#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mf0 h ALA 28 N 0.00 0.17 0.34 0.00 0.00 -1.99 -3.27 119.26 114.51 1mf0 h ALA 28 Ca 0.00 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 1mf0 h ALA 28 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1mf0 h ALA 28 CO 0.00 0.58 -0.34 0.00 0.00 0.00 0.00 179.25 179.49 1mf0 h THR 29 N 0.30 0.29 0.00 0.00 1.03 -1.98 -3.49 112.91 109.06 1mf0 h THR 29 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.31 1mf0 h THR 29 Cb 1.48 0.29 0.00 0.00 -1.07 0.00 0.00 68.15 68.86 1mf0 h THR 29 CO 0.16 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.28 1mf0 n GLY 30 N -1.45 0.64 3.77 2.99 0.00 -1.23 -4.84 105.19 105.06 1mf0 n GLY 30 Ca -0.10 -2.10 -0.39 0.00 0.00 0.00 0.00 46.02 43.44 1mf0 n GLY 30 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mf0 s SER 31 N -4.00 7.22 0.23 1.61 1.04 0.20 -4.51 113.70 115.48 1mf0 s SER 31 Ca 0.00 1.45 -0.16 0.00 0.48 0.00 0.00 55.95 57.72 1mf0 s SER 31 Cb 0.00 -2.45 -0.08 0.00 0.10 0.00 0.00 66.02 63.59 1mf0 s SER 31 CO 0.00 0.13 0.66 -0.13 0.98 0.00 0.00 173.24 174.88 1mf0 s ARG 32 N -0.58 4.07 0.11 4.02 0.52 -1.26 -4.83 118.95 121.00 1mf0 s ARG 32 Ca 0.35 0.66 -0.19 0.00 -0.52 0.00 0.00 55.73 56.03 1mf0 s ARG 32 Cb -0.21 -2.75 -0.07 0.00 0.52 0.00 0.00 34.95 32.44 1mf0 s ARG 32 CO 0.23 0.35 0.59 0.08 0.02 0.00 0.00 175.30 176.57 1mf0 s VAL 33 N -1.66 4.72 -0.18 3.52 1.01 0.78 -4.55 120.40 124.04 1mf0 s VAL 33 Ca 0.45 1.18 -0.10 0.00 0.00 0.00 0.00 61.98 63.51 1mf0 s VAL 33 Cb -0.14 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 1mf0 s VAL 33 CO 0.20 0.46 0.15 -0.89 0.00 0.00 0.00 175.10 175.01 1mf0 s THR 34 N -1.22 5.42 -0.03 3.92 2.01 -0.58 0.23 115.64 125.39 1mf0 s THR 34 Ca 0.32 0.23 0.06 0.00 0.31 0.00 0.00 61.69 62.62 1mf0 s THR 34 Cb -0.19 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.83 1mf0 s THR 34 CO 0.20 0.47 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.71 1mf0 s VAL 35 N 0.07 2.55 -0.20 3.82 1.01 0.14 -0.57 120.40 127.22 1mf0 s VAL 35 Ca 0.10 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.14 1mf0 s VAL 35 Cb -0.11 -1.96 0.04 0.00 0.00 0.00 0.00 36.38 34.34 1mf0 s VAL 35 CO -0.00 0.56 -0.14 -0.69 0.00 0.00 0.00 175.10 174.82 1mf0 s VAL 36 N -0.70 1.91 0.26 2.92 1.01 -0.56 -0.02 120.40 125.21 1mf0 s VAL 36 Ca 0.11 -1.09 0.06 0.00 0.00 0.00 0.00 61.98 61.06 1mf0 s VAL 36 Cb -0.10 -1.87 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 1mf0 s VAL 36 CO 0.00 0.29 -0.07 -0.76 0.00 0.00 0.00 175.10 174.56 1mf0 s LEU 37 N 1.30 2.45 -0.10 3.92 1.43 -0.15 -1.04 118.68 126.50 1mf0 s LEU 37 Ca -0.00 -1.16 -0.16 0.00 -1.03 0.00 0.00 54.13 51.77 1mf0 s LEU 37 Cb -0.16 -0.58 -0.05 0.00 0.03 0.00 0.00 46.19 45.43 1mf0 s LEU 37 CO -0.09 -0.34 0.42 -0.83 0.23 0.00 0.00 176.35 175.74 1mf0 s GLY 38 N -3.39 2.38 0.00 -3.19 0.00 -1.26 -0.68 107.32 101.18 1mf0 s GLY 38 Ca 0.28 -0.25 0.22 0.00 0.00 0.00 0.00 44.72 44.97 1mf0 s GLY 38 CO 0.10 0.55 0.97 0.00 0.00 0.00 0.00 173.10 174.71 1mf0 n ALA 39 N 3.19 4.24 -2.61 3.20 0.00 -1.01 -0.37 120.51 127.15 1mf0 n ALA 39 Ca -0.10 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1mf0 n ALA 39 Cb 0.52 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.12 1mf0 n ALA 39 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1mf0 n GLN 40 N -1.62 0.00 -2.31 0.00 6.02 -1.26 -4.57 117.38 113.65 1mf0 n GLN 40 Ca 0.03 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.76 1mf0 n GLN 40 Cb 0.36 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.63 1mf0 n GLN 40 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1mf0 n TRP 41 N 0.00 3.19 -0.15 1.08 8.01 -1.26 -1.42 117.44 126.90 1mf0 n TRP 41 Ca 0.00 -2.81 0.02 0.00 -1.31 0.00 0.00 57.50 53.40 1mf0 n TRP 41 Cb 0.00 -0.20 -0.01 0.00 -2.01 0.00 0.00 31.31 29.09 1mf0 n TRP 41 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1mf0 n GLY 42 N -0.56 -1.94 3.86 6.99 0.00 -1.26 -4.64 105.19 107.64 1mf0 n GLY 42 Ca 0.41 -1.46 -0.30 0.00 0.00 0.00 0.00 46.02 44.67 1mf0 n GLY 42 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mf0 n ASP 43 N -2.53 -4.55 0.10 1.61 8.00 -1.26 -4.86 116.55 113.06 1mf0 n ASP 43 Ca -0.00 -0.74 0.12 0.00 0.71 0.00 0.00 54.79 54.88 1mf0 n ASP 43 Cb 0.07 -3.66 0.26 0.00 -0.02 0.00 0.00 41.12 37.77 1mf0 n ASP 43 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1mf0 h GLU 44 N -1.83 0.00 0.00 -1.24 3.07 -1.91 -3.47 114.58 109.20 1mf0 h GLU 44 Ca -0.56 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.30 1mf0 h GLU 44 Cb 1.37 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.28 1mf0 h GLU 44 CO 0.67 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.69 1mf0 n GLY 45 N 1.28 1.96 0.30 -3.84 0.00 -1.26 -4.43 105.19 99.20 1mf0 n GLY 45 Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 1mf0 n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mf0 h LYS 46 N 0.00 0.99 -0.69 1.61 1.57 -1.93 -1.29 116.57 116.84 1mf0 h LYS 46 Ca 0.00 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1mf0 h LYS 46 Cb 0.00 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.05 1mf0 h LYS 46 CO 0.00 0.66 0.45 0.78 -0.57 0.00 0.00 179.45 180.77 1mf0 h GLY 47 N 1.02 0.91 0.55 3.86 0.00 -1.91 0.33 103.07 107.84 1mf0 h GLY 47 Ca 0.28 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1mf0 h GLY 47 CO -0.07 0.24 -0.03 1.70 0.00 0.00 0.00 176.54 178.39 1mf0 h LYS 48 N 0.76 0.06 -0.40 4.80 3.64 -1.39 -2.09 116.57 121.95 1mf0 h LYS 48 Ca 0.29 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.60 1mf0 h LYS 48 Cb 0.17 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1mf0 h LYS 48 CO -0.09 0.54 0.11 0.28 -2.27 0.00 0.00 179.45 178.02 1mf0 h VAL 49 N -0.41 1.22 -0.58 2.00 2.07 -0.72 -2.52 116.25 117.32 1mf0 h VAL 49 Ca 0.00 -0.75 0.05 0.00 0.82 0.00 0.00 66.70 66.82 1mf0 h VAL 49 Cb 0.53 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 1mf0 h VAL 49 CO 0.01 0.26 0.31 0.58 0.02 0.00 0.00 177.57 178.75 1mf0 h VAL 50 N 0.51 0.97 -0.76 2.57 2.07 -0.40 -2.28 116.25 118.92 1mf0 h VAL 50 Ca 0.13 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.47 1mf0 h VAL 50 Cb 0.29 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 1mf0 h VAL 50 CO -0.00 0.11 0.49 -0.78 0.02 0.00 0.00 177.57 177.41 1mf0 h ASP 51 N 0.59 0.83 -0.58 0.57 1.82 -1.17 0.22 116.42 118.70 1mf0 h ASP 51 Ca 0.25 -0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.88 1mf0 h ASP 51 Cb 0.15 -0.20 -0.03 0.00 0.68 0.00 0.00 39.33 39.93 1mf0 h ASP 51 CO -0.16 0.59 0.35 0.25 -1.61 0.00 0.00 179.24 178.66 1mf0 h LEU 52 N 0.98 0.69 -0.10 2.28 5.85 -1.01 -2.57 115.31 121.44 1mf0 h LEU 52 Ca 0.29 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1mf0 h LEU 52 Cb -0.05 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.80 1mf0 h LEU 52 CO -0.09 0.54 0.00 -0.07 -0.34 0.00 0.00 178.44 178.48 1mf0 h LEU 53 N 0.78 0.00 -0.58 2.25 3.38 -1.03 -3.29 115.31 116.82 1mf0 h LEU 53 Ca 0.21 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.02 1mf0 h LEU 53 Cb -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1mf0 h LEU 53 CO -0.04 0.00 -0.65 0.00 0.09 0.00 0.00 178.44 177.84 1mf0 h ALA 54 N 2.16 0.78 -1.00 1.53 0.00 -0.16 -3.20 119.26 119.37 1mf0 h ALA 54 Ca 0.00 -0.57 0.38 0.00 0.00 0.00 0.00 54.91 54.72 1mf0 h ALA 54 Cb 0.88 -0.08 -0.17 0.00 0.00 0.00 0.00 17.79 18.41 1mf0 h ALA 54 CO 0.00 0.76 0.48 1.79 0.00 0.00 0.00 179.25 182.28 1mf0 h THR 55 N 0.18 0.06 0.00 0.00 1.35 -1.60 -0.96 112.91 111.94 1mf0 h THR 55 Ca -0.01 -0.02 -0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1mf0 h THR 55 Cb 1.18 -0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 1mf0 h THR 55 CO 0.10 0.01 -0.00 -0.78 -0.25 0.00 0.00 175.52 174.60 1mf0 h ASP 56 N 0.06 -0.00 -0.24 5.36 1.82 -1.82 -3.49 116.42 118.11 1mf0 h ASP 56 Ca 0.80 -0.23 -0.15 0.00 -0.39 0.00 0.00 57.03 57.06 1mf0 h ASP 56 Cb 2.01 0.00 0.03 0.00 0.68 0.00 0.00 39.33 42.05 1mf0 h ASP 56 CO -0.75 0.61 -0.13 0.00 -1.61 0.00 0.00 179.24 177.36 1mf0 n ALA 57 N -2.74 -1.45 -0.02 -0.78 0.00 -0.37 -4.94 120.51 110.20 1mf0 n ALA 57 Ca -0.02 0.09 -0.17 0.00 0.00 0.00 0.00 53.44 53.33 1mf0 n ALA 57 Cb 0.11 -0.36 -0.14 0.00 0.00 0.00 0.00 19.45 19.06 1mf0 n ALA 57 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1mf0 n ASP 58 N 0.46 1.71 -3.86 0.00 8.00 0.53 -4.63 116.55 118.77 1mf0 n ASP 58 Ca 0.04 0.20 -0.15 0.00 0.71 0.00 0.00 54.79 55.59 1mf0 n ASP 58 Cb 0.06 -0.52 -0.15 0.00 -0.02 0.00 0.00 41.12 40.49 1mf0 n ASP 58 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1mf0 s ILE 59 N -2.56 0.12 -0.06 0.53 1.01 -1.01 -1.58 121.20 117.64 1mf0 s ILE 59 Ca -0.19 0.02 0.04 0.00 0.00 0.00 0.00 60.65 60.51 1mf0 s ILE 59 Cb 0.07 -0.16 0.00 0.00 0.01 0.00 0.00 42.46 42.39 1mf0 s ILE 59 CO 0.76 0.08 -0.17 -0.69 0.00 0.00 0.00 174.94 174.92 1mf0 s VAL 60 N 0.43 1.48 0.15 2.92 1.01 -0.91 0.54 120.40 126.02 1mf0 s VAL 60 Ca -0.04 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1mf0 s VAL 60 Cb -0.06 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1mf0 s VAL 60 CO -0.01 0.43 0.15 -0.94 0.00 0.00 0.00 175.10 174.73 1mf0 s SER 61 N 0.34 0.19 0.08 3.32 1.04 0.11 -0.07 113.70 118.71 1mf0 s SER 61 Ca -0.11 -1.08 0.06 0.00 0.48 0.00 0.00 55.95 55.30 1mf0 s SER 61 Cb -0.15 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.29 1mf0 s SER 61 CO 0.04 -0.80 -0.11 -0.60 0.98 0.00 0.00 173.24 172.76 1mf0 s ARG 62 N -4.02 2.19 0.00 4.02 6.06 -0.18 0.76 118.95 127.78 1mf0 s ARG 62 Ca 0.22 -0.97 0.00 0.00 -2.50 0.00 0.00 55.73 52.48 1mf0 s ARG 62 Cb 0.06 -2.32 0.00 0.00 0.06 0.00 0.00 34.95 32.75 1mf0 s ARG 62 CO 0.01 0.53 0.00 0.00 -2.50 0.00 0.00 175.30 173.34 1mf0 s GLN 64 N -1.60 1.08 0.87 0.00 -1.52 -1.26 -2.86 119.66 114.37 1mf0 s GLN 64 Ca 0.00 -1.03 0.00 0.00 -1.95 0.00 0.00 55.36 52.38 1mf0 s GLN 64 Cb 0.00 0.39 0.00 0.00 -0.22 0.00 0.00 33.01 33.18 1mf0 s GLN 64 CO 0.00 -0.40 0.00 0.41 -0.25 0.00 0.00 175.29 175.05 1mf0 n GLY 65 N -0.19 -1.90 0.00 3.09 0.00 -1.26 -4.56 105.19 100.37 1mf0 n GLY 65 Ca -0.11 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1mf0 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mf0 n GLY 66 N 0.00 5.01 0.00 -0.02 0.00 -1.26 -1.10 105.19 107.82 1mf0 n GLY 66 Ca 0.00 -0.92 0.02 0.00 0.00 0.00 0.00 46.02 45.12 1mf0 n GLY 66 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1mf0 n ASN 67 N 0.00 0.00 0.23 1.61 0.23 -1.26 -2.70 115.26 113.37 1mf0 n ASN 67 Ca 0.00 -1.76 0.09 0.00 -0.53 0.00 0.00 54.58 52.38 1mf0 n ASN 67 Cb 0.00 0.00 0.54 0.00 -2.08 0.00 0.00 39.78 38.24 1mf0 n ASN 67 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1mf0 h ASN 68 N 0.00 0.00 -4.27 0.53 -1.07 -1.94 -3.43 115.58 105.40 1mf0 h ASN 68 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 56.30 55.85 1mf0 h ASN 68 Cb 0.00 0.00 0.14 0.00 -2.07 0.00 0.00 38.32 36.39 1mf0 h ASN 68 CO 0.00 0.23 0.31 0.00 0.07 0.00 0.00 177.43 178.04 1mf0 s ALA 69 N -3.97 2.11 -0.31 4.14 0.00 -1.10 -5.03 121.76 117.60 1mf0 s ALA 69 Ca -0.02 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.40 1mf0 s ALA 69 Cb 0.12 -3.34 0.15 0.00 0.00 0.00 0.00 23.12 20.06 1mf0 s ALA 69 CO 0.64 -1.91 0.36 0.20 0.00 0.00 0.00 175.76 175.05 1mf0 s GLY 70 N -2.99 -0.28 -0.28 0.00 0.00 -1.26 -4.46 107.32 98.06 1mf0 s GLY 70 Ca 0.64 -0.31 -0.06 0.00 0.00 0.00 0.00 44.72 45.00 1mf0 s GLY 70 CO 0.53 2.83 0.05 0.30 0.00 0.00 0.00 173.10 176.81 1mf0 s HIS 71 N 2.16 3.12 -0.16 1.90 3.76 0.05 -4.89 115.29 121.23 1mf0 s HIS 71 Ca 0.12 -1.00 -0.16 0.00 -0.15 0.00 0.00 55.06 53.87 1mf0 s HIS 71 Cb -0.13 -2.22 -0.04 0.00 1.11 0.00 0.00 32.58 31.29 1mf0 s HIS 71 CO -0.24 -0.57 0.40 0.99 -0.85 0.00 0.00 174.74 174.47 1mf0 s THR 72 N 1.49 5.22 -0.02 1.30 2.01 -1.26 -0.55 115.64 123.83 1mf0 s THR 72 Ca 0.03 0.77 0.07 0.00 0.31 0.00 0.00 61.69 62.86 1mf0 s THR 72 Cb -0.17 -3.74 -0.02 0.00 0.01 0.00 0.00 72.50 68.59 1mf0 s THR 72 CO 0.01 0.32 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.34 1mf0 s VAL 73 N 0.81 1.81 -0.23 3.82 1.01 -0.37 -3.47 120.40 123.78 1mf0 s VAL 73 Ca 0.21 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 1mf0 s VAL 73 Cb -0.14 -1.51 0.07 0.00 0.00 0.00 0.00 36.38 34.80 1mf0 s VAL 73 CO 0.08 0.51 0.04 -0.69 