -0.47 1.70 0.35 -0.54 0.00 0.00 174.62 176.31 1i88 n THR 361 N -0.10 0.78 -2.27 3.99 -2.24 -0.64 -2.84 114.28 110.95 1i88 n THR 361 Ca -0.07 0.14 -0.39 0.00 -2.27 0.00 0.00 64.05 61.46 1i88 n THR 361 Cb 0.63 -1.02 0.03 0.00 -2.10 0.00 0.00 70.33 67.87 1i88 n THR 361 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i88 n GLY 362 N 0.27 5.79 2.44 3.38 0.00 -1.26 -3.64 105.19 112.17 1i88 n GLY 362 Ca 0.03 -2.55 -0.19 0.00 0.00 0.00 0.00 46.02 43.31 1i88 n GLY 362 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1i88 n GLU 363 N -0.35 -1.97 -0.95 1.61 1.02 -1.22 -1.59 120.64 117.20 1i88 n GLU 363 Ca 0.49 0.90 0.00 0.00 -0.02 0.00 0.00 57.16 58.53 1i88 n GLU 363 Cb 0.28 -5.47 0.00 0.00 -0.02 0.00 0.00 31.44 26.23 1i88 n GLU 363 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1i88 n GLY 364 N -1.09 0.94 3.94 0.62 0.00 -1.13 -4.92 105.19 103.55 1i88 n GLY 364 Ca -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.61 1i88 n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i88 s LEU 365 N 0.00 4.01 -0.17 0.99 1.43 -0.62 -4.61 118.68 119.71 1i88 s LEU 365 Ca 0.00 -0.16 -0.18 0.00 -1.03 0.00 0.00 54.13 52.77 1i88 s LEU 365 Cb 0.00 -2.64 -0.14 0.00 0.03 0.00 0.00 46.19 43.43 1i88 s LEU 365 CO 0.00 -0.23 0.21 -0.08 0.23 0.00 0.00 176.35 176.47 1i88 h GLU 366 N 1.14 0.00 -6.23 1.70 4.81 -1.84 -3.39 114.58 110.77 1i88 h GLU 366 Ca -0.48 0.00 -0.65 0.00 -0.13 0.00 0.00 59.36 58.10 1i88 h GLU 366 Cb 1.24 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 30.51 1i88 h GLU 366 CO 0.58 0.64 -0.63 -1.58 -0.73 0.00 0.00 179.01 177.29 1i88 s TRP 367 N -2.21 3.10 0.24 0.92 0.52 -1.26 -0.85 118.94 119.40 1i88 s TRP 367 Ca -0.20 0.05 -0.10 0.00 0.02 0.00 0.00 56.10 55.87 1i88 s TRP 367 Cb 0.02 -1.60 -0.01 0.00 -1.15 0.00 0.00 33.47 30.73 1i88 s TRP 367 CO 0.45 0.50 0.40 0.20 0.02 0.00 0.00 176.95 178.52 1i88 s GLY 368 N -2.18 0.78 0.01 0.98 0.00 0.26 -1.12 107.32 106.05 1i88 s GLY 368 Ca 0.26 -1.10 0.02 0.00 0.00 0.00 0.00 44.72 43.90 1i88 s GLY 368 CO 0.18 -0.82 -0.06 0.54 0.00 0.00 0.00 173.10 172.94 1i88 s VAL 369 N -4.01 0.41 -0.09 1.40 0.11 -0.09 -1.05 120.40 117.08 1i88 s VAL 369 Ca 0.27 -0.52 0.02 0.00 -2.93 0.00 0.00 61.98 58.82 1i88 s VAL 369 Cb 0.01 -0.41 0.01 0.00 -1.53 0.00 0.00 36.38 34.47 1i88 s VAL 369 CO 0.10 -0.08 -0.15 -0.22 -3.33 0.00 0.00 175.10 171.41 1i88 s LEU 370 N -0.66 1.74 -0.03 2.54 0.20 -0.20 -0.95 118.68 121.33 1i88 s LEU 370 Ca -0.03 -0.40 0.08 0.00 0.69 0.00 0.00 54.13 54.47 1i88 s LEU 370 Cb -0.05 -1.04 -0.02 0.00 -0.43 0.00 0.00 46.19 44.65 1i88 s LEU 370 CO -0.00 0.04 -0.26 -0.36 -0.29 0.00 0.00 176.35 175.48 1i88 s PHE 371 N 0.79 2.35 -0.03 5.38 0.08 -0.11 -0.82 117.98 125.63 1i88 s PHE 371 Ca -0.11 -0.50 0.05 0.00 0.12 0.00 0.00 56.93 56.48 1i88 s PHE 371 Cb -0.16 -1.52 -0.03 0.00 -0.57 0.00 0.00 43.02 40.75 1i88 s PHE 371 CO 0.02 -0.08 -0.15 0.20 -0.10 0.00 0.00 175.22 175.10 1i88 s GLY 372 N -0.51 1.53 -0.02 4.36 0.00 -0.27 -1.04 107.32 111.38 1i88 s GLY 372 Ca 0.07 -1.04 0.03 0.00 0.00 0.00 0.00 44.72 43.78 1i88 s GLY 372 CO 0.00 -0.85 -0.09 -1.36 0.00 0.00 0.00 173.10 170.80 1i88 s PHE 373 N -0.78 0.92 0.00 1.90 0.08 -1.26 -0.96 117.98 117.89 1i88 s PHE 373 Ca 0.12 -0.21 0.00 0.00 0.12 0.00 0.00 56.93 56.97 1i88 s PHE 373 Cb -0.11 -0.63 0.00 0.00 -0.57 0.00 0.00 43.02 41.71 1i88 s PHE 373 CO 0.02 -0.06 0.00 0.41 -0.10 0.00 0.00 175.22 175.48 1i88 n GLY 374 N 3.10 1.48 3.59 4.36 0.00 -0.69 -2.90 105.19 114.13 1i88 n GLY 374 Ca -0.16 -0.72 -0.48 0.00 0.00 0.00 0.00 46.02 44.67 1i88 n GLY 374 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1i88 n PRO 375 N 0.00 1.27 0.00 1.61 -0.02 -1.26 -0.88 135.00 135.72 1i88 n PRO 375 Ca 0.00 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1i88 n PRO 375 Cb 0.00 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1i88 n PRO 375 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i88 n GLY 376 N 1.88 0.81 3.48 -1.23 0.00 -1.26 -3.06 105.19 105.81 1i88 n GLY 376 Ca 0.14 0.00 -0.64 0.00 0.00 0.00 0.00 46.02 45.52 1i88 n GLY 376 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1i88 n LEU 377 N 0.00 1.02 -4.76 0.99 0.00 -1.24 -4.45 117.00 108.57 1i88 n LEU 377 Ca 0.00 0.98 -0.36 0.00 0.00 0.00 0.00 56.01 56.64 1i88 n LEU 377 Cb 0.00 -0.86 -0.08 0.00 0.00 0.00 0.00 43.42 42.48 1i88 n LEU 377 CO 0.00 -0.79 -0.23 -0.89 0.00 0.00 0.00 177.39 175.47 1i88 s THR 378 N 3.95 4.97 -0.16 1.96 2.01 -0.06 -0.58 115.64 127.73 1i88 s THR 378 Ca 1.07 0.01 0.02 0.00 0.31 0.00 0.00 61.69 63.10 1i88 s THR 378 Cb -1.46 -3.16 0.01 0.00 0.01 0.00 0.00 72.50 67.90 1i88 s THR 378 CO 0.74 0.57 -0.20 -0.63 -0.69 0.00 0.00 174.62 174.41 1i88 s ILE 379 N -0.61 2.12 -0.16 1.82 1.01 0.02 -1.70 121.20 123.70 1i88 s ILE 379 Ca 0.11 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 59.75 1i88 s ILE 379 Cb -0.12 -1.87 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 1i88 s ILE 379 CO 0.02 0.54 0.11 -1.61 0.00 0.00 0.00 174.94 174.00 1i88 s GLU 380 N 1.05 3.77 -0.09 2.79 0.41 -0.13 -1.09 118.70 125.41 