0.00 0.00 0.00 175.10 175.04 1mf0 s VAL 74 N -0.47 0.75 -0.00 2.92 1.01 -1.26 0.11 120.40 123.46 1mf0 s VAL 74 Ca 0.07 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1mf0 s VAL 74 Cb -0.10 -1.31 -0.00 0.00 0.00 0.00 0.00 36.38 34.97 1mf0 s VAL 74 CO -0.00 -0.33 -0.04 0.68 0.00 0.00 0.00 175.10 175.41 1mf0 s VAL 75 N 1.73 0.30 -1.73 2.92 -7.23 -0.75 -0.76 120.40 114.89 1mf0 s VAL 75 Ca 0.01 -0.16 -0.16 0.00 -1.81 0.00 0.00 61.98 59.86 1mf0 s VAL 75 Cb -0.17 -0.25 0.15 0.00 0.56 0.00 0.00 36.38 36.66 1mf0 s VAL 75 CO -0.13 0.08 0.56 -0.67 -0.31 0.00 0.00 175.10 174.63 1mf0 n ASP 76 N 3.00 -1.79 0.00 4.85 2.03 -1.26 -1.25 116.55 122.12 1mf0 n ASP 76 Ca -0.13 -1.15 0.00 0.00 0.52 0.00 0.00 54.79 54.04 1mf0 n ASP 76 Cb 0.59 -2.15 0.00 0.00 -0.72 0.00 0.00 41.12 38.83 1mf0 n ASP 76 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1mf0 n GLY 77 N -1.50 3.26 3.90 0.27 0.00 -1.26 -5.04 105.19 104.81 1mf0 n GLY 77 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1mf0 n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mf0 s LYS 78 N -0.57 3.51 -0.14 1.61 1.02 -0.38 -5.09 119.74 119.69 1mf0 s LYS 78 Ca 0.00 -0.22 0.02 0.00 0.02 0.00 0.00 55.97 55.79 1mf0 s LYS 78 Cb 0.00 -3.06 0.01 0.00 -0.52 0.00 0.00 37.83 34.26 1mf0 s LYS 78 CO 0.00 0.63 -0.21 -2.00 -0.92 0.00 0.00 175.35 172.85 1mf0 s GLU 79 N -2.02 2.92 0.30 1.68 2.12 -1.26 -1.81 118.70 120.63 1mf0 s GLU 79 Ca 0.30 -0.82 0.10 0.00 0.36 0.00 0.00 54.97 54.91 1mf0 s GLU 79 Cb -0.13 -2.38 -0.05 0.00 0.26 0.00 0.00 34.13 31.83 1mf0 s GLU 79 CO 0.20 -0.04 -0.04 0.71 -0.54 0.00 0.00 175.26 175.55 1mf0 s TYR 80 N 0.87 2.55 -0.30 5.30 2.02 0.12 -4.97 117.35 122.94 1mf0 s TYR 80 Ca -0.06 -0.33 -0.01 0.00 -0.37 0.00 0.00 57.07 56.30 1mf0 s TYR 80 Cb -0.15 -1.27 0.13 0.00 -0.40 0.00 0.00 41.96 40.27 1mf0 s TYR 80 CO -0.03 0.58 0.28 0.16 -1.57 0.00 0.00 175.55 174.98 1mf0 s ASP 81 N -3.66 1.88 0.40 2.29 -4.77 -1.26 -1.24 116.67 110.31 1mf0 s ASP 81 Ca 0.32 -0.93 -0.01 0.00 -3.30 0.00 0.00 52.55 48.63 1mf0 s ASP 81 Cb -0.04 0.39 -0.03 0.00 -1.09 0.00 0.00 42.92 42.15 1mf0 s ASP 81 CO 0.19 -0.38 0.63 -0.36 0.70 0.00 0.00 175.17 175.95 1mf0 s PHE 82 N 2.22 3.51 0.00 2.11 0.08 0.29 -4.86 117.98 121.33 1mf0 s PHE 82 Ca 0.10 0.50 0.00 0.00 0.12 0.00 0.00 56.93 57.66 1mf0 s PHE 82 Cb -0.14 -2.05 0.00 0.00 -0.57 0.00 0.00 43.02 40.26 1mf0 s PHE 82 CO -0.30 -0.03 0.00 0.72 -0.10 0.00 0.00 175.22 175.51 1mf0 n HIS 83 N -1.96 0.00 -0.03 0.36 8.25 -1.26 -0.77 115.22 119.81 1mf0 n HIS 83 Ca -0.03 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.39 1mf0 n HIS 83 Cb 0.56 0.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.67 1mf0 n HIS 83 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1mf0 n LEU 84 N -1.65 2.46 -4.71 2.41 7.99 -1.26 -4.03 117.00 118.22 1mf0 n LEU 84 Ca 0.00 -0.03 -0.42 0.00 -0.01 0.00 0.00 56.01 55.55 1mf0 n LEU 84 Cb 0.04 -0.17 -0.03 0.00 -0.11 0.00 0.00 43.42 43.16 1mf0 n LEU 84 CO 0.00 0.52 1.20 -0.76 -1.51 0.00 0.00 177.39 176.84 1mf0 s LEU 85 N -5.20 4.36 0.45 2.23 1.43 -1.26 -4.94 118.68 115.75 1mf0 s LEU 85 Ca -0.08 2.46 -0.25 0.00 -1.03 0.00 0.00 54.13 55.23 1mf0 s LEU 85 Cb 0.02 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.58 1mf0 s LEU 85 CO 0.16 -0.78 1.44 -2.84 0.23 0.00 0.00 176.35 174.56 1mf0 s PRO 86 N 1.61 3.66 0.32 1.29 0.02 -1.26 -4.82 135.00 135.81 1mf0 s PRO 86 Ca 0.69 2.45 0.22 0.00 0.02 0.00 0.00 61.00 64.38 1mf0 s PRO 86 Cb -0.40 -2.65 1.17 0.00 0.02 0.00 0.00 34.50 32.64 1mf0 s PRO 86 CO 0.31 -0.85 1.69 0.43 -0.33 0.00 0.00 177.00 178.24 1mf0 n SER 87 N -0.22 0.60 -0.08 2.53 7.64 -1.26 -0.98 113.62 121.85 1mf0 n SER 87 Ca 0.05 0.75 0.15 0.00 1.01 0.00 0.00 58.87 60.84 1mf0 n SER 87 Cb 0.42 -0.84 0.76 0.00 -1.01 0.00 0.00 64.21 63.53 1mf0 n SER 87 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mf0 n GLY 88 N -1.08 -0.96 0.46 0.23 0.00 -1.26 -3.83 105.19 98.75 1mf0 n GLY 88 Ca -0.01 -0.23 0.28 0.00 0.00 0.00 0.00 46.02 46.06 1mf0 n GLY 88 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1mf0 h ILE 89 N 0.39 0.55 -0.19 -0.61 6.09 -1.40 0.49 117.51 122.83 1mf0 h ILE 89 Ca 0.00 -0.03 0.04 0.00 -1.37 0.00 0.00 64.86 63.50 1mf0 h ILE 89 Cb 0.23 0.47 -0.01 0.00 0.47 0.00 0.00 36.82 37.98 1mf0 h ILE 89 CO 0.00 0.01 0.13 0.40 -3.07 0.00 0.00 178.15 175.63 1mf0 h ILE 90 N 0.07 0.96 -3.12 2.19 1.08 -1.82 -3.40 117.51 113.47 1mf0 h ILE 90 Ca 0.46 -0.03 -0.57 0.00 -0.39 0.00 0.00 64.86 64.32 1mf0 h ILE 90 Cb 1.70 0.85 -0.05 0.00 -3.07 0.00 0.00 36.82 36.24 1mf0 h ILE 90 CO -0.04 0.02 0.87 0.21 -0.69 0.00 0.00 178.15 178.51 1mf0 s ASN 91 N -6.81 6.94 0.22 1.72 3.84 0.17 -4.91 114.94 116.11 1mf0 s ASN 91 Ca -0.06 1.32 0.11 0.00 0.21 0.00 0.00 52.86 54.45 1mf0 s ASN 91 Cb 0.18 -2.54 0.07 0.00 -0.55 0.00 0.00 41.25 38.41 1mf0 s ASN 91 CO 0.69 -0.83 1.44 0.71 -2.79 0.00 0.00 177.10 176.32 1mf0 h THR 92 N 5.64 1.35 -0.10 -5.21 1.35 -1.84 -3.20 112.91 110.89 1mf0 h THR 92 Ca -0.22 -2.65 0.00 0.00 -0.55 0.00 0.00 66.41 62.98 1mf0 h THR 92 Cb 1.08 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 70.00 1mf0 h THR 92 CO 1.00 0.71 0.00 0.29 -0.25 0.00 0.00 175.52 177.28 1mf0 n LYS 93 N -3.42 1.66 -3.88 4.72 5.02 -1.26 -4.84 118.16 116.15 1mf0 n LYS 93 Ca 0.00 -0.54 -0.11 0.00 -2.02 0.00 0.00 58.31 55.64 1mf0 n LYS 93 Cb 0.78 -1.60 -0.09 0.00 -0.02 0.00 0.00 35.03 34.10 1mf0 n LYS 93 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mf0 s ALA 94 N -1.34 -0.27 -0.11 7.82 0.00 -1.21 -4.83 121.76 121.82 1mf0 s ALA 94 Ca 0.09 -0.28 -0.08 0.00 0.00 0.00 0.00 51.96 51.69 1mf0 s ALA 94 Cb 0.07 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 1mf0 s ALA 94 CO 0.03 -0.28 0.18 0.08 0.00 0.00 0.00 175.76 175.77 1mf0 s VAL 95 N -2.03 5.43 -0.16 0.00 1.01 -0.62 -4.87 120.40 119.16 1mf0 s VAL 95 Ca -0.10 0.31 -0.07 0.00 0.00 0.00 0.00 61.98 62.13 1mf0 s VAL 95 Cb -0.04 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1mf0 s VAL 95 CO -0.01 0.60 0.07 -0.44 0.00 0.00 0.00 175.10 175.31 1mf0 s SER 96 N -0.92 5.71 0.03 3.32 0.01 0.26 -2.13 113.70 119.98 1mf0 s SER 96 Ca 0.16 0.15 0.09 0.00 1.31 0.00 0.00 55.95 57.66 1mf0 s SER 96 Cb -0.13 -1.92 -0.03 0.00 0.21 0.00 0.00 66.02 64.16 1mf0 s SER 96 CO 0.05 0.24 -0.25 0.12 0.41 0.00 0.00 173.24 173.81 1mf0 s PHE 97 N -0.01 2.36 -0.30 2.43 5.36 0.90 -0.68 117.98 128.03 1mf0 s PHE 97 Ca 0.06 -0.40 0.03 0.00 -0.96 0.00 0.00 56.93 55.67 1mf0 s PHE 97 Cb -0.12 -1.43 0.08 0.00 -0.34 0.00 0.00 43.02 41.22 1mf0 s PHE 97 CO 0.01 0.11 -0.01 0.42 -1.46 0.00 0.00 175.22 174.29 1mf0 s ILE 98 N -0.78 2.01 0.99 3.12 1.01 -0.63 -1.01 121.20 125.92 1mf0 s ILE 98 Ca 0.12 -1.90 -0.12 0.00 0.00 0.00 0.00 60.65 58.74 1mf0 s ILE 98 Cb -0.10 -2.35 0.18 0.00 0.01 0.00 0.00 42.46 40.20 1mf0 s ILE 98 CO 0.02 -0.38 1.09 -0.83 0.00 0.00 0.00 174.94 174.84 1mf0 s GLY 99 N 1.09 1.57 0.55 6.18 0.00 -0.61 -0.80 107.32 115.31 1mf0 s GLY 99 Ca 0.03 -0.30 0.23 0.00 0.00 0.00 0.00 44.72 44.67 1mf0 s GLY 99 CO -0.08 0.29 2.18 3.45 0.00 0.00 0.00 173.10 178.93 1mf0 h ASN 100 N -1.86 0.00 0.48 1.64 -1.07 -1.44 -2.72 115.58 110.61 1mf0 h ASN 100 Ca -0.54 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 55.79 1mf0 h ASN 100 Cb 1.32 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.57 1mf0 h ASN 100 CO 0.57 0.00 -0.21 1.23 0.07 0.00 0.00 177.43 179.09 1mf0 h GLY 101 N 0.00 0.00 -1.68 9.14 0.00 -1.35 -3.33 103.07 105.85 1mf0 h GLY 101 Ca 0.02 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.85 1mf0 h GLY 101 CO -0.00 0.00 0.37 0.14 0.00 0.00 0.00 176.54 177.05 1mf0 s VAL 102 N -4.09 3.35 -0.18 4.60 1.01 -1.03 -4.42 120.40 119.64 1mf0 s VAL 102 Ca -0.02 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.58 1mf0 s VAL 102 Cb 0.13 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.37 1mf0 s VAL 102 CO 0.64 -0.40 -0.17 0.68 0.00 0.00 0.00 175.10 175.85 1mf0 s VAL 103 N -2.39 2.37 -0.14 2.92 -7.23 -0.26 -3.01 120.40 112.65 1mf0 s VAL 103 Ca 0.66 -0.85 -0.04 0.00 -1.81 0.00 0.00 61.98 59.95 1mf0 s VAL 103 Cb -0.20 -2.01 -0.03 0.00 0.56 0.00 0.00 36.38 34.71 1mf0 s VAL 103 CO 0.42 0.52 -0.02 -0.63 -0.31 0.00 0.00 175.10 175.08 1mf0 s ILE 104 N 1.17 4.09 -0.64 -0.62 1.01 0.45 -4.21 121.20 122.44 1mf0 s ILE 104 Ca 0.02 -0.30 -0.07 0.00 0.00 0.00 0.00 60.65 60.30 1mf0 s ILE 104 Cb -0.14 -2.78 0.17 0.00 0.01 0.00 0.00 42.46 39.72 1mf0 s ILE 104 CO -0.08 0.51 0.49 -2.28 0.00 0.00 0.00 174.94 173.59 1mf0 s HIS 105 N 0.08 3.51 0.11 3.97 5.65 -1.26 0.14 115.29 127.48 1mf0 s HIS 105 Ca 0.01 -2.39 -0.21 0.00 0.25 0.00 0.00 55.06 52.72 1mf0 s HIS 105 Cb -0.13 -3.40 -0.05 0.00 -1.18 0.00 0.00 32.58 27.82 1mf0 s HIS 105 CO 0.02 -0.91 1.16 1.28 -0.65 0.00 0.00 174.74 175.65 1mf0 n LEU 106 N 3.88 -0.72 -0.14 8.88 7.99 -1.26 -0.24 117.00 135.39 1mf0 n LEU 106 Ca 0.06 1.33 -0.04 0.00 -0.01 0.00 0.00 56.01 57.35 1mf0 n LEU 106 Cb 0.41 -0.22 0.03 0.00 -0.11 0.00 0.00 43.42 43.53 1mf0 n LEU 106 CO 0.35 -1.05 0.78 1.55 -1.51 0.00 0.00 177.39 177.52 1mf0 h PRO 107 N 0.00 0.01 -0.87 3.23 0.13 -1.94 0.10 132.00 132.67 1mf0 h PRO 107 Ca 0.11 -0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.33 1mf0 h PRO 107 Cb 0.28 -0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.34 1mf0 h PRO 107 CO -0.64 0.01 0.56 0.78 -0.23 0.00 0.00 178.00 178.48 1mf0 h GLY 108 N 0.01 1.23 0.99 1.56 0.00 -1.03 0.12 103.07 105.95 1mf0 h GLY 108 Ca 0.22 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 1mf0 h GLY 108 CO -0.45 0.20 -0.32 -2.00 0.00 0.00 0.00 176.54 173.97 1mf0 h LEU 109 N 0.86 -0.76 -0.89 3.11 5.85 0.18 -1.74 115.31 121.91 1mf0 h LEU 109 Ca 0.40 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 59.10 1mf0 h LEU 109 Cb 0.40 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.59 1mf0 h LEU 109 CO -0.17 -0.53 0.33 -0.26 -0.34 0.00 0.00 178.44 177.48 1mf0 h PHE 110 N -0.93 1.15 -0.53 1.25 0.04 -1.03 -1.30 116.94 115.59 1mf0 h PHE 110 Ca -0.09 -0.07 0.09 0.00 2.80 0.00 0.00 57.97 60.70 1mf0 h PHE 110 Cb 0.70 -0.35 -0.07 0.00 2.20 0.00 0.00 35.95 38.42 1mf0 h PHE 110 CO -0.02 0.86 0.11 1.49 -0.60 0.00 0.00 178.31 180.14 1mf0 h GLU 111 N 1.12 0.24 -0.46 1.51 4.81 -0.67 0.22 114.58 121.35 1mf0 h GLU 111 Ca 0.26 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 1mf0 h GLU 111 Cb 0.18 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1mf0 h GLU 111 CO -0.03 0.16 0.23 1.49 -0.73 0.00 0.00 179.01 180.13 1mf0 h GLU 112 N 0.25 0.65 -0.06 1.92 4.81 -0.61 -1.23 114.58 120.31 1mf0 h GLU 112 Ca 0.27 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1mf0 h GLU 112 Cb 0.38 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 1mf0 h GLU 112 CO -0.35 0.55 0.03 0.00 -0.73 0.00 0.00 179.01 178.51 1mf0 h ALA 113 N 1.07 0.08 0.18 2.92 0.00 -0.22 -1.71 119.26 121.59 1mf0 h ALA 113 Ca 0.16 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1mf0 h ALA 113 Cb 0.10 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1mf0 h ALA 113 CO -0.02 -0.38 -0.39 0.93 0.00 0.00 0.00 179.25 179.39 1mf0 h GLU 114 N 0.00 -0.64 -0.93 0.00 3.07 -0.48 0.66 114.58 116.27 1mf0 h GLU 114 Ca 0.02 0.04 0.27 0.00 -0.50 0.00 0.00 59.36 59.20 1mf0 h GLU 114 Cb 0.09 0.15 -0.15 0.00 -0.84 0.00 0.00 28.75 27.99 1mf0 h GLU 114 CO -0.00 -0.43 0.29 -0.22 -1.40 0.00 0.00 179.01 177.25 1mf0 h LYS 115 N -0.67 0.18 0.00 2.33 3.11 -1.04 0.19 116.57 120.67 1mf0 h LYS 115 Ca 0.01 -0.01 -0.20 0.00 -2.81 0.00 0.00 60.65 57.64 1mf0 h LYS 115 Cb 0.67 -0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 31.83 1mf0 h LYS 115 CO -0.19 0.12 -1.05 -0.91 -2.81 0.00 0.00 179.45 174.61 1mf0 h ASN 116 N 0.19 0.00 0.17 4.20 2.35 -0.40 -3.32 115.58 118.77 1mf0 h ASN 116 Ca 0.62 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.36 1mf0 h ASN 116 Cb 1.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.69 1mf0 h ASN 116 CO -0.69 0.88 -0.08 -0.33 -1.65 0.00 0.00 177.43 175.56 1mf0 h GLU 117 N 0.00 -0.22 -1.72 0.81 5.08 0.33 -0.89 114.58 117.97 1mf0 h GLU 117 Ca -0.06 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1mf0 h GLU 117 Cb 1.73 0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.03 1mf0 h GLU 117 CO 0.10 -0.13 0.00 1.63 -1.00 0.00 0.00 179.01 179.61 1mf0 n LYS 118 N -5.18 0.37 0.00 2.33 5.02 -0.43 -0.37 118.16 119.90 1mf0 n LYS 118 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1mf0 n LYS 118 Cb 0.12 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 1mf0 n LYS 118 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1mf0 n LYS 119 N 1.05 0.00 0.00 1.97 4.81 -0.39 -5.02 118.16 120.58 1mf0 n LYS 119 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1mf0 n LYS 119 Cb 0.19 -0.31 0.00 0.00 0.02 0.00 0.00 35.03 34.92 1mf0 n LYS 119 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mf0 n GLY 120 N 0.00 2.05 3.64 3.14 0.00 0.50 -5.08 105.19 109.43 1mf0 n GLY 120 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1mf0 n GLY 120 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mf0 s LEU 121 N 0.00 4.13 0.00 0.99 2.96 -0.88 -4.98 118.68 120.91 1mf0 s LEU 121 Ca 0.00 2.23 0.03 0.00 -0.22 0.00 0.00 54.13 56.17 1mf0 s LEU 121 Cb 0.00 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.15 1mf0 s LEU 121 CO 0.00 -1.22 -0.09 -0.54 -1.32 0.00 0.00 176.35 173.18 1mf0 s LYS 122 N 4.73 0.72 -1.73 1.98 -0.14 -1.26 -4.24 119.74 119.80 1mf0 s LYS 122 Ca 0.84 -0.41 0.00 0.00 -1.36 0.00 0.00 55.97 55.04 1mf0 s LYS 122 Cb -0.35 -0.68 0.00 0.00 -1.68 0.00 0.00 37.83 35.11 1mf0 s LYS 122 CO 0.35 0.18 0.00 -0.25 -0.76 0.00 0.00 175.35 174.87 1mf0 n ASP 123 N 2.62 -4.99 -0.36 2.83 8.00 -1.26 -4.88 116.55 118.51 1mf0 n ASP 123 Ca -0.15 0.40 0.10 0.00 0.71 0.00 0.00 54.79 55.86 1mf0 n ASP 123 Cb 0.56 -3.93 0.29 0.00 -0.02 0.00 0.00 41.12 38.02 1mf0 n ASP 123 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 1mf0 h TRP 124 N 0.00 1.10 -1.00 1.24 5.08 -1.93 -0.28 115.95 120.16 1mf0 h TRP 124 Ca -0.33 0.03 0.21 0.00 1.08 0.00 0.00 58.89 59.88 1mf0 h TRP 124 Cb 1.07 -0.34 -0.10 0.00 -3.00 0.00 0.00 29.16 26.79 1mf0 h TRP 124 CO 0.46 0.34 0.62 1.05 -1.28 0.00 0.00 178.44 179.63 1mf0 h GLU 125 N 0.87 0.60 0.00 0.12 9.09 -1.92 0.38 114.58 123.73 1mf0 h GLU 125 Ca 0.54 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.91 1mf0 h GLU 125 Cb 0.70 -0.14 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 1mf0 h GLU 125 CO -0.32 0.40 0.00 0.87 0.05 0.00 0.00 179.01 180.01 1mf0 h LYS 126 N 0.62 0.00 0.00 1.06 6.56 -1.44 -3.08 116.57 120.29 1mf0 h LYS 126 Ca 0.58 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.17 1mf0 h LYS 126 Cb 1.10 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.76 1mf0 h LYS 126 CO -0.36 0.00 -0.03 2.89 -2.06 0.00 0.00 179.45 179.90 1mf0 n ARG 127 N -2.36 1.35 -5.02 3.15 1.85 0.12 -5.02 116.66 110.73 1mf0 n ARG 127 Ca 0.02 -2.40 -0.32 0.00 -1.00 0.00 0.00 57.85 54.15 1mf0 n ARG 127 Cb 0.26 -1.40 -0.14 0.00 -1.05 0.00 0.00 32.46 30.12 1mf0 n ARG 127 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1mf0 s LEU 128 N -2.57 2.49 -0.06 2.89 2.96 -0.52 0.91 118.68 124.79 1mf0 s LEU 128 Ca 0.28 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1mf0 s LEU 128 Cb 0.24 -1.49 0.02 0.00 0.50 0.00 0.00 46.19 45.46 1mf0 s LEU 128 CO 0.03 0.30 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.65 1mf0 s ILE 129 N -0.49 0.82 -0.20 6.68 1.01 0.14 -4.70 121.20 124.45 1mf0 s ILE 129 Ca 0.06 -0.28 -0.06 0.00 0.00 0.00 0.00 60.65 60.37 1mf0 s ILE 129 Cb -0.12 -0.79 -0.03 0.00 0.01 0.00 0.00 42.46 41.53 1mf0 s ILE 129 CO 0.01 0.29 0.03 -0.63 0.00 0.00 0.00 174.94 174.64 1mf0 s ILE 130 N 0.85 4.25 0.13 2.92 -1.09 0.44 -1.60 121.20 127.10 1mf0 s ILE 130 Ca -0.12 -0.21 -0.31 0.00 -2.23 0.00 0.00 60.65 57.78 1mf0 s ILE 130 Cb -0.15 -2.93 -0.09 0.00 -1.58 0.00 0.00 42.46 37.71 1mf0 s ILE 130 CO 0.01 0.42 1.51 -0.55 -1.23 0.00 0.00 174.94 175.11 1mf0 s SER 131 N 0.92 6.68 0.00 3.58 0.15 0.02 -1.17 113.70 123.88 1mf0 s SER 131 Ca 0.02 2.48 0.16 0.00 0.70 0.00 0.00 55.95 59.31 1mf0 s SER 131 Cb -0.14 -2.59 0.96 0.00 -1.71 0.00 0.00 66.02 62.54 1mf0 s SER 131 CO 0.02 -0.77 1.37 -0.90 1.20 0.00 0.00 173.24 174.16 1mf0 n ASP 132 N 4.26 0.00 -0.36 5.45 5.68 0.36 -2.77 116.55 129.17 1mf0 n ASP 132 Ca 0.13 -0.55 0.09 0.00 -0.50 0.00 0.00 54.79 53.96 1mf0 n ASP 132 Cb 0.40 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.37 1mf0 n ASP 132 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1mf0 n ARG 133 N -0.98 1.51 -2.19 0.11 1.74 -1.26 -1.94 116.66 113.64 1mf0 n ARG 133 Ca 0.12 -0.77 -0.36 0.00 -0.77 0.00 0.00 57.85 56.06 1mf0 n ARG 133 Cb 0.06 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1mf0 n ARG 133 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mf0 s ALA 134 N -2.15 2.81 0.49 7.54 0.00 -1.11 -4.78 121.76 124.56 1mf0 s ALA 134 Ca 0.14 0.94 -0.09 0.00 0.00 0.00 0.00 51.96 52.95 1mf0 s ALA 134 Cb 0.14 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 1mf0 s ALA 134 CO 0.49 -0.82 0.84 -1.01 0.00 0.00 0.00 175.76 175.26 1mf0 s HIS 135 N -1.61 3.54 -0.18 0.00 3.76 -1.16 -1.75 115.29 117.89 1mf0 s HIS 135 Ca 0.69 1.01 -0.07 0.00 -0.15 0.00 0.00 55.06 56.54 1mf0 s HIS 135 Cb -0.28 -2.46 -0.04 0.00 1.11 0.00 0.00 32.58 30.91 1mf0 s HIS 135 CO 0.33 -0.32 0.06 -0.51 -0.85 0.00 0.00 174.74 173.45 1mf0 s LEU 136 N -4.54 3.81 -0.44 0.89 1.43 0.15 -0.41 118.68 119.57 1mf0 s LEU 136 Ca 0.51 0.08 -0.24 0.00 -1.03 0.00 0.00 54.13 53.45 1mf0 s LEU 136 Cb -0.10 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.18 1mf0 s LEU 136 CO 0.42 0.17 0.81 -0.69 0.23 0.00 0.00 176.35 177.30 1mf0 s VAL 137 N 0.37 4.63 0.36 -1.59 1.01 0.37 -4.72 120.40 120.82 1mf0 s VAL 137 Ca 0.03 0.55 -0.14 0.00 0.00 0.00 0.00 61.98 62.42 1mf0 s VAL 137 Cb -0.12 -4.33 -0.08 0.00 0.00 0.00 0.00 36.38 31.85 1mf0 s VAL 137 CO 0.00 -0.70 0.77 -0.36 0.00 0.00 0.00 175.10 174.81 1mf0 s PHE 138 N 3.35 3.40 0.31 5.22 0.08 -1.26 -4.35 117.98 124.72 1mf0 s PHE 138 Ca 0.31 1.21 0.04 0.00 0.12 0.00 0.00 56.93 58.62 1mf0 s PHE 138 Cb -0.12 -2.54 0.82 0.00 -0.57 0.00 0.00 43.02 40.61 1mf0 s PHE 138 CO 0.23 0.01 1.60 -0.44 -0.10 0.00 0.00 175.22 176.52 1mf0 h ASP 139 N 1.92 -0.18 0.49 1.36 5.19 -1.99 0.59 116.42 123.78 1mf0 h ASP 139 Ca -0.48 0.24 -0.06 0.00 -0.62 0.00 0.00 57.03 56.12 1mf0 h ASP 139 Cb 1.18 0.37 -0.01 0.00 0.18 0.00 0.00 39.33 41.05 1mf0 h ASP 139 CO 0.65 -0.29 -0.29 2.19 -3.12 0.00 0.00 179.24 178.38 1mf0 h PHE 140 N 0.08 0.00 -0.32 4.55 -0.00 -1.96 -2.35 116.94 116.94 1mf0 h PHE 140 Ca 0.61 0.00 0.02 0.00 -0.00 0.00 0.00 57.97 58.61 1mf0 h PHE 140 Cb 1.33 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 37.25 1mf0 h PHE 140 CO -0.34 0.29 0.16 0.45 -0.00 0.00 0.00 178.31 178.87 1mf0 h HIS 141 N 0.00 0.29 -0.27 6.09 3.86 -0.18 0.37 115.15 125.31 1mf0 h HIS 141 Ca -0.00 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 1mf0 h HIS 141 Cb 0.61 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.98 1mf0 h HIS 141 CO 0.00 0.16 -0.02 1.96 0.86 0.00 0.00 177.93 180.88 1mf0 h GLN 142 N 0.33 0.41 0.34 2.45 4.20 -1.34 -1.57 115.11 119.92 1mf0 h GLN 142 Ca 0.14 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 1mf0 h GLN 142 Cb 0.05 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1mf0 h GLN 142 CO -0.10 0.46 -0.16 0.00 -0.67 0.00 0.00 178.83 178.36 1mf0 h ALA 143 N 1.59 -0.45 0.00 3.87 0.00 -0.63 -2.95 119.26 120.68 1mf0 h ALA 143 Ca 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1mf0 h ALA 143 Cb 0.30 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1mf0 h ALA 143 CO 0.01 -0.55 -0.06 -0.39 0.00 0.00 0.00 179.25 178.27 1mf0 h VAL 144 N -0.87 0.47 0.06 0.00 -1.51 -0.26 -1.11 116.25 113.04 1mf0 h VAL 144 Ca -0.05 -0.27 -0.00 0.00 -1.23 0.00 0.00 66.70 65.15 1mf0 h VAL 144 Cb 0.53 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.87 1mf0 h VAL 144 CO 0.08 0.06 -0.03 -0.78 -1.23 0.00 0.00 177.57 175.66 1mf0 h ASP 145 N 0.00 -0.07 -0.36 4.19 3.58 -1.20 0.68 116.42 123.25 1mf0 h ASP 145 Ca -0.00 -0.04 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 1mf0 h ASP 145 Cb 0.18 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.23 1mf0 h ASP 145 CO 0.01 -0.00 0.16 1.23 -2.88 0.00 0.00 179.24 177.75 1mf0 h GLY 146 N -0.13 0.56 0.44 -0.78 0.00 -1.17 -1.79 103.07 100.20 1mf0 h GLY 146 Ca -0.01 -0.29 0.08 0.00 0.00 0.00 0.00 47.33 47.12 1mf0 h GLY 146 CO 0.01 0.27 0.23 1.41 0.00 0.00 0.00 176.54 178.46 1mf0 h LEU 147 N 0.43 0.24 -1.43 3.11 -0.00 -0.86 -1.44 115.31 115.37 1mf0 h LEU 147 Ca 0.12 0.07 0.01 0.00 -0.00 0.00 0.00 57.88 58.08 1mf0 h LEU 147 Cb 0.15 0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 40.83 1mf0 h LEU 147 CO -0.01 0.15 0.39 1.56 -0.00 0.00 0.00 178.44 180.52 1mf0 h GLN 148 N 0.41 0.77 0.11 1.13 4.20 0.86 -1.06 115.11 121.54 1mf0 h GLN 148 Ca 0.29 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.95 1mf0 h GLN 148 Cb 0.33 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1mf0 h GLN 148 CO -0.28 0.51 -0.05 0.93 -0.67 0.00 0.00 178.83 179.26 1mf0 h GLU 149 N 0.79 -0.15 -0.91 1.46 4.39 -0.44 -2.37 114.58 117.35 1mf0 h GLU 149 Ca 0.21 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1mf0 h GLU 149 Cb -0.09 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.55 1mf0 h GLU 149 CO -0.05 0.33 0.59 0.28 -1.16 0.00 0.00 179.01 179.00 1mf0 h VAL 150 N -0.75 1.24 -0.08 3.13 2.07 -1.32 -0.09 116.25 120.46 1mf0 h VAL 150 Ca -0.02 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1mf0 h VAL 150 Cb 0.55 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1mf0 h VAL 150 CO 0.03 0.24 -0.04 -0.61 0.02 0.00 0.00 177.57 177.20 1mf0 h GLN 151 N 1.25 0.11 0.07 1.57 -0.00 -1.22 0.17 115.11 117.06 1mf0 h GLN 151 Ca 0.33 -0.01 -0.25 0.00 -0.00 0.00 0.00 58.65 58.72 1mf0 h GLN 151 Cb -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 27.48 27.35 1mf0 h GLN 151 CO -0.07 0.17 -1.10 0.00 0.00 0.00 0.00 178.83 177.83 1mf0 h ARG 152 N 0.11 0.30 0.21 1.69 3.08 -0.52 -3.22 114.38 116.04 1mf0 h ARG 152 Ca 0.03 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.64 1mf0 h ARG 152 Cb 0.16 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1mf0 h ARG 152 CO 0.01 1.15 -0.10 1.96 -1.07 0.00 0.00 179.97 181.92 1mf0 h GLN 153 N 0.12 -0.27 0.00 0.04 1.08 -0.36 -1.48 115.11 114.24 1mf0 h GLN 153 Ca -0.11 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.11 1mf0 h GLN 153 Cb 1.79 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 29.29 1mf0 h GLN 153 CO 0.18 0.11 0.14 0.00 -0.95 0.00 0.00 178.83 178.32 1mf0 n ALA 154 N -2.52 0.80 -0.89 3.87 0.00 0.52 0.03 120.51 122.32 1mf0 n ALA 154 Ca -0.08 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1mf0 n ALA 154 Cb 0.26 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1mf0 n ALA 154 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1mf0 n GLN 155 N -1.85 0.00 0.25 0.00 7.27 -1.17 -4.78 117.38 117.11 1mf0 n GLN 155 Ca -0.01 0.00 0.16 0.00 0.07 0.00 0.00 57.00 57.22 1mf0 n GLN 155 Cb 0.16 -0.04 0.59 0.00 2.41 0.00 0.00 30.24 33.37 1mf0 n GLN 155 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1mf0 h GLU 156 N 0.00 0.00 -0.38 3.69 4.39 -1.35 -3.46 114.58 117.47 1mf0 h GLU 156 Ca 0.00 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 1mf0 h GLU 156 Cb 0.00 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 1mf0 h GLU 156 CO 0.00 0.00 -0.13 0.41 -1.16 0.00 0.00 179.01 178.13 1mf0 n GLY 157 N 0.20 0.81 3.36 -3.84 0.00 0.11 -4.99 105.19 100.83 1mf0 n GLY 157 Ca 0.01 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 1mf0 n GLY 157 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mf0 s LYS 158 N -2.74 0.46 0.13 1.61 2.20 -1.25 -4.94 119.74 115.21 1mf0 s LYS 158 Ca 0.00 0.92 0.01 0.00 -0.36 0.00 0.00 55.97 56.54 1mf0 s LYS 158 Cb 0.00 0.06 -0.00 0.00 -1.51 0.00 0.00 37.83 36.38 1mf0 s LYS 158 CO 0.00 -0.17 0.05 0.27 -0.36 0.00 0.00 175.35 175.14 1mf0 n ASN 159 N 4.41 1.06 0.12 1.43 0.23 -1.26 -4.28 115.26 116.97 1mf0 n ASN 159 Ca -0.21 -1.71 -0.20 0.00 -0.53 0.00 0.00 54.58 51.94 1mf0 n ASN 159 Cb 0.55 0.33 -0.14 0.00 -2.08 0.00 0.00 39.78 38.44 1mf0 n ASN 159 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 1mf0 h ILE 160 N 1.22 1.40 -0.26 1.53 2.04 -1.94 -3.43 117.51 118.07 1mf0 h ILE 160 Ca -0.10 -2.86 0.00 0.00 1.00 0.00 0.00 64.86 62.89 1mf0 h ILE 160 Cb 0.40 2.95 0.00 0.00 -0.74 0.00 0.00 36.82 39.42 1mf0 h ILE 160 CO 0.16 0.85 0.00 0.61 0.00 0.00 0.00 178.15 179.77 1mf0 n GLY 161 N 1.57 1.08 3.51 5.37 0.00 -1.26 -1.98 