1i88 s GLU 380 Ca -0.01 -0.23 0.04 0.00 -0.41 0.00 0.00 54.97 54.36 1i88 s GLU 380 Cb -0.14 -3.24 0.00 0.00 -1.78 0.00 0.00 34.13 28.97 1i88 s GLU 380 CO -0.07 0.51 -0.21 0.99 -0.49 0.00 0.00 175.26 175.98 1i88 s THR 381 N -0.25 1.82 -0.11 3.63 2.01 -0.03 -1.11 115.64 121.60 1i88 s THR 381 Ca 0.10 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.22 1i88 s THR 381 Cb -0.12 -1.59 0.02 0.00 0.01 0.00 0.00 72.50 70.83 1i88 s THR 381 CO 0.01 0.51 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.64 1i88 s VAL 382 N 0.37 1.27 -0.17 3.82 1.01 0.00 -1.05 120.40 125.66 1i88 s VAL 382 Ca -0.17 -0.48 -0.20 0.00 0.00 0.00 0.00 61.98 61.13 1i88 s VAL 382 Cb -0.17 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 1i88 s VAL 382 CO 0.07 0.40 0.59 -0.69 0.00 0.00 0.00 175.10 175.47 1i88 s VAL 383 N 1.25 5.07 0.19 2.92 1.01 0.32 -1.03 120.40 130.12 1i88 s VAL 383 Ca -0.02 1.14 0.10 0.00 0.00 0.00 0.00 61.98 63.19 1i88 s VAL 383 Cb -0.14 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1i88 s VAL 383 CO -0.04 0.18 -0.14 -0.76 0.00 0.00 0.00 175.10 174.34 1i88 s LEU 384 N 1.48 2.80 -0.06 3.92 1.43 -0.22 -0.99 118.68 127.04 1i88 s LEU 384 Ca 0.29 -0.68 0.05 0.00 -1.03 0.00 0.00 54.13 52.76 1i88 s LEU 384 Cb -0.16 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.56 1i88 s LEU 384 CO 0.11 0.11 -0.22 -0.60 0.23 0.00 0.00 176.35 175.98 1i88 s ARG 385 N -2.80 2.61 1.01 1.70 3.52 0.31 -0.57 118.95 124.72 1i88 s ARG 385 Ca 0.24 -0.85 -0.16 0.00 -0.13 0.00 0.00 55.73 54.83 1i88 s ARG 385 Cb -0.08 -2.25 0.21 0.00 -1.56 0.00 0.00 34.95 31.27 1i88 s ARG 385 CO 0.13 0.41 1.24 -1.54 -0.81 0.00 0.00 175.30 174.74 1i88 s SER 386 N -0.23 2.71 0.03 -2.12 1.04 -0.03 -0.83 113.70 114.27 1i88 s SER 386 Ca -0.01 0.46 0.08 0.00 0.48 0.00 0.00 55.95 56.97 1i88 s SER 386 Cb -0.13 -0.64 -0.02 0.00 0.10 0.00 0.00 66.02 65.32 1i88 s SER 386 CO 0.03 -3.00 -0.25 -0.69 0.98 0.00 0.00 173.24 170.31 1i88 s VAL 387 N -3.59 1.97 0.22 5.02 1.01 -1.23 -4.75 120.40 119.06 1i88 s VAL 387 Ca 0.71 -1.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 1i88 s VAL 387 Cb -0.07 -1.68 -0.10 0.00 0.00 0.00 0.00 36.38 34.54 1i88 s VAL 387 CO 0.53 0.39 1.44 0.00 0.00 0.00 0.00 175.10 177.46 1i88 s ALA 388 N -0.73 3.63 0.00 5.51 0.00 -1.26 -1.62 121.76 127.29 1i88 s ALA 388 Ca 0.10 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1i88 s ALA 388 Cb -0.10 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1i88 s ALA 388 CO 0.01 -0.71 0.00 -0.89 0.00 0.00 0.00 175.76 174.17