105.19 113.47 1mf0 n GLY 161 Ca -0.12 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 1mf0 n GLY 161 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mf0 n THR 162 N -1.87 0.00 1.39 2.61 -1.04 -1.26 -4.59 114.28 109.52 1mf0 n THR 162 Ca 0.00 -0.28 0.14 0.00 -2.04 0.00 0.00 64.05 61.87 1mf0 n THR 162 Cb 0.25 -0.94 0.58 0.00 -1.82 0.00 0.00 70.33 68.40 1mf0 n THR 162 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1mf0 n THR 163 N -4.64 0.00 -2.65 12.58 -2.24 -1.26 -4.92 114.28 111.15 1mf0 n THR 163 Ca 0.06 -0.08 -0.17 0.00 -2.27 0.00 0.00 64.05 61.60 1mf0 n THR 163 Cb 0.54 -0.01 0.02 0.00 -2.10 0.00 0.00 70.33 68.78 1mf0 n THR 163 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1mf0 n LYS 164 N -0.87 -2.87 -0.38 -0.78 5.02 -1.26 -4.91 118.16 112.10 1mf0 n LYS 164 Ca 0.14 0.72 0.10 0.00 -2.02 0.00 0.00 58.31 57.25 1mf0 n LYS 164 Cb 0.29 -5.12 0.29 0.00 -0.02 0.00 0.00 35.03 30.47 1mf0 n LYS 164 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1mf0 n LYS 165 N -2.99 2.97 -0.87 1.97 4.76 -1.26 -4.73 118.16 118.01 1mf0 n LYS 165 Ca -0.12 -2.59 0.00 0.00 -2.87 0.00 0.00 58.31 52.73 1mf0 n LYS 165 Cb 0.61 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 1mf0 n LYS 165 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1mf0 n GLY 166 N 1.25 0.89 0.26 0.72 0.00 -1.26 -4.47 105.19 102.58 1mf0 n GLY 166 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.21 1mf0 n GLY 166 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1mf0 h ILE 167 N 0.00 0.34 0.39 -0.61 1.08 -1.92 0.27 117.51 117.06 1mf0 h ILE 167 Ca 0.00 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 1mf0 h ILE 167 Cb 0.00 0.34 -0.02 0.00 -3.07 0.00 0.00 36.82 34.08 1mf0 h ILE 167 CO 0.00 0.00 -0.38 1.23 -0.69 0.00 0.00 178.15 178.31 1mf0 h GLY 168 N -0.06 -1.12 0.45 5.37 0.00 -1.95 -1.23 103.07 104.52 1mf0 h GLY 168 Ca 0.26 0.51 0.13 0.00 0.00 0.00 0.00 47.33 48.23 1mf0 h GLY 168 CO -0.61 -0.35 0.63 -2.55 0.00 0.00 0.00 176.54 173.66 1mf0 h PRO 169 N -0.76 0.93 -0.12 4.80 0.11 -1.71 -0.58 132.00 134.65 1mf0 h PRO 169 Ca -0.05 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.00 1mf0 h PRO 169 Cb 0.66 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 1mf0 h PRO 169 CO -0.04 0.61 0.07 1.15 -0.21 0.00 0.00 178.00 179.58 1mf0 h THR 170 N 0.95 1.09 -0.17 -1.15 2.02 -0.30 0.73 112.91 116.09 1mf0 h THR 170 Ca 0.50 -0.24 -0.05 0.00 0.77 0.00 0.00 66.41 67.39 1mf0 h THR 170 Cb 0.54 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1mf0 h THR 170 CO -0.27 0.08 -0.13 1.88 0.37 0.00 0.00 175.52 177.45 1mf0 h TYR 171 N 0.11 0.28 -0.09 3.16 0.05 -0.43 0.47 116.97 120.51 1mf0 h TYR 171 Ca 0.04 -0.03 -0.14 0.00 0.05 0.00 0.00 58.73 58.65 1mf0 h TYR 171 Cb 0.07 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 1mf0 h TYR 171 CO -0.04 0.40 -0.54 1.03 -1.05 0.00 0.00 178.16 177.95 1mf0 h SER 172 N 0.26 0.29 -0.33 3.88 0.87 -0.69 -1.26 113.55 116.57 1mf0 h SER 172 Ca 0.05 -0.15 -0.09 0.00 -1.23 0.00 0.00 61.79 60.36 1mf0 h SER 172 Cb 0.39 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1mf0 h SER 172 CO 0.02 0.78 -0.17 0.28 -0.53 0.00 0.00 176.83 177.22 1mf0 h SER 173 N 0.20 0.71 -0.09 6.23 0.02 0.03 -2.39 113.55 118.27 1mf0 h SER 173 Ca 0.00 -0.41 0.02 0.00 -0.84 0.00 0.00 61.79 60.57 1mf0 h SER 173 Cb 1.02 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.34 1mf0 h SER 173 CO 0.09 0.96 -0.06 0.50 -1.14 0.00 0.00 176.83 177.18 1mf0 h LYS 174 N 0.45 -0.06 -0.81 3.45 3.64 -0.74 -0.36 116.57 122.14 1mf0 h LYS 174 Ca 0.07 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.50 1mf0 h LYS 174 Cb 0.70 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.48 1mf0 h LYS 174 CO 0.05 -0.04 0.51 0.00 -2.27 0.00 0.00 179.45 177.69 1mf0 h ALA 175 N 1.01 1.09 0.00 5.00 0.00 -1.19 0.13 119.26 125.30 1mf0 h ALA 175 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1mf0 h ALA 175 Cb 0.15 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1mf0 h ALA 175 CO -0.13 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1mf0 n ALA 176 N -2.34 1.69 -1.96 0.00 0.00 -0.90 -4.85 120.51 112.14 1mf0 n ALA 176 Ca 0.10 0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.48 1mf0 n ALA 176 Cb 0.13 -1.32 -0.01 0.00 0.00 0.00 0.00 19.45 18.25 1mf0 n ALA 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mf0 n ARG 177 N -1.89 -0.68 -0.03 0.00 3.00 0.45 -4.90 116.66 112.61 1mf0 n ARG 177 Ca 0.03 0.51 0.04 0.00 -0.01 0.00 0.00 57.85 58.42 1mf0 n ARG 177 Cb 0.21 -4.47 -0.13 0.00 0.00 0.00 0.00 32.46 28.06 1mf0 n ARG 177 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 1mf0 n THR 178 N -3.72 0.31 -0.21 0.55 5.66 -0.27 -5.00 114.28 111.60 1mf0 n THR 178 Ca -0.10 -0.48 -0.24 0.00 -3.05 0.00 0.00 64.05 60.18 1mf0 n THR 178 Cb 0.51 -0.09 0.23 0.00 -1.55 0.00 0.00 70.33 69.44 1mf0 n THR 178 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1mf0 n GLY 179 N 1.65 -3.65 3.14 1.09 0.00 -0.99 -4.90 105.19 101.54 1mf0 n GLY 179 Ca -0.10 -1.19 -0.19 0.00 0.00 0.00 0.00 46.02 44.55 1mf0 n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mf0 s LEU 180 N 0.00 2.20 0.32 0.99 1.43 -1.26 -4.97 118.68 117.39 1mf0 s LEU 180 Ca 0.52 -0.49 0.09 0.00 -1.03 0.00 0.00 54.13 53.22 1mf0 s LEU 180 Cb -0.09 -0.56 -0.05 0.00 0.03 0.00 0.00 46.19 45.52 1mf0 s LEU 180 CO 0.44 -0.00 0.02 -0.13 0.23 0.00 0.00 176.35 176.90 1mf0 s ARG 181 N -1.29 2.14 0.28 1.70 0.52 -1.26 -0.67 118.95 120.37 1mf0 s ARG 181 Ca 0.00 -1.65 0.02 0.00 -0.52 0.00 0.00 55.73 53.59 1mf0 s ARG 181 Cb -0.08 -2.01 0.69 0.00 0.52 0.00 0.00 34.95 34.07 1mf0 s ARG 181 CO 0.01 0.19 1.68 0.82 0.02 0.00 0.00 175.30 178.03 1mf0 h ILE 182 N 1.81 0.42 -0.20 1.52 1.08 -1.46 0.25 117.51 120.95 1mf0 h ILE 182 Ca -0.43 -0.11 -0.07 0.00 -0.39 0.00 0.00 64.86 63.87 1mf0 h ILE 182 Cb 1.25 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 35.07 1mf0 h ILE 182 CO 0.64 0.06 -0.16 0.00 -0.69 0.00 0.00 178.15 178.00 1mf0 h ASP 184 N 0.31 0.00 -0.13 0.00 3.32 -0.82 -2.20 116.42 116.91 1mf0 h ASP 184 Ca 0.06 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 1mf0 h ASP 184 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1mf0 h ASP 184 CO 0.03 0.44 -0.23 0.25 -1.72 0.00 0.00 179.24 178.02 1mf0 h LEU 185 N 0.00 0.42 -1.07 1.55 6.46 -0.50 -3.23 115.31 118.94 1mf0 h LEU 185 Ca -0.00 -0.55 -0.09 0.00 -0.12 0.00 0.00 57.88 57.12 1mf0 h LEU 185 Cb 0.81 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.61 1mf0 h LEU 185 CO 0.06 0.89 -0.45 -0.07 -0.62 0.00 0.00 178.44 178.25 1mf0 h LEU 186 N -0.03 0.00 0.00 2.25 4.07 -1.30 -3.43 115.31 116.86 1mf0 h LEU 186 Ca 0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1mf0 h LEU 186 Cb 0.81 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.55 1mf0 h LEU 186 CO 0.05 0.45 0.00 -0.24 -1.08 0.00 0.00 178.44 177.62 1mf0 n SER 187 N -3.90 0.00 -4.57 -0.43 2.88 -0.84 -4.79 113.62 101.98 1mf0 n SER 187 Ca -0.01 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 57.07 1mf0 n SER 187 Cb 0.49 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.90 1mf0 n SER 187 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1mf0 n ASP 188 N 0.00 3.06 0.08 -3.46 2.03 -1.26 -4.83 116.55 112.18 1mf0 n ASP 188 Ca 0.00 0.40 0.05 0.00 0.52 0.00 0.00 54.79 55.76 1mf0 n ASP 188 Cb 0.00 -1.46 0.48 0.00 -0.72 0.00 0.00 41.12 39.43 1mf0 n ASP 188 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 1mf0 h PHE 189 N 13.33 0.35 -0.57 -0.67 3.57 -1.86 -2.00 116.94 129.10 1mf0 h PHE 189 Ca -0.39 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.13 1mf0 h PHE 189 Cb 1.27 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.85 1mf0 h PHE 189 CO 0.94 0.24 0.35 -0.44 -2.23 0.00 0.00 178.31 177.17 1mf0 h ASP 190 N 0.38 0.59 -0.13 0.41 3.32 -1.97 0.49 116.42 119.50 1mf0 h ASP 190 Ca 0.10 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.00 1mf0 h ASP 190 Cb -0.02 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1mf0 h ASP 190 CO -0.02 0.42 -0.44 -0.33 -1.72 0.00 0.00 179.24 177.14 1mf0 h GLU 191 N 0.71 0.68 0.68 3.56 5.08 -1.83 -2.75 114.58 120.71 1mf0 h GLU 191 Ca 0.22 -0.37 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 1mf0 h GLU 191 Cb -0.01 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1mf0 h GLU 191 CO -0.08 0.99 -0.33 0.35 -1.00 0.00 0.00 179.01 178.93 1mf0 h PHE 192 N 0.55 -0.86 -0.98 4.33 3.57 -0.65 -1.87 116.94 121.03 1mf0 h PHE 192 Ca 0.04 -0.02 0.24 0.00 3.53 0.00 0.00 57.97 61.75 1mf0 h PHE 192 Cb 0.99 0.28 -0.08 0.00 2.79 0.00 0.00 35.95 39.94 1mf0 h PHE 192 CO 0.05 -0.53 0.64 0.77 -2.23 0.00 0.00 178.31 177.01 1mf0 h SER 193 N -0.92 0.40 0.13 0.41 0.02 -0.03 0.52 113.55 114.08 1mf0 h SER 193 Ca -0.09 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1mf0 h SER 193 Cb 0.70 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1mf0 h SER 193 CO 0.15 0.12 -0.06 0.00 -1.14 0.00 0.00 176.83 175.90 1mf0 h ALA 194 N 1.60 -0.18 -0.45 3.77 0.00 -1.16 0.12 119.26 122.96 1mf0 h ALA 194 Ca 0.53 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.30 1mf0 h ALA 194 Cb 1.37 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.18 1mf0 h ALA 194 CO -0.21 -0.40 0.13 0.00 0.00 0.00 0.00 179.25 178.77 1mf0 h ARG 195 N -0.58 0.28 -0.15 0.00 3.08 -0.26 -1.45 114.38 115.29 1mf0 h ARG 195 Ca -0.02 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.06 1mf0 h ARG 195 Cb 0.45 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 1mf0 h ARG 195 CO 0.03 0.18 -0.15 0.35 -1.07 0.00 0.00 179.97 179.31 1mf0 h PHE 196 N 0.29 -0.38 -0.66 3.04 3.57 0.06 -1.54 116.94 121.31 1mf0 h PHE 196 Ca 0.22 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.87 1mf0 h PHE 196 Cb 0.25 0.19 -0.13 0.00 2.79 0.00 0.00 35.95 39.05 1mf0 h PHE 196 CO -0.18 -0.22 -0.17 0.87 -2.23 0.00 0.00 178.31 176.38 1mf0 h LYS 197 N -0.18 -0.00 -0.34 1.11 1.79 0.26 -1.29 116.57 117.92 1mf0 h LYS 197 Ca 0.10 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.42 1mf0 h LYS 197 Cb 0.33 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1mf0 h LYS 197 CO -0.26 -0.00 -0.38 -0.91 -1.08 0.00 0.00 179.45 176.82 1mf0 h ASN 198 N -0.00 0.87 -0.31 0.86 2.35 -0.88 -1.92 115.58 116.55 1mf0 h ASN 198 Ca 0.32 -0.39 -0.06 0.00 -0.55 0.00 0.00 56.30 55.61 1mf0 h ASN 198 Cb 0.48 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1mf0 h ASN 198 CO -0.68 1.15 -0.01 0.25 -1.65 0.00 0.00 177.43 176.49 1mf0 h LEU 199 N 0.67 0.63 -0.19 1.61 5.85 -0.61 -1.00 115.31 122.28 1mf0 h LEU 199 Ca 0.06 -0.14 -0.10 0.00 0.84 0.00 0.00 57.88 58.54 1mf0 h LEU 199 Cb 0.94 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 1mf0 h LEU 199 CO 0.09 0.71 -0.28 0.00 -0.34 0.00 0.00 178.44 178.62 1mf0 h ALA 200 N 1.37 0.29 0.00 1.25 0.00 -1.15 -2.72 119.26 118.30 1mf0 h ALA 200 Ca 0.13 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1mf0 h ALA 200 Cb 0.40 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1mf0 h ALA 200 CO 0.02 0.29 -0.17 0.45 0.00 0.00 0.00 179.25 179.84 1mf0 h HIS 201 N 0.18 0.00 -0.31 0.00 3.86 -1.11 -2.40 115.15 115.37 1mf0 h HIS 201 Ca 0.02 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.12 1mf0 h HIS 201 Cb 0.85 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.32 1mf0 h HIS 201 CO 0.09 0.17 -0.24 1.96 0.86 0.00 0.00 177.93 180.77 1mf0 h GLN 202 N 0.00 0.70 -0.40 2.45 4.20 -1.05 -2.77 115.11 118.23 1mf0 h GLN 202 Ca -0.00 -0.35 -0.08 0.00 0.06 0.00 0.00 58.65 58.28 1mf0 h GLN 202 Cb 0.30 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1mf0 h GLN 202 CO 0.02 0.96 -0.07 0.45 -0.67 0.00 0.00 178.83 179.51 1mf0 h HIS 203 N 0.45 0.75 0.00 2.96 3.86 -1.17 -2.05 115.15 119.95 1mf0 h HIS 203 Ca 0.06 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 1mf0 h HIS 203 Cb 0.80 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 29.06 1mf0 h HIS 203 CO 0.07 0.75 -0.10 1.96 0.86 0.00 0.00 177.93 181.47 1mf0 h GLN 204 N 0.64 0.00 0.00 2.45 4.20 -1.34 -0.45 115.11 120.60 1mf0 h GLN 204 Ca 0.12 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.78 1mf0 h GLN 204 Cb 0.51 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1mf0 h GLN 204 CO 0.03 0.10 -0.21 0.77 -0.67 0.00 0.00 178.83 178.85 1mf0 h SER 205 N 0.00 0.00 0.16 1.46 0.02 -1.08 0.14 113.55 114.25 1mf0 h SER 205 Ca -0.00 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.60 1mf0 h SER 205 Cb 0.22 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 1mf0 h SER 205 CO 0.01 0.21 -1.84 0.24 -1.14 0.00 0.00 176.83 174.30 1mf0 h MET 206 N 0.00 0.33 -2.83 3.45 2.86 -1.12 -3.41 114.93 114.21 1mf0 h MET 206 Ca -0.00 -0.56 -0.61 0.00 -2.06 0.00 0.00 59.70 56.47 1mf0 h MET 206 Cb 0.74 0.21 -0.41 0.00 0.06 0.00 0.00 31.60 32.20 1mf0 h MET 206 CO 0.03 1.27 -0.72 -0.06 1.06 0.00 0.00 176.91 178.49 1mf0 s PHE 207 N -2.56 2.69 -1.57 -0.22 0.40 -0.40 -4.95 117.98 111.37 1mf0 s PHE 207 Ca -0.19 -2.98 0.00 0.00 -0.60 0.00 0.00 56.93 53.16 1mf0 s PHE 207 Cb 0.06 -2.07 0.00 0.00 0.51 0.00 0.00 43.02 41.51 1mf0 s PHE 207 CO 0.81 -0.65 0.63 -0.35 0.70 0.00 0.00 175.22 176.36 1mf0 n PRO 208 N 2.29 0.00 -0.01 0.24 -0.04 0.48 0.02 135.00 137.99 1mf0 n PRO 208 Ca 0.23 0.15 -0.11 0.00 -0.04 0.00 0.00 63.50 63.73 1mf0 n PRO 208 Cb 0.39 -1.51 -0.14 0.00 -0.04 0.00 0.00 33.50 32.20 1mf0 n PRO 208 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mf0 h THR 209 N 0.00 0.87 -2.45 0.52 1.03 -1.93 -3.46 112.91 107.49 1mf0 h THR 209 Ca 0.00 -2.68 -0.53 0.00 -0.01 0.00 0.00 66.41 63.19 1mf0 h THR 209 Cb 0.02 2.48 0.01 0.00 -1.07 0.00 0.00 68.15 69.59 1mf0 h THR 209 CO 0.00 0.60 1.18 -0.22 -0.01 0.00 0.00 175.52 177.07 1mf0 s LEU 210 N -6.34 4.40 -0.05 0.00 1.98 0.10 -4.99 118.68 113.78 1mf0 s LEU 210 Ca -0.08 2.57 -0.03 0.00 -2.89 0.00 0.00 54.13 53.70 1mf0 s LEU 210 Cb 0.08 -3.53 -0.04 0.00 0.66 0.00 0.00 46.19 43.35 1mf0 s LEU 210 CO 0.82 -1.01 0.11 -1.61 -1.89 0.00 0.00 176.35 172.76 1mf0 s GLU 211 N 4.17 3.24 -0.13 1.98 2.02 -1.26 -4.80 118.70 123.92 1mf0 s GLU 211 Ca 0.84 -0.34 -0.02 0.00 0.02 0.00 0.00 54.97 55.47 1mf0 s GLU 211 Cb -0.41 -2.99 0.04 0.00 0.10 0.00 0.00 34.13 30.87 1mf0 s GLU 211 CO 0.38 0.70 -0.00 0.42 0.02 0.00 0.00 175.26 176.77 1mf0 s ILE 212 N -1.13 0.60 -1.39 -1.63 1.01 -1.26 -5.04 121.20 112.36 1mf0 s ILE 212 Ca 0.20 -0.24 -0.16 0.00 0.00 0.00 0.00 60.65 60.45 1mf0 s ILE 212 Cb -0.12 -0.85 0.05 0.00 0.01 0.00 0.00 42.46 41.55 1mf0 s ILE 212 CO 0.11 0.11 2.01 -0.67 0.00 0.00 0.00 174.94 176.49 1mf0 n ASP 213 N 5.06 4.35 -0.02 3.58 2.03 -1.26 -4.86 116.55 125.43 1mf0 n ASP 213 Ca -0.09 -2.88 -0.01 0.00 0.52 0.00 0.00 54.79 52.34 1mf0 n ASP 213 Cb 0.49 -1.70 -0.01 0.00 -0.72 0.00 0.00 41.12 39.19 1mf0 n ASP 213 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1mf0 n VAL 214 N 5.64 -0.04 -0.24 5.18 0.31 -1.26 -1.44 118.33 126.48 1mf0 n VAL 214 Ca 0.50 1.36 0.18 0.00 -0.01 0.00 0.00 64.34 66.37 1mf0 n VAL 214 Cb 0.42 -1.80 0.50 0.00 -0.91 0.00 0.00 33.84 32.06 1mf0 n VAL 214 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1mf0 h GLU 215 N 0.00 0.41 0.43 5.55 4.39 -1.98 0.98 114.58 124.36 1mf0 h GLU 215 Ca 0.01 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 1mf0 h GLU 215 Cb 0.02 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1mf0 h GLU 215 CO -0.05 0.27 -0.20 0.78 -1.16 0.00 0.00 179.01 178.65 1mf0 h GLY 216 N 0.42 -0.60 0.18 -3.84 0.00 -1.65 0.13 103.07 97.72 1mf0 h GLY 216 Ca 0.46 0.22 0.06 0.00 0.00 0.00 0.00 47.33 48.07 1mf0 h GLY 216 CO -0.18 -0.22 -0.24 1.46 0.00 0.00 0.00 176.54 177.37 1mf0 h GLN 217 N -0.59 -0.25 -0.66 4.80 4.20 -1.17 0.33 115.11 121.76 1mf0 h GLN 217 Ca -0.06 0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.81 1mf0 h GLN 217 Cb 0.44 0.06 -0.11 0.00 0.30 0.00 0.00 27.48 28.17 1mf0 h GLN 217 CO 0.10 -0.17 0.05 -0.07 -0.67 0.00 0.00 178.83 178.07 1mf0 h LEU 218 N -0.26 -0.19 -0.60 1.46 3.38 -0.82 0.53 115.31 118.80 1mf0 h LEU 218 Ca 0.13 0.15 -0.09 0.00 0.09 0.00 0.00 57.88 58.16 1mf0 h LEU 218 Cb 0.46 0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1mf0 h LEU 218 CO -0.37 -0.09 0.04 0.11 0.09 0.00 0.00 178.44 178.21 1mf0 h LYS 219 N 0.16 1.04 -0.27 1.13 6.56 0.42 -2.37 116.57 123.24 1mf0 h LYS 219 Ca 0.36 -0.31 -0.09 0.00 -1.06 0.00 0.00 60.65 59.54 1mf0 h LYS 219 Cb 0.59 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 32.13 1mf0 h LYS 219 CO -0.53 1.00 -0.23 0.00 -2.06 0.00 0.00 179.45 177.63 1mf0 h ARG 220 N 0.94 0.51 -0.76 3.15 3.08 0.53 -2.85 114.38 118.97 1mf0 h ARG 220 Ca 0.17 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1mf0 h ARG 220 Cb 0.51 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 1mf0 h ARG 220 CO 0.02 0.70 0.48 -0.07 -1.07 0.00 0.00 179.97 180.04 1mf0 h LEU 221 N 0.45 0.90 -1.43 3.04 3.38 0.47 -0.99 115.31 121.13 1mf0 h LEU 221 Ca 0.07 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1mf0 h LEU 221 Cb 0.65 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1mf0 h LEU 221 CO 0.05 0.67 0.05 0.50 0.09 0.00 0.00 178.44 179.79 1mf0 h LYS 222 N 1.04 0.42 0.68 1.13 3.64 -1.20 0.30 116.57 122.59 1mf0 h LYS 222 Ca 0.28 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1mf0 h LYS 222 Cb -0.08 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1mf0 h LYS 222 CO -0.06 0.42 -0.33 0.78 -2.27 0.00 0.00 179.45 177.99 1mf0 h GLY 223 N 0.68 -0.96 -0.11 5.01 0.00 -1.18 -2.57 103.07 103.94 1mf0 h GLY 223 Ca 0.10 0.35 0.24 0.00 0.00 0.00 0.00 47.33 48.03 1mf0 h GLY 223 CO 0.00 -0.35 0.62 0.74 0.00 0.00 0.00 176.54 177.55 1mf0 h PHE 224 N -1.20 0.94 0.61 5.60 0.04 -0.94 -1.03 116.94 120.96 1mf0 h PHE 224 Ca -0.09 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 1mf0 h PHE 224 Cb 0.72 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 1mf0 h PHE 224 CO 0.00 0.09 -0.49 0.00 -0.60 0.00 0.00 178.31 177.30 1mf0 h ALA 225 N 1.69 -1.17 0.00 2.45 0.00 -0.28 0.52 119.26 122.48 1mf0 h ALA 225 Ca 0.63 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.32 1mf0 h ALA 225 Cb 1.25 0.67 -0.00 0.00 0.00 0.00 0.00 17.79 19.71 1mf0 h ALA 225 CO -0.42 -1.19 -0.01 0.93 0.00 0.00 0.00 179.25 178.56 1mf0 h GLU 226 N -1.08 0.00 0.16 0.00 4.39 -0.87 0.13 114.58 117.31 1mf0 h GLU 226 Ca -0.08 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.33 1mf0 h GLU 226 Cb 0.90 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.56 1mf0 h GLU 226 CO 0.00 0.01 -1.44 -0.09 -1.16 0.00 0.00 179.01 176.33 1mf0 h ARG 227 N 0.00 0.33 0.00 2.33 2.43 -0.58 -3.36 114.38 115.53 1mf0 h ARG 227 Ca -0.00 -0.56 -0.15 0.00 -0.81 0.00 0.00 59.98 58.46 1mf0 h ARG 227 Cb 0.15 0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1mf0 h ARG 227 CO 0.00 1.27 -0.71 0.97 -1.51 0.00 0.00 179.97 180.00 1mf0 h ILE 228 N -0.14 1.38 -0.89 1.20 6.09 0.51 -3.38 117.51 122.28 1mf0 h ILE 228 Ca -0.29 -2.52 0.18 0.00 -1.37 0.00 0.00 64.86 60.85 1mf0 h ILE 228 Cb 1.89 2.41 -0.17 0.00 0.47 0.00 0.00 36.82 41.42 1mf0 h ILE 228 CO 0.13 0.69 -0.22 -1.14 -3.07 0.00 0.00 178.15 174.54 1mf0 n ARG 229 N -3.51 -0.08 0.28 2.19 0.63 0.41 -1.18 116.66 115.40 1mf0 n ARG 229 Ca -0.00 1.38 0.16 0.00 -0.92 0.00 0.00 57.85 58.47 1mf0 n ARG 229 Cb 0.74 -2.07 0.80 0.00 0.45 0.00 0.00 32.46 32.38 1mf0 n ARG 229 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1mf0 h PRO 230 N 0.00 0.00 -0.00 -0.14 0.13 -1.82 -2.85 132.00 127.32 1mf0 h PRO 230 Ca 0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.56 1mf0 h PRO 230 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1mf0 h PRO 230 CO -0.91 0.07 -0.61 -1.33 -0.23 0.00 0.00 178.00 174.99 1mf0 n MET 231 N -3.38 0.05 -2.74 0.86 2.81 -0.32 -4.92 117.12 109.47 1mf0 n MET 231 Ca -0.01 -0.03 -0.40 0.00 -1.81 0.00 0.00 57.70 55.45 1mf0 n MET 231 Cb 0.23 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.18 1mf0 n MET 231 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1mf0 s VAL 232 N -2.97 4.06 0.24 2.03 1.01 -1.08 -0.42 120.40 123.27 1mf0 s VAL 232 Ca 0.11 2.02 -0.17 0.00 0.00 0.00 0.00 61.98 63.94 1mf0 s VAL 232 Cb 0.17 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 32.31 1mf0 s VAL 232 CO 0.73 0.44 0.58 -0.13 0.00 0.00 0.00 175.10 176.71 1mf0 s ARG 233 N -1.33 1.58 -0.40 2.72 0.52 -0.32 -4.88 118.95 116.84 1mf0 s ARG 233 Ca 0.43 -1.04 -0.29 0.00 -0.52 0.00 0.00 55.73 54.31 1mf0 s ARG 233 Cb -0.25 0.53 0.00 0.00 0.52 0.00 0.00 34.95 35.75 1mf0 s ARG 233 CO 0.31 -0.69 1.52 0.34 0.02 0.00 0.00 175.30 176.80 1mf0 s ASP 234 N -2.94 6.20 0.20 0.23 2.15 -1.26 -0.48 116.67 120.77 1mf0 s ASP 234 Ca 0.15 0.93 -0.10 0.00 0.43 0.00 0.00 52.55 53.96 1mf0 s ASP 234 Cb -0.03 -2.54 0.13 0.00 -0.30 0.00 0.00 42.92 40.19 1mf0 s ASP 234 CO 0.05 -1.52 1.79 1.23 -0.17 0.00 0.00 175.17 176.55 1mf0 h GLY 235 N 12.65 1.12 1.00 2.66 0.00 -1.91 -0.45 103.07 118.13 1mf0 h GLY 235 Ca -0.29 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.47 1mf0 h GLY 235 CO 1.08 0.52 -0.21 -2.08 0.00 0.00 0.00 176.54 175.85 1mf0 h VAL 236 N 1.02 0.56 0.64 4.60 2.07 -1.91 0.03 116.25 123.27 1mf0 h VAL 236 Ca 0.25 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.72 1mf0 h VAL 236 Cb 0.11 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1mf0 h VAL 236 CO -0.03 0.00 -0.35 0.22 0.02 0.00 0.00 177.57 177.44 1mf0 h TYR 237 N -0.61 -0.90 -0.49 1.57 5.03 -1.95 0.56 116.97 120.19 1mf0 h TYR 237 Ca -0.06 -0.02 0.08 0.00 2.58 0.00 0.00 58.73 61.31 1mf0 h TYR 237 Cb 0.46 0.31 -0.10 0.00 1.55 0.00 0.00 36.73 38.96 1mf0 h TYR 237 CO -0.04 -0.54 -0.44 0.35 -1.32 0.00 0.00 178.16 176.16 1mf0 h PHE 238 N -0.92 -1.29 -0.26 -3.82 3.04 -1.01 0.16 116.94 112.84 1mf0 h PHE 238 Ca -0.08 0.08 -0.05 0.00 3.98 0.00 0.00 57.97 61.90 1mf0 h PHE 238 Cb 0.72 0.63 -0.01 0.00 2.56 0.00 0.00 35.95 39.85 1mf0 h PHE 238 CO -0.06 -0.44 -0.04 1.98 -2.02 0.00 0.00 178.31 177.74 1mf0 h MET 239 N -0.29 0.39 0.13 1.11 4.05 -0.92 -2.41 114.93 117.00 1mf0 h MET 239 Ca 0.15 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 59.48 1mf0 h MET 239 Cb 0.57 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 1mf0 h MET 239 CO -0.63 0.45 -0.06 -0.92 0.23 0.00 0.00 176.91 175.98 1mf0 h TYR 240 N 0.38 -0.16 -0.91 1.39 3.20 0.92 -2.56 116.97 119.22 1mf0 h TYR 240 Ca 0.08 -0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.12 1mf0 h TYR 240 Cb 0.32 0.05 -0.10 0.00 1.54 0.00 0.00 36.73 38.54 1mf0 h TYR 240 CO 0.01 0.16 0.49 0.93 -1.64 0.00 0.00 178.16 178.11 1mf0 h GLU 241 N -0.50 0.62 0.00 1.82 4.39 -0.59 -1.15 114.58 119.17 1mf0 h GLU 241 Ca -0.02 -0.04 -0.11 0.00 0.34 0.00 0.00 59.36 59.53 1mf0 h GLU 241 Cb 0.40 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 1mf0 h GLU 241 CO 0.03 0.41 -0.54 0.00 -1.16 0.00 0.00 179.01 177.75 1mf0 h ALA 242 N 1.61 1.10 0.00 3.43 0.00 -1.37 -1.98 119.26 122.04 1mf0 h ALA 242 Ca 0.52 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1mf0 h ALA 242 Cb 0.80 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1mf0 h ALA 242 CO -0.39 0.67 -0.77 1.28 0.00 0.00 0.00 179.25 180.05 1mf0 n LEU 243 N -3.88 0.64 -0.10 0.00 4.77 -0.51 -4.16 117.00 113.76 1mf0 n LEU 243 Ca -0.01 0.10 0.01 0.00 -0.03 0.00 0.00 56.01 56.08 1mf0 n LEU 243 Cb 0.55 -0.16 0.01 0.00 -2.33 0.00 0.00 43.42 41.49 1mf0 n LEU 243 CO 0.41 0.01 0.27 1.41 -1.33 0.00 0.00 177.39 178.16 1mf0 n HIS 244 N -1.97 0.00 -0.40 -1.77 8.25 -0.73 0.60 115.22 119.20 1mf0 n HIS 244 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1mf0 n HIS 244 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 1mf0 n HIS 244 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mf0 n GLY 245 N 0.22 1.58 3.74 -1.41 0.00 -0.75 -4.98 105.19 103.59 1mf0 n GLY 245 Ca 0.02 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 1mf0 n GLY 245 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1mf0 s PRO 246 N 2.95 4.26 0.10 1.61 0.04 -1.26 -4.86 135.00 137.85 1mf0 s PRO 246 Ca 0.00 2.31 -0.27 0.00 0.04 0.00 0.00 61.00 63.07 1mf0 s PRO 246 Cb 0.00 -3.11 -0.15 0.00 0.04 0.00 0.00 34.50 31.28 1mf0 s PRO 246 CO 0.00 -0.43 0.61 -0.35 0.04 0.00 0.00 177.00 176.87 1mf0 n PRO 247 N 2.42 0.00 -4.02 0.56 -0.04 -1.26 -4.94 135.00 127.73 1mf0 n PRO 247 Ca 0.07 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.45 1mf0 n PRO 247 Cb 0.40 -0.99 -0.11 0.00 -0.04 0.00 0.00 33.50 32.77 1mf0 n PRO 247 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1mf0 s LYS 248 N -0.51 0.43 -0.51 0.54 1.02 -1.26 -5.11 119.74 114.33 1mf0 s LYS 248 Ca 0.62 -0.83 -0.16 0.00 0.02 0.00 0.00 55.97 55.62 1mf0 s LYS 248 Cb -0.88 0.15 0.10 0.00 -0.52 0.00 0.00 37.83 36.68 1mf0 s LYS 248 CO 0.47 -0.08 0.48 0.15 -0.92 0.00 0.00 175.35 175.45 1mf0 s LYS 249 N -2.38 3.00 -0.14 1.68 1.02 -1.26 -4.77 119.74 116.89 1mf0 s LYS 249 Ca -0.07 -1.47 -0.04 0.00 0.02 0.00 0.00 55.97 54.40 1mf0 s LYS 249 Cb -0.03 -4.21 -0.03 0.00 -0.52 0.00 0.00 37.83 33.03 1mf0 s LYS 249 CO -0.04 -1.21 -0.00 0.08 -0.92 0.00 0.00 175.35 173.25 1mf0 s VAL 250 N 1.77 4.21 -0.10 3.17 1.01 -1.26 -0.34 120.40 128.86 1mf0 s VAL 250 Ca 0.05 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.81 1mf0 s VAL 250 Cb -0.26 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.28 1mf0 s VAL 250 CO 0.05 0.52 -0.21 -0.22 0.00 0.00 0.00 175.10 175.24 1mf0 s LEU 251 N -0.03 2.25 -0.26 3.92 0.20 0.19 -1.52 118.68 123.42 1mf0 s LEU 251 Ca 0.03 -0.50 -0.06 0.00 0.69 0.00 0.00 54.13 54.29 1mf0 s LEU 251 Cb -0.13 -1.46 -0.00 0.00 -0.43 0.00 0.00 46.19 44.17 1mf0 s LEU 251 CO 0.02 0.17 0.04 -0.69 -0.29 0.00 0.00 176.35 175.60 1mf0 s VAL 252 N 0.30 3.82 -0.48 1.68 1.01 0.27 0.05 120.40 127.05 1mf0 s VAL 252 Ca -0.16 -0.56 -0.20 0.00 0.00 0.00 0.00 61.98 61.06 1mf0 s VAL 252 Cb -0.17 -2.88 0.04 0.00 0.00 0.00 0.00 36.38 33.37 1mf0 s VAL 252 CO 0.08 0.22 0.64 -0.70 0.00 0.00 0.00 175.10 175.34 1mf0 s GLU 253 N 1.51 3.19 0.63 2.72 2.12 0.23 -1.50 118.70 127.59 1mf0 s GLU 253 Ca 0.04 -0.65 -0.11 0.00 0.36 0.00 0.00 54.97 54.60 1mf0 s GLU 253 Cb -0.16 -4.03 -0.03 0.00 0.26 0.00 0.00 34.13 30.17 1mf0 s GLU 253 CO 0.01 -1.13 1.03 0.20 -0.54 0.00 0.00 175.26 174.83 1mf0 s GLY 254 N 2.38 1.69 0.35 -1.50 0.00 -0.20 -4.13 107.32 105.90 1mf0 s GLY 254 Ca 0.19 -0.04 0.09 0.00 0.00 0.00 0.00 44.72 44.96 1mf0 s GLY 254 CO 0.15 0.24 -0.05 0.00 0.00 0.00 0.00 173.10 173.44 1mf0 s ALA 255 N -3.12 3.06 0.00 3.20 0.00 -1.26 -4.87 121.76 118.77 1mf0 s ALA 255 Ca 0.56 -2.07 0.00 0.00 0.00 0.00 0.00 51.96 50.45 1mf0 s ALA 255 Cb -0.12 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.86 1mf0 s ALA 255 CO 0.53 0.06 0.00 0.09 0.00 0.00 0.00 175.76 176.44 1mf0 n ASN 256 N -0.86 0.00 -3.45 0.00 5.03 -1.26 -4.74 115.26 109.97 1mf0 n ASN 256 Ca -0.05 0.00 -0.03 0.00 0.87 0.00 0.00 54.58 55.37 1mf0 n ASN 256 Cb 0.63 0.00 0.01 0.00 -1.02 0.00 0.00 39.78 39.40 1mf0 n ASN 256 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1mf0 s ALA 257 N -1.64 -1.56 0.14 5.41 0.00 -1.26 -4.18 121.76 118.66 1mf0 s ALA 257 Ca 0.00 -0.21 -0.25 0.00 0.00 0.00 0.00 51.96 51.50 1mf0 s ALA 257 Cb 0.00 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.81 1mf0 s ALA 257 CO 0.00 -1.05 1.62 0.00 0.00 0.00 0.00 175.76 176.32 1mf0 h ALA 258 N 2.00 -0.33 0.00 0.00 0.00 -0.76 -1.53 119.26 118.63 1mf0 h ALA 258 Ca -0.27 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1mf0 h ALA 258 Cb 1.22 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1mf0 h ALA 258 CO 0.33 -0.77 0.00 1.28 0.00 0.00 0.00 179.25 180.09 1mf0 n LEU 259 N -5.40 0.09 -0.22 0.00 4.32 -0.51 -1.56 117.00 113.72 1mf0 n LEU 259 Ca -0.03 -0.04 0.03 0.00 -0.02 0.00 0.00 56.01 55.95 1mf0 n LEU 259 Cb 0.32 -0.04 0.02 0.00 -1.62 0.00 0.00 43.42 42.09 1mf0 n LEU 259 CO 0.16 0.02 0.32 0.18 -1.22 0.00 0.00 177.39 176.86 1mf0 n LEU 260 N -0.44 1.42 -4.73 2.23 4.77 -0.61 -1.75 117.00 117.89 1mf0 n LEU 260 Ca 0.00 -0.97 -0.42 0.00 -0.03 0.00 0.00 56.01 54.59 1mf0 n LEU 260 Cb 0.02 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1mf0 n LEU 260 CO 0.00 0.30 1.26 -0.62 -1.33 0.00 0.00 177.39 176.99 1mf0 s ASP 261 N -0.54 6.48 0.50 -1.43 -1.08 -0.60 -0.73 116.67 119.27 1mf0 s ASP 261 Ca 0.07 2.78 0.25 0.00 -0.52 0.00 0.00 52.55 55.12 1mf0 s ASP 261 Cb 0.05 -2.61 1.33 0.00 -1.46 0.00 0.00 42.92 40.22 1mf0 s ASP 261 CO 0.08 -0.87 1.92 -0.29 0.52 0.00 0.00 175.17 176.53 1mf0 h ILE 262 N 3.74 0.66 0.00 4.11 6.09 -1.39 0.29 117.51 131.01 1mf0 h ILE 262 Ca -0.44 -0.05 -0.32 0.00 -1.37 0.00 0.00 64.86 62.68 1mf0 h ILE 262 Cb 1.21 0.52 -0.05 0.00 0.47 0.00 0.00 36.82 38.97 1mf0 h ILE 262 CO 0.88 0.02 -1.78 0.47 -3.07 0.00 0.00 178.15 174.68 1mf0 n ASP 263 N -4.38 1.90 0.01 2.19 8.00 -1.26 -4.71 116.55 118.30 1mf0 n ASP 263 Ca 0.16 0.39 0.11 0.00 0.71 0.00 0.00 54.79 56.15 1mf0 n ASP 263 Cb 0.75 -0.91 -0.06 0.00 -0.02 0.00 0.00 41.12 40.88 1mf0 n ASP 263 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1mf0 n PHE 264 N -4.36 0.07 -0.82 1.24 3.72 -1.14 -4.89 117.46 111.27 1mf0 n PHE 264 Ca -0.41 0.02 -0.10 0.00 -0.05 0.00 0.00 57.45 56.91 1mf0 n PHE 264 Cb 0.76 -0.23 0.08 0.00 -0.94 0.00 0.00 39.48 39.15 1mf0 n PHE 264 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1mf0 n GLY 265 N 1.42 -2.28 2.69 1.37 0.00 0.10 -4.84 105.19 103.65 1mf0 n GLY 265 Ca 0.02 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.16 1mf0 n GLY 265 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mf0 n THR 266 N -3.18 3.05 -1.61 2.61 -2.24 -0.72 -4.90 114.28 107.29 1mf0 n THR 266 Ca 0.05 -2.21 -0.44 0.00 -2.27 0.00 0.00 64.05 59.18 1mf0 n THR 266 Cb 0.20 -2.44 -0.01 0.00 -2.10 0.00 0.00 70.33 65.99 1mf0 n THR 266 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mf0 n TYR 267 N 5.38 1.43 1.20 4.78 9.36 -1.26 -0.38 117.16 137.67 1mf0 n TYR 267 Ca 0.56 0.67 0.09 0.00 3.32 0.00 0.00 57.90 62.54 1mf0 n TYR 267 Cb 0.30 -2.28 0.32 0.00 -0.63 0.00 0.00 39.34 37.05 1mf0 n TYR 267 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1mf0 n PRO 268 N 0.65 1.69 -1.92 2.98 -0.04 -1.26 -4.38 135.00 132.72 1mf0 n PRO 268 Ca 0.09 -1.05 -0.41 0.00 -0.04 0.00 0.00 63.50 62.09 1mf0 n PRO 268 Cb 0.33 -1.34 -0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1mf0 n PRO 268 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1mf0 n PHE 269 N 0.29 2.91 -4.10 0.54 3.72 0.49 -4.83 117.46 116.48 1mf0 n PHE 269 Ca 0.14 -2.90 -0.16 0.00 -0.05 0.00 0.00 57.45 54.49 1mf0 n PHE 269 Cb 0.30 -2.18 -0.04 0.00 -0.94 0.00 0.00 39.48 36.62 1mf0 n PHE 269 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1mf0 n VAL 270 N 3.46 0.00 -2.87 -4.37 0.24 -1.26 -4.42 118.33 109.11 1mf0 n VAL 270 Ca 0.55 -1.92 -0.21 0.00 -2.04 0.00 0.00 64.34 60.72 1mf0 n VAL 270 Cb 0.32 1.14 0.02 0.00 -1.47 0.00 0.00 33.84 33.85 1mf0 n VAL 270 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1mf0 s THR 271 N -2.91 3.19 -0.45 3.34 -1.32 0.09 -5.00 115.64 112.59 1mf0 s THR 271 Ca 0.31 -0.71 0.05 0.00 -1.21 0.00 0.00 61.69 60.13 1mf0 s THR 271 Cb -0.01 -3.16 0.39 0.00 -1.51 0.00 0.00 72.50 68.21 1mf0 s THR 271 CO 0.22 -0.10 1.28 -1.20 -2.21 0.00 0.00 174.62 172.62 1mf0 n SER 272 N -2.12 3.41 -4.18 8.08 7.64 -1.26 -3.32 113.62 121.86 1mf0 n SER 272 Ca 0.06 -2.62 -0.11 0.00 1.01 0.00 0.00 58.87 57.20 1mf0 n SER 272 Cb 0.59 -0.63 -0.10 0.00 -1.01 0.00 0.00 64.21 63.06 1mf0 n SER 272 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1mf0 s SER 273 N -0.30 0.82 -0.74 6.43 1.04 -1.26 -4.90 113.70 114.79 1mf0 s SER 273 Ca 0.28 -1.15 -0.22 0.00 0.48 0.00 0.00 55.95 55.34 1mf0 s SER 273 Cb 0.23 0.18 0.08 0.00 0.10 0.00 0.00 66.02 66.61 1mf0 s SER 273 CO 0.07 -0.61 1.05 0.20 0.98 0.00 0.00 173.24 174.93 1mf0 s ASN 274 N -3.09 6.27 0.00 7.02 -0.87 -1.26 -1.96 114.94 121.05 1mf0 s ASN 274 Ca 0.21 -1.16 0.25 0.00 -1.57 0.00 0.00 52.86 50.59 1mf0 s ASN 274 Cb 0.07 -2.44 1.12 0.00 -0.02 0.00 0.00 41.25 39.98 1mf0 s ASN 274 CO 0.01 -1.42 1.81 0.00 -2.57 0.00 0.00 177.10 174.93 1mf0 s THR 276 N -2.91 1.89 0.48 0.00 -4.23 -1.26 -4.70 115.64 104.91 1mf0 s THR 276 Ca 0.15 0.00 0.20 0.00 -1.18 0.00 0.00 61.69 60.86 1mf0 s THR 276 Cb 0.17 -2.85 0.37 0.00 1.34 0.00 0.00 72.50 71.53 1mf0 s THR 276 CO 0.44 0.00 1.97 1.62 -0.54 0.00 0.00 174.62 178.11 1mf0 h VAL 277 N -1.85 0.78 -0.01 2.29 3.04 -1.88 -0.51 116.25 118.11 1mf0 h VAL 277 Ca -0.45 -0.07 -0.01 0.00 -1.01 0.00 0.00 66.70 65.16 1mf0 h VAL 277 Cb 1.26 0.57 -0.00 0.00 -2.01 0.00 0.00 31.29 31.11 1mf0 h VAL 277 CO 0.40 0.04 -0.04 1.23 -1.01 0.00 0.00 177.57 178.19 1mf0 h GLY 278 N 0.19 0.01 2.00 3.17 0.00 -1.90 -1.12 103.07 105.43 1mf0 h GLY 278 Ca 0.29 -0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.61 1mf0 h GLY 278 CO -0.05 0.01 -0.00 -1.33 0.00 0.00 0.00 176.54 175.16 1mf0 h GLY 279 N 0.15 0.00 0.85 4.60 0.00 -1.19 -1.41 103.07 106.07 1mf0 h GLY 279 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1mf0 h GLY 279 CO 0.01 0.00 -0.40 -2.08 0.00 0.00 0.00 176.54 174.06 1mf0 h VAL 280 N 0.00 1.36 -0.19 4.60 2.07 -1.34 0.28 116.25 123.03 1mf0 h VAL 280 Ca -0.00 -1.69 -0.15 0.00 0.82 0.00 0.00 66.70 65.68 1mf0 h VAL 280 Cb 0.04 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1mf0 h VAL 280 CO 0.00 0.51 -0.50 0.00 0.02 0.00 0.00 177.57 177.60 1mf0 h THR 282 N 0.42 1.35 0.00 0.00 2.02 -1.28 -1.09 112.91 114.32 1mf0 h THR 282 Ca 0.02 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 65.99 1mf0 h THR 282 Cb 1.02 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 69.37 1mf0 h THR 282 CO 0.09 0.34 0.00 1.23 0.37 0.00 0.00 175.52 177.55 1mf0 h GLY 283 N -0.18 0.00 0.00 2.16 0.00 -0.46 -3.36 103.07 101.24 1mf0 h GLY 283 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1mf0 h GLY 283 CO 0.02 0.00 -0.65 1.04 0.00 0.00 0.00 176.54 176.95 1mf0 n LEU 284 N -2.38 0.00 -0.82 3.11 4.77 -0.85 -1.18 117.00 119.65 1mf0 n LEU 284 Ca 0.05 -0.16 -0.05 0.00 -0.03 0.00 0.00 56.01 55.82 1mf0 n LEU 284 Cb 0.44 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.53 1mf0 n LEU 284 CO 0.30 0.00 -0.00 0.61 -1.33 0.00 0.00 177.39 176.97 1mf0 n GLY 285 N 1.94 0.43 3.40 -0.72 0.00 -0.42 -4.60 105.19 105.22 1mf0 n GLY 285 Ca 0.00 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 1mf0 n GLY 285 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1mf0 s ILE 286 N -2.65 2.62 0.81 -0.61 -4.36 -1.22 -4.96 121.20 110.84 1mf0 s ILE 286 Ca 0.06 -0.90 -0.11 0.00 -0.26 0.00 0.00 60.65 59.44 1mf0 s ILE 286 Cb -0.03 -1.98 0.08 0.00 1.25 0.00 0.00 42.46 41.78 1mf0 s ILE 286 CO 0.08 0.58 1.10 -2.16 0.24 0.00 0.00 174.94 174.77 1mf0 s PRO 287 N -0.70 1.94 0.40 0.37 0.04 -1.26 -4.33 135.00 131.46 1mf0 s PRO 287 Ca 0.11 1.18 0.10 0.00 0.04 0.00 0.00 61.00 62.43 1mf0 s PRO 287 Cb -0.10 -1.86 0.89 0.00 0.04 0.00 0.00 34.50 33.47 1mf0 s PRO 287 CO -0.00 -1.87 1.97 -1.00 0.04 0.00 0.00 177.00 176.14 1mf0 h PRO 288 N -1.30 0.55 0.00 0.56 0.13 -1.99 -1.19 132.00 128.77 1mf0 h PRO 288 Ca -0.44 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1mf0 h PRO 288 Cb 1.24 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1mf0 h PRO 288 CO 0.50 0.36 0.00 -0.56 -0.23 0.00 0.00 178.00 178.08 1mf0 h GLN 289 N 0.57 0.00 -0.21 0.86 -0.00 -2.00 -1.35 115.11 112.98 1mf0 h GLN 289 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.94 1mf0 h GLN 289 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.86 1mf0 h GLN 289 CO -0.09 0.00 0.00 0.09 -0.00 0.00 0.00 178.83 178.83 1mf0 n ASN 290 N -2.47 1.59 -4.61 0.06 4.13 -0.45 -4.78 115.26 108.73 1mf0 n ASN 290 Ca 0.02 -1.79 -0.35 0.00 1.68 0.00 0.00 54.58 54.14 1mf0 n ASN 290 Cb 0.24 -0.14 -0.10 0.00 -1.54 0.00 0.00 39.78 38.25 1mf0 n ASN 290 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1mf0 s ILE 291 N -1.73 4.68 0.00 2.41 1.01 -0.51 -0.15 121.20 126.91 1mf0 s ILE 291 Ca 0.28 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.86 1mf0 s ILE 291 Cb 0.15 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.51 1mf0 s ILE 291 CO 0.22 0.45 0.00 0.61 0.00 0.00 0.00 174.94 176.22 1mf0 n GLY 292 N 3.65 1.18 3.68 6.18 0.00 0.14 -4.78 105.19 115.24 1mf0 n GLY 292 Ca -0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.41 1mf0 n GLY 292 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mf0 n ASP 293 N 0.00 3.30 -4.02 1.61 10.43 -1.25 -4.83 116.55 121.79 1mf0 n ASP 293 Ca 0.00 1.09 -0.31 0.00 2.57 0.00 0.00 54.79 58.13 1mf0 n ASP 293 Cb 0.00 -1.47 -0.15 0.00 1.84 0.00 0.00 41.12 41.34 1mf0 n ASP 293 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1mf0 s VAL 294 N 0.80 2.00 -0.24 2.53 1.01 -1.26 0.23 120.40 125.46 1mf0 s VAL 294 Ca 0.76 -1.63 -0.12 0.00 0.00 0.00 0.00 61.98 60.99 1mf0 s VAL 294 Cb -0.63 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 1mf0 s VAL 294 CO 0.39 -0.14 0.22 -0.31 0.00 0.00 0.00 175.10 175.26 1mf0 s TYR 295 N 1.16 3.31 -0.35 5.22 2.02 0.97 0.14 117.35 129.80 1mf0 s TYR 295 Ca -0.05 0.29 -0.18 0.00 -0.37 0.00 0.00 57.07 56.76 1mf0 s TYR 295 Cb -0.20 -2.35 -0.00 0.00 -0.40 0.00 0.00 41.96 39.01 1mf0 s TYR 295 CO -0.06 -0.00 0.52 0.20 -1.57 0.00 0.00 175.55 174.63 1mf0 s GLY 296 N 1.21 1.82 -0.26 0.71 0.00 -0.64 -0.98 107.32 109.18 1mf0 s GLY 296 Ca 0.10 -1.02 -0.26 0.00 0.00 0.00 0.00 44.72 43.54 1mf0 s GLY 296 CO 0.06 1.28 0.92 0.14 0.00 0.00 0.00 173.10 175.51 1mf0 s VAL 297 N 2.41 4.73 -0.10 1.40 1.01 0.15 -0.98 120.40 129.02 1mf0 s VAL 297 Ca 0.19 1.67 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1mf0 s VAL 297 Cb -0.15 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 32.02 1mf0 s VAL 297 CO 0.13 -0.20 -0.08 0.54 0.00 0.00 0.00 175.10 175.49 1mf0 s VAL 298 N 3.10 0.98 0.51 2.92 0.11 0.18 -2.40 120.40 125.80 1mf0 s VAL 298 Ca 0.39 -0.30 -0.21 0.00 -2.93 0.00 0.00 61.98 58.93 1mf0 s VAL 298 Cb -0.14 -0.98 -0.06 0.00 -1.53 0.00 0.00 36.38 33.66 1mf0 s VAL 298 CO 0.09 0.35 1.17 -0.75 -3.33 0.00 0.00 175.10 172.63 1mf0 s LYS 299 N 1.43 3.48 0.00 1.54 2.20 -1.26 -1.35 119.74 125.78 1mf0 s LYS 299 Ca -0.01 1.75 0.12 0.00 -0.36 0.00 0.00 55.97 57.47 1mf0 s LYS 299 Cb -0.13 -2.19 0.63 0.00 -1.51 0.00 0.00 37.83 34.63 1mf0 s LYS 299 CO -0.05 -0.78 1.24 0.00 -0.36 0.00 0.00 175.35 175.40 1mf0 n ALA 300 N -0.96 1.78 -3.38 3.13 0.00 0.50 -4.68 120.51 116.90 1mf0 n ALA 300 Ca 0.10 -0.06 -0.09 0.00 0.00 0.00 0.00 53.44 53.39 1mf0 n ALA 300 Cb 0.49 -1.19 -0.04 0.00 0.00 0.00 0.00 19.45 18.71 1mf0 n ALA 300 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1mf0 s TYR 301 N -2.39 0.28 -0.00 0.00 1.13 -1.26 -4.39 117.35 110.71 1mf0 s TYR 301 Ca 0.13 -0.68 -0.01 0.00 -1.41 0.00 0.00 57.07 55.10 1mf0 s TYR 301 Cb 0.08 0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 41.26 1mf0 s TYR 301 CO 0.17 -1.13 0.09 0.99 -2.51 0.00 0.00 175.55 173.15 1mf0 s THR 302 N -3.70 4.77 -0.01 -3.49 2.01 0.24 -4.83 115.64 110.63 1mf0 s THR 302 Ca 0.20 -0.40 -0.04 0.00 0.31 0.00 0.00 61.69 61.76 1mf0 s THR 302 Cb -0.02 -3.19 -0.00 0.00 0.01 0.00 0.00 72.50 69.30 1mf0 s THR 302 CO 0.10 0.35 0.08 0.42 -0.69 0.00 0.00 174.62 174.87 1mf0 s THR 303 N -1.21 0.05 -0.03 -0.82 -4.23 -1.26 -0.72 115.64 107.43 1mf0 s THR 303 Ca 0.23 -0.43 -0.01 0.00 -1.18 0.00 0.00 61.69 60.30 1mf0 s THR 303 Cb -0.12 -0.26 0.02 0.00 1.34 0.00 0.00 72.50 73.48 1mf0 s THR 303 CO 0.14 -0.23 0.06 -0.60 -0.54 0.00 0.00 174.62 173.45 1mf0 s ARG 304 N -0.75 0.03 -0.21 3.99 3.52 -0.79 -4.16 118.95 120.58 1mf0 s ARG 304 Ca -0.08 0.18 -0.06 0.00 -0.13 0.00 0.00 55.73 55.64 1mf0 s ARG 304 Cb -0.05 -0.12 -0.20 0.00 -1.56 0.00 0.00 34.95 33.02 1mf0 s ARG 304 CO 0.00 -0.10 0.02 1.55 -0.81 0.00 0.00 175.30 175.96 1mf0 n VAL 305 N 3.74 1.61 -1.13 7.11 3.14 -1.26 -1.10 118.33 130.43 1mf0 n VAL 305 Ca -0.21 -0.52 0.00 0.00 -2.96 0.00 0.00 64.34 60.65 1mf0 n VAL 305 Cb 0.54 -1.66 0.00 0.00 -1.06 0.00 0.00 33.84 31.66 1mf0 n VAL 305 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1mf0 n GLY 306 N 1.94 -0.22 3.86 7.55 0.00 -1.26 -4.71 105.19 112.35 1mf0 n GLY 306 Ca -0.41 -1.77 -0.30 0.00 0.00 0.00 0.00 46.02 43.54 1mf0 n GLY 306 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mf0 s ILE 307 N -0.09 3.53 0.00 -0.61 -1.09 -0.84 -4.98 121.20 117.12 1mf0 s ILE 307 Ca 0.00 0.50 0.00 0.00 -2.23 0.00 0.00 60.65 58.92 1mf0 s ILE 307 Cb 0.00 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.46 1mf0 s ILE 307 CO 0.00 -0.65 0.00 0.61 -1.23 0.00 0.00 174.94 173.67 1mf0 n GLY 308 N -2.74 2.94 3.65 6.18 0.00 -1.26 -4.85 105.19 109.11 1mf0 n GLY 308 Ca 0.07 -2.04 -0.44 0.00 0.00 0.00 0.00 46.02 43.61 1mf0 n GLY 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mf0 n ALA 309 N -1.06 0.59 -3.04 4.61 0.00 -1.26 -4.99 120.51 115.36 1mf0 n ALA 309 Ca 0.00 0.39 -0.16 0.00 0.00 0.00 0.00 53.44 53.67 1mf0 n ALA 309 Cb 0.00 -2.16 -0.03 0.00 0.00 0.00 0.00 19.45 17.26 1mf0 n ALA 309 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1mf0 n PHE 310 N 0.67 -2.14 -0.30 0.00 -0.00 -1.26 -5.02 117.46 109.41 1mf0 n PHE 310 Ca 0.08 -2.49 0.02 0.00 -0.00 0.00 0.00 57.45 55.07 1mf0 n PHE 310 Cb 0.33 0.75 0.07 0.00 -0.00 0.00 0.00 39.48 40.63 1mf0 n PHE 310 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 1mf0 n PRO 311 N 2.35 -0.13 0.00 -7.13 -0.02 -1.26 -1.16 135.00 127.65 1mf0 n PRO 311 Ca 0.21 1.23 0.14 0.00 -2.02 0.00 0.00 63.50 63.06 1mf0 n PRO 311 Cb 0.54 -1.84 0.47 0.00 -0.02 0.00 0.00 33.50 32.65 1mf0 n PRO 311 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1mf0 n THR 312 N -5.24 0.00 -1.50 3.45 -2.24 -1.26 -4.83 114.28 102.65 1mf0 n THR 312 Ca 0.11 -0.18 -0.58 0.00 -2.27 0.00 0.00 64.05 61.13 1mf0 n THR 312 Cb 0.36 0.40 -0.08 0.00 -2.10 0.00 0.00 70.33 68.91 1mf0 n THR 312 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1mf0 n GLU 313 N -0.29 0.09 -3.77 -0.78 2.13 -0.31 -3.25 120.64 114.45 1mf0 n GLU 313 Ca 0.16 0.03 -0.37 0.00 0.66 0.00 0.00 57.16 57.64 1mf0 n GLU 313 Cb 0.34 -1.53 -0.12 0.00 0.27 0.00 0.00 31.44 30.41 1mf0 n GLU 313 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1mf0 s GLN 314 N 0.00 2.15 -1.16 5.31 -1.52 0.74 -4.91 119.66 120.27 1mf0 s GLN 314 Ca 0.90 -1.69 -0.11 0.00 -1.95 0.00 0.00 55.36 52.50 1mf0 s GLN 314 Cb -1.24 -3.56 0.23 0.00 -0.22 0.00 0.00 33.01 28.23 1mf0 s GLN 314 CO 0.56 -1.00 1.28 0.44 -0.25 0.00 0.00 175.29 176.32 1mf0 n ILE 315 N 4.64 4.46 -2.88 1.08 -5.35 -1.26 -3.35 119.36 116.70 1mf0 n ILE 315 Ca -0.05 -5.11 0.00 0.00 -0.27 0.00 0.00 62.75 57.32 1mf0 n ILE 315 Cb 0.42 -2.52 0.00 0.00 -1.74 0.00 0.00 39.64 35.80 1mf0 n ILE 315 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1mf0 n ASN 316 N 3.89 0.00 0.14 7.28 0.23 -1.26 -4.98 115.26 120.56 1mf0 n ASN 316 Ca 0.30 -0.20 0.05 0.00 -0.53 0.00 0.00 54.58 54.20 1mf0 n ASN 316 Cb 0.40 0.00 0.50 0.00 -2.08 0.00 0.00 39.78 38.60 1mf0 n ASN 316 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1mf0 h GLU 317 N 0.00 0.24 0.72 -3.83 4.11 -1.98 -0.30 114.58 113.53 1mf0 h GLU 317 Ca 0.00 -0.02 -0.04 0.00 0.07 0.00 0.00 59.36 59.37 1mf0 h GLU 317 Cb 0.00 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.21 1mf0 h GLU 317 CO 0.00 0.22 -0.34 0.82 0.07 0.00 0.00 179.01 179.77 1mf0 h ILE 318 N 0.24 0.12 -0.99 -1.06 1.08 -1.95 0.66 117.51 115.61 1mf0 h ILE 318 Ca 0.06 -0.25 0.21 0.00 -0.39 0.00 0.00 64.86 64.49 1mf0 h ILE 318 Cb 0.08 0.15 -0.10 0.00 -3.07 0.00 0.00 36.82 33.88 1mf0 h ILE 318 CO -0.00 0.01 0.62 1.23 -0.69 0.00 0.00 178.15 179.32 1mf0 h GLY 319 N -1.18 1.57 0.94 5.37 0.00 -1.48 0.21 103.07 108.51 1mf0 h GLY 319 Ca -0.10 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 1mf0 h GLY 319 CO 0.16 -0.08 0.10 -0.55 0.00 0.00 0.00 176.54 176.18 1mf0 h ASP 320 N 0.64 0.64 0.23 0.19 3.32 -0.84 0.13 116.42 120.73 1mf0 h ASP 320 Ca 0.57 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 1mf0 h ASP 320 Cb 1.05 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.43 1mf0 h ASP 320 CO -0.34 0.70 -0.15 0.25 -1.72 0.00 0.00 179.24 177.98 1mf0 h LEU 321 N 0.54 -0.37 -0.67 1.55 5.85 0.18 0.25 115.31 122.64 1mf0 h LEU 321 Ca 0.13 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.91 1mf0 h LEU 321 Cb 0.32 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 1mf0 h LEU 321 CO 0.00 -0.24 0.41 -0.07 -0.34 0.00 0.00 178.44 178.20 1mf0 h LEU 322 N -0.37 0.65 -0.92 2.25 3.38 -1.00 0.61 115.31 119.91 1mf0 h LEU 322 Ca -0.02 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1mf0 h LEU 322 Cb 0.31 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1mf0 h LEU 322 CO 0.02 0.45 0.60 -0.61 0.09 0.00 0.00 178.44 178.99 1mf0 h GLN 323 N 0.78 1.18 0.07 1.13 4.15 -0.26 0.85 115.11 123.01 1mf0 h GLN 323 Ca 0.28 -0.07 -0.17 0.00 0.77 0.00 0.00 58.65 59.46 1mf0 h GLN 323 Cb 0.06 -0.27 -0.00 0.00 0.21 0.00 0.00 27.48 27.48 1mf0 h GLN 323 CO -0.12 0.78 -0.82 -0.91 -1.93 0.00 0.00 178.83 175.83 1mf0 h ASN 324 N 1.22 0.24 0.64 -0.69 2.35 0.21 -1.20 115.58 118.35 1mf0 h ASN 324 Ca 0.34 -0.87 -0.05 0.00 -0.55 0.00 0.00 56.30 55.18 1mf0 h ASN 324 Cb -0.10 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 1mf0 h ASN 324 CO -0.09 1.36 -0.22 0.03 -1.65 0.00 0.00 177.43 176.86 1mf0 h ARG 325 N -0.63 0.00 -0.02 0.81 3.08 0.19 -2.59 114.38 115.23 1mf0 h ARG 325 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1mf0 h ARG 325 Cb 1.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.49 1mf0 h ARG 325 CO 0.03 0.22 -0.33 0.41 -1.07 0.00 0.00 179.97 179.23 1mf0 n GLY 326 N -0.22 0.01 4.09 0.04 0.00 0.29 -4.88 105.19 104.51 1mf0 n GLY 326 Ca -0.01 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 1mf0 n GLY 326 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1mf0 n HIS 327 N 0.02 -1.89 -2.29 1.61 8.25 -0.79 -4.81 115.22 115.33 1mf0 n HIS 327 Ca 0.11 0.82 -0.42 0.00 -0.26 0.00 0.00 57.72 57.97 1mf0 n HIS 327 Cb 0.45 -3.38 -0.00 0.00 1.12 0.00 0.00 29.99 28.17 1mf0 n HIS 327 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1mf0 n GLU 328 N -4.47 3.04 -4.21 -0.41 -0.58 -0.52 -4.90 120.64 108.59 1mf0 n GLU 328 Ca -0.00 -3.04 -0.12 0.00 -0.42 0.00 0.00 57.16 53.58 1mf0 n GLU 328 Cb 0.53 -3.43 -0.10 0.00 -0.57 0.00 0.00 31.44 27.87 1mf0 n GLU 328 CO 0.00 0.00 0.00 1.67 -0.48 0.00 0.00 177.13 178.32 1mf0 s TRP 329 N 4.08 1.08 -0.36 -0.32 -2.14 -1.26 -0.03 118.94 120.00 1mf0 s TRP 329 Ca 0.52 -1.11 -0.35 0.00 2.66 0.00 0.00 56.10 57.82 1mf0 s TRP 329 Cb 0.07 -0.62 -0.11 0.00 -3.10 0.00 0.00 33.47 29.71 1mf0 s TRP 329 CO 0.03 -0.34 2.20 0.41 -2.66 0.00 0.00 176.95 176.59 1mf0 n GLY 330 N -0.19 0.47 0.66 3.67 0.00 0.13 -4.75 105.19 105.17 1mf0 n GLY 330 Ca -0.06 0.93 0.00 0.00 0.00 0.00 0.00 46.02 46.90 1mf0 n GLY 330 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1mf0 n VAL 331 N 7.21 0.08 0.18 1.61 3.14 -1.26 -1.58 118.33 127.72 1mf0 n VAL 331 Ca 0.42 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.80 1mf0 n VAL 331 Cb 0.23 -0.29 0.00 0.00 -1.06 0.00 0.00 33.84 32.72 1mf0 n VAL 331 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 1mf0 n THR 332 N 0.53 0.00 0.20 1.55 5.66 -1.26 -4.96 114.28 116.00 1mf0 n THR 332 Ca 0.00 0.00 0.10 0.00 -3.05 0.00 0.00 64.05 61.10 1mf0 n THR 332 Cb 0.08 0.00 0.13 0.00 -1.55 0.00 0.00 70.33 68.99 1mf0 n THR 332 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1mf0 h THR 333 N 0.00 0.16 0.00 1.09 1.03 -1.96 -3.47 112.91 109.76 1mf0 h THR 333 Ca 0.00 -1.23 0.00 0.00 -0.01 0.00 0.00 66.41 65.17 1mf0 h THR 333 Cb 0.00 2.04 0.00 0.00 -1.07 0.00 0.00 68.15 69.12 1mf0 h THR 333 CO 0.00 0.09 0.00 0.61 -0.01 0.00 0.00 175.52 176.21 1mf0 n GLY 334 N 1.13 0.69 3.64 2.99 0.00 -0.61 -4.91 105.19 108.12 1mf0 n GLY 334 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1mf0 n GLY 334 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mf0 s ARG 335 N -0.10 3.95 0.48 1.61 1.81 -1.26 -4.23 118.95 121.21 1mf0 s ARG 335 Ca 0.00 1.56 -0.24 0.00 -1.72 0.00 0.00 55.73 55.33 1mf0 s ARG 335 Cb 0.00 -3.93 -0.07 0.00 -0.45 0.00 0.00 34.95 30.50 1mf0 s ARG 335 CO 0.00 -1.09 1.39 0.15 -0.68 0.00 0.00 175.30 175.07 1mf0 s LYS 336 N 4.23 3.52 0.17 3.54 1.02 -1.26 0.19 119.74 131.15 1mf0 s LYS 336 Ca 0.63 2.32 -0.08 0.00 0.02 0.00 0.00 55.97 58.86 1mf0 s LYS 336 Cb -0.22 -2.52 -0.06 0.00 -0.52 0.00 0.00 37.83 34.51 1mf0 s LYS 336 CO 0.24 -0.92 0.46 1.03 -0.92 0.00 0.00 175.35 175.25 1mf0 s ARG 337 N -2.60 3.74 0.26 1.68 0.52 0.96 -4.85 118.95 118.66 1mf0 s ARG 337 Ca 0.64 0.13 -0.30 0.00 -0.52 0.00 0.00 55.73 55.69 1mf0 s ARG 337 Cb -0.42 -2.79 -0.10 0.00 0.52 0.00 0.00 34.95 32.16 1mf0 s ARG 337 CO 0.52 0.42 1.37 1.03 0.02 0.00 0.00 175.30 178.66 1mf0 s ARG 338 N -2.58 4.32 0.13 3.54 0.52 -0.26 -4.90 118.95 119.72 1mf0 s ARG 338 Ca 0.42 2.22 0.08 0.00 -0.52 0.00 0.00 55.73 57.94 1mf0 s ARG 338 Cb -0.12 -3.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.20 1mf0 s ARG 338 CO 0.22 -0.31 -0.19 0.00 0.02 0.00 0.00 175.30 175.04 1mf0 s GLY 340 N -2.24 -0.14 1.27 0.00 0.00 0.10 -0.19 107.32 106.12 1mf0 s GLY 340 Ca 0.10 -0.08 -0.16 0.00 0.00 0.00 0.00 44.72 44.58 1mf0 s GLY 340 CO 0.05 0.08 0.99 -0.98 0.00 0.00 0.00 173.10 173.24 1mf0 s TRP 341 N -3.38 0.70 0.43 1.90 0.52 -1.20 -0.59 118.94 117.32 1mf0 s TRP 341 Ca 0.13 0.98 -0.25 0.00 0.02 0.00 0.00 56.10 56.98 1mf0 s TRP 341 Cb -0.03 -3.01 -0.08 0.00 -1.15 0.00 0.00 33.47 29.20 1mf0 s TRP 341 CO 0.04 -4.33 1.27 -1.17 0.02 0.00 0.00 176.95 172.78 1mf0 s LEU 342 N -7.49 4.13 -0.31 2.99 2.96 -1.26 -2.93 118.68 116.78 1mf0 s LEU 342 Ca 0.69 2.58 -0.00 0.00 -0.22 0.00 0.00 54.13 57.17 1mf0 s LEU 342 Cb -0.22 -4.02 0.10 0.00 0.50 0.00 0.00 46.19 42.55 1mf0 s LEU 342 CO 0.63 -0.94 0.08 -0.62 -1.32 0.00 0.00 176.35 174.19 1mf0 s ASP 343 N -0.91 4.06 0.53 3.68 -1.08 -1.26 -0.18 116.67 121.51 1mf0 s ASP 343 Ca 0.60 -1.65 0.29 0.00 -0.52 0.00 0.00 52.55 51.27 1mf0 s ASP 343 Cb -0.36 -0.95 1.49 0.00 -1.46 0.00 0.00 42.92 41.65 1mf0 s ASP 343 CO 0.45 -0.40 2.08 -0.07 0.52 0.00 0.00 175.17 177.75 1mf0 h LEU 344 N 8.04 0.00 -0.16 -1.34 3.38 -1.27 -2.92 115.31 121.04 1mf0 h LEU 344 Ca -0.13 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1mf0 h LEU 344 Cb 1.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1mf0 h LEU 344 CO 0.47 0.10 0.07 0.24 0.09 0.00 0.00 178.44 179.42 1mf0 h MET 345 N 0.00 0.23 -0.28 1.13 2.86 -1.78 -0.45 114.93 116.64 1mf0 h MET 345 Ca -0.00 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.49 1mf0 h MET 345 Cb 0.34 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 1mf0 h MET 345 CO 0.01 0.28 -0.31 -0.84 1.06 0.00 0.00 176.91 177.12 1mf0 h ILE 346 N 0.12 1.28 -0.41 -1.22 3.07 -1.93 -2.11 117.51 116.32 1mf0 h ILE 346 Ca 0.05 -1.42 0.00 0.00 1.55 0.00 0.00 64.86 65.05 1mf0 h ILE 346 Cb 0.13 1.41 -0.02 0.00 -0.27 0.00 0.00 36.82 38.07 1mf0 h ILE 346 CO -0.01 0.45 0.27 -0.07 -1.05 0.00 0.00 178.15 177.75 1mf0 h LEU 347 N 0.50 0.47 -0.43 0.16 4.07 -1.29 0.16 115.31 118.95 1mf0 h LEU 347 Ca 0.06 -0.01 -0.17 0.00 0.08 0.00 0.00 57.88 57.83 1mf0 h LEU 347 Cb 0.79 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.41 1mf0 h LEU 347 CO 0.06 0.34 -0.57 0.03 -1.08 0.00 0.00 178.44 177.22 1mf0 h ARG 348 N 0.56 0.65 -0.42 1.13 3.08 -1.02 -1.78 114.38 116.58 1mf0 h ARG 348 Ca 0.15 -0.42 -0.09 0.00 0.07 0.00 0.00 59.98 59.69 1mf0 h ARG 348 Cb -0.06 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1mf0 h ARG 348 CO -0.03 1.04 -0.10 -0.92 -1.07 0.00 0.00 179.97 178.89 1mf0 h TYR 349 N 0.49 0.81 -0.72 3.04 3.20 -1.19 -1.31 116.97 121.30 1mf0 h TYR 349 Ca 0.00 -0.14 -0.07 0.00 3.14 0.00 0.00 58.73 61.67 1mf0 h TYR 349 Cb 1.14 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 1mf0 h TYR 349 CO 0.05 0.80 0.19 0.00 -1.64 0.00 0.00 178.16 177.57 1mf0 h ALA 350 N 1.22 0.98 -0.31 1.82 0.00 -0.41 -2.70 119.26 119.86 1mf0 h ALA 350 Ca 0.12 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1mf0 h ALA 350 Cb 0.56 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1mf0 h ALA 350 CO 0.03 0.67 -0.22 1.25 0.00 0.00 0.00 179.25 180.98 1mf0 h HIS 351 N 1.08 0.67 -0.94 0.00 -0.00 -0.80 0.09 115.15 115.25 1mf0 h HIS 351 Ca 0.23 -0.14 0.06 0.00 -0.00 0.00 0.00 60.37 60.52 1mf0 h HIS 351 Cb 0.35 -0.17 -0.06 0.00 -0.00 0.00 0.00 27.41 27.53 1mf0 h HIS 351 CO 0.03 0.77 0.61 0.52 -0.00 0.00 0.00 177.93 179.86 1mf0 h MET 352 N 0.53 1.05 0.13 5.26 2.07 -0.93 0.22 114.93 123.27 1mf0 h MET 352 Ca 0.08 -0.06 -0.23 0.00 -2.07 0.00 0.00 59.70 57.41 1mf0 h MET 352 Cb 0.67 -0.24 0.01 0.00 -1.87 0.00 0.00 31.60 30.17 1mf0 h MET 352 CO 0.05 0.70 -1.12 0.28 1.07 0.00 0.00 176.91 177.89 1mf0 h VAL 353 N 1.09 1.27 0.01 -2.22 2.07 -1.33 -3.40 116.25 113.74 1mf0 h VAL 353 Ca 0.40 -2.47 -0.27 0.00 0.82 0.00 0.00 66.70 65.19 1mf0 h VAL 353 Cb 0.18 2.95 -0.04 0.00 -1.52 0.00 0.00 31.29 32.86 1mf0 h VAL 353 CO -0.15 0.70 -1.46 0.78 0.02 0.00 0.00 177.57 177.46 1mf0 h ASN 354 N -0.34 0.03 -4.93 0.57 2.35 -0.86 -3.44 115.58 108.96 1mf0 h ASN 354 Ca -0.23 -0.05 -0.23 0.00 -0.55 0.00 0.00 56.30 55.24 1mf0 h ASN 354 Cb 1.70 -0.01 0.15 0.00 0.05 0.00 0.00 38.32 40.21 1mf0 h ASN 354 CO 0.10 1.04 -0.65 0.61 -1.65 0.00 0.00 177.43 176.88 1mf0 n GLY 355 N 1.50 -0.47 3.74 2.83 0.00 0.78 -4.83 105.19 108.74 1mf0 n GLY 355 Ca -0.11 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1mf0 n GLY 355 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mf0 n PHE 356 N -3.20 2.68 0.12 1.61 0.99 -1.26 -4.72 117.46 113.67 1mf0 n PHE 356 Ca -0.15 0.45 0.11 0.00 -0.00 0.00 0.00 57.45 57.87 1mf0 n PHE 356 Cb 0.62 -2.50 -0.02 0.00 -1.00 0.00 0.00 39.48 36.58 1mf0 n PHE 356 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1mf0 n THR 357 N 0.78 0.53 -3.60 4.37 -2.24 0.37 -4.94 114.28 109.53 1mf0 n THR 357 Ca 0.04 -0.53 -0.05 0.00 -2.27 0.00 0.00 64.05 61.24 1mf0 n THR 357 Cb 0.37 -0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 1mf0 n THR 357 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mf0 s ALA 358 N -3.37 -1.85 0.22 6.98 0.00 -1.21 -4.69 121.76 117.83 1mf0 s ALA 358 Ca -0.01 0.79 0.09 0.00 0.00 0.00 0.00 51.96 52.83 1mf0 s ALA 358 Cb 0.10 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.59 1mf0 s ALA 358 CO 0.80 -0.82 -0.04 -0.51 0.00 0.00 0.00 175.76 175.20 1mf0 s LEU 359 N -2.63 3.14 -0.25 0.00 1.43 0.41 -1.62 118.68 119.16 1mf0 s LEU 359 Ca 0.09 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.63 1mf0 s LEU 359 Cb -0.01 -1.74 0.06 0.00 0.03 0.00 0.00 46.19 44.54 1mf0 s LEU 359 CO -0.05 0.05 -0.06 0.00 0.23 0.00 0.00 176.35 176.53 1mf0 s ALA 360 N -2.00 2.20 -0.50 4.21 0.00 -0.15 0.12 121.76 125.64 1mf0 s ALA 360 Ca 0.28 -1.58 -0.16 0.00 0.00 0.00 0.00 51.96 50.50 1mf0 s ALA 360 Cb -0.08 -1.53 0.09 0.00 0.00 0.00 0.00 23.12 21.60 1mf0 s ALA 360 CO 0.18 -1.25 0.45 -1.17 0.00 0.00 0.00 175.76 173.97 1mf0 s LEU 361 N 1.28 5.71 0.18 0.00 2.96 -0.11 0.48 118.68 129.19 1mf0 s LEU 361 Ca -0.05 -1.42 -0.00 0.00 -0.22 0.00 0.00 54.13 52.44 1mf0 s LEU 361 Cb -0.19 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 1mf0 s LEU 361 CO -0.07 -0.74 0.37 0.42 -1.32 0.00 0.00 176.35 175.01 1mf0 s THR 362 N 1.74 5.23 -0.95 3.68 -4.23 -0.45 -0.08 115.64 120.59 1mf0 s THR 362 Ca 0.05 -0.39 -0.05 0.00 -1.18 0.00 0.00 61.69 60.12 1mf0 s THR 362 Cb -0.25 -3.72 0.01 0.00 1.34 0.00 0.00 72.50 69.87 1mf0 s THR 362 CO 0.06 -0.13 0.82 0.29 -0.54 0.00 0.00 174.62 175.12 1mf0 n LYS 363 N -0.55 -5.53 -0.15 3.99 5.02 -1.11 -0.37 118.16 119.46 1mf0 n LYS 363 Ca -0.05 0.59 -0.12 0.00 -2.02 0.00 0.00 58.31 56.71 1mf0 n LYS 363 Cb 0.54 -4.91 -0.01 0.00 -0.02 0.00 0.00 35.03 30.63 1mf0 n LYS 363 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1mf0 h LEU 364 N -1.84 1.00 -1.98 -0.35 5.85 -1.48 -2.99 115.31 113.52 1mf0 h LEU 364 Ca -0.41 -0.42 0.16 0.00 0.84 0.00 0.00 57.88 58.05 1mf0 h LEU 364 Cb 1.26 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1mf0 h LEU 364 CO 0.39 1.20 0.48 -2.24 -0.34 0.00 0.00 178.44 177.93 1mf0 h ASP 365 N 0.81 0.00 0.19 1.25 3.04 -1.83 0.10 116.42 119.98 1mf0 h ASP 365 Ca 0.09 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.87 1mf0 h ASP 365 Cb 0.85 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.14 1mf0 h ASP 365 CO 0.08 0.00 -0.05 0.40 -2.04 0.00 0.00 179.24 177.63 1mf0 h ILE 366 N 0.00 0.44 -0.13 4.15 5.03 -1.86 -2.06 117.51 123.08 1mf0 h ILE 366 Ca 0.26 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.76 1mf0 h ILE 366 Cb 1.21 1.16 0.00 0.00 -3.03 0.00 0.00 36.82 36.16 1mf0 h ILE 366 CO -0.00 0.05 0.00 0.18 -0.68 0.00 0.00 178.15 177.70 1mf0 n LEU 367 N -3.62 2.43 -0.08 1.44 4.77 0.35 -4.41 117.00 117.88 1mf0 n LEU 367 Ca -0.02 -0.91 0.22 0.00 -0.03 0.00 0.00 56.01 55.27 1mf0 n LEU 367 Cb 0.15 -0.07 0.68 0.00 -2.33 0.00 0.00 43.42 41.84 1mf0 n LEU 367 CO 0.27 0.46 1.21 0.44 -1.33 0.00 0.00 177.39 178.44 1mf0 h ASP 368 N 3.53 0.05 0.23 -1.43 3.32 -1.46 -2.83 116.42 117.84 1mf0 h ASP 368 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 1mf0 h ASP 368 Cb 0.76 -0.01 0.04 0.00 0.22 0.00 0.00 39.33 40.34 1mf0 h ASP 368 CO 0.00 0.02 -1.32 0.58 -1.72 0.00 0.00 179.24 176.80 1mf0 h VAL 369 N 0.05 1.34 -2.83 -1.35 2.07 -1.81 -2.35 116.25 111.37 1mf0 h VAL 369 Ca 0.33 -2.66 -0.59 0.00 0.82 0.00 0.00 66.70 64.60 1mf0 h VAL 369 Cb 1.23 3.08 0.11 0.00 -1.52 0.00 0.00 31.29 34.19 1mf0 h VAL 369 CO -0.02 0.79 0.32 0.18 0.02 0.00 0.00 177.57 178.86 1mf0 n LEU 370 N -3.82 2.61 0.08 2.57 4.77 -1.07 -4.82 117.00 117.32 1mf0 n LEU 370 Ca -0.16 1.19 -0.01 0.00 -0.03 0.00 0.00 56.01 57.00 1mf0 n LEU 370 Cb 1.04 -1.38 -0.05 0.00 -2.33 0.00 0.00 43.42 40.70 1mf0 n LEU 370 CO 0.58 -0.96 0.12 0.28 -1.33 0.00 0.00 177.39 176.09 1mf0 h SER 371 N 2.39 0.00 -3.88 -1.43 0.02 -1.91 -3.37 113.55 105.37 1mf0 h SER 371 Ca -0.43 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.41 1mf0 h SER 371 Cb 1.31 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.62 1mf0 h SER 371 CO 0.63 0.67 -0.18 -1.83 -1.14 0.00 0.00 176.83 174.97 1mf0 s GLU 372 N -2.87 0.53 -0.13 3.45 -1.05 -1.26 -1.14 118.70 116.23 1mf0 s GLU 372 Ca 0.01 0.64 0.02 0.00 -0.15 0.00 0.00 54.97 55.49 1mf0 s GLU 372 Cb 0.08 0.25 -0.00 0.00 -0.44 0.00 0.00 34.13 34.02 1mf0 s GLU 372 CO 0.79 -0.07 -0.18 0.42 0.95 0.00 0.00 175.26 177.16 1mf0 s ILE 373 N 0.28 2.48 0.15 1.83 1.01 0.35 -4.82 121.20 122.48 1mf0 s ILE 373 Ca -0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 60.65 59.76 1mf0 s ILE 373 Cb -0.03 -2.01 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 1mf0 s ILE 373 CO 0.00 0.54 0.37 -0.54 0.00 0.00 0.00 174.94 175.31 1mf0 s LYS 374 N 0.54 3.59 -0.14 2.79 1.02 -1.26 0.82 119.74 127.10 1mf0 s LYS 374 Ca -0.11 -0.16 -0.06 0.00 0.02 0.00 0.00 55.97 55.65 1mf0 s LYS 374 Cb -0.16 -2.86 0.06 0.00 -0.52 0.00 0.00 37.83 34.35 1mf0 s LYS 374 CO 0.04 0.46 0.31 0.54 -0.92 0.00 0.00 175.35 175.79 1mf0 s VAL 375 N -1.69 -0.26 0.15 3.17 0.11 -0.39 -4.06 120.40 117.43 1mf0 s VAL 375 Ca 0.40 0.18 -0.31 0.00 -2.93 0.00 0.00 61.98 59.32 1mf0 s VAL 375 Cb -0.12 -0.50 -0.10 0.00 -1.53 0.00 0.00 36.38 34.14 1mf0 s VAL 375 CO 0.26 0.08 1.56 -0.83 -3.33 0.00 0.00 175.10 172.83 1mf0 s GLY 376 N 1.89 1.59 -0.09 6.54 0.00 0.74 -2.03 107.32 115.96 1mf0 s GLY 376 Ca -0.05 1.34 0.10 0.00 0.00 0.00 0.00 44.72 46.11 1mf0 s GLY 376 CO -0.10 2.63 0.07 0.29 0.00 0.00 0.00 173.10 175.98 1mf0 n ILE 377 N 4.03 0.63 -3.73 0.90 -5.35 -0.37 -0.77 119.36 114.70 1mf0 n ILE 377 Ca 0.14 -0.43 -0.09 0.00 -0.27 0.00 0.00 62.75 62.10 1mf0 n ILE 377 Cb 0.39 -0.58 -0.03 0.00 -1.74 0.00 0.00 39.64 37.68 1mf0 n ILE 377 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1mf0 s SER 378 N -4.17 -0.33 0.12 7.28 1.04 -1.24 -4.48 113.70 111.92 1mf0 s SER 378 Ca -0.05 -0.44 0.09 0.00 0.48 0.00 0.00 55.95 56.03 1mf0 s SER 378 Cb 0.04 0.66 -0.04 0.00 0.10 0.00 0.00 66.02 66.78 1mf0 s SER 378 CO 0.44 -1.18 -0.19 -0.31 0.98 0.00 0.00 173.24 172.99 1mf0 s TYR 379 N -3.87 2.52 -0.01 5.02 2.02 -1.26 -0.60 117.35 121.17 1mf0 s TYR 379 Ca 0.09 -0.27 -0.00 0.00 -0.37 0.00 0.00 57.07 56.51 1mf0 s TYR 379 Cb -0.03 -1.34 0.02 0.00 -0.40 0.00 0.00 41.96 40.20 1mf0 s TYR 379 CO -0.00 0.38 0.02 -1.59 -1.57 0.00 0.00 175.55 172.80 1mf0 s LYS 380 N -2.14 -0.01 -0.05 -0.62 -2.85 -0.33 -0.91 119.74 112.83 1mf0 s LYS 380 Ca 0.18 0.11 -0.03 0.00 -1.00 0.00 0.00 55.97 55.23 1mf0 s LYS 380 Cb -0.11 -0.12 -0.01 0.00 -2.06 0.00 0.00 37.83 35.54 1mf0 s LYS 380 CO 0.10 -0.09 -0.05 1.25 0.10 0.00 0.00 175.35 176.66 1mf0 h LEU 381 N 6.71 0.00 -6.12 2.77 7.12 -0.87 0.73 115.31 125.64 1mf0 h LEU 381 Ca -0.35 0.00 -0.59 0.00 0.13 0.00 0.00 57.88 57.07 1mf0 h LEU 381 Cb 1.17 0.00 -0.41 0.00 -0.53 0.00 0.00 40.66 40.88 1mf0 h LEU 381 CO 0.49 0.29 -0.70 0.59 -0.13 0.00 0.00 178.44 178.98 1mf0 n ASN 382 N -3.25 3.04 0.00 1.25 3.02 -1.26 -4.67 115.26 113.39 1mf0 n ASN 382 Ca -0.02 -3.30 0.00 0.00 -0.03 0.00 0.00 54.58 51.23 1mf0 n ASN 382 Cb 0.07 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.58 1mf0 n ASN 382 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mf0 n GLY 383 N 0.92 0.47 3.45 7.41 0.00 -1.26 -4.93 105.19 111.24 1mf0 n GLY 383 Ca 0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 1mf0 n GLY 383 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mf0 s LYS 384 N -0.55 3.63 -0.23 1.61 -2.85 -1.26 -5.08 119.74 115.01 1mf0 s LYS 384 Ca 0.00 -0.51 -0.29 0.00 -1.00 0.00 0.00 55.97 54.17 1mf0 s LYS 384 Cb 0.00 -3.15 -0.01 0.00 -2.06 0.00 0.00 37.83 32.62 1mf0 s LYS 384 CO 0.00 -0.04 1.29 0.50 0.10 0.00 0.00 175.35 177.19 1mf0 s ARG 385 N 1.16 4.07 0.20 1.78 3.52 -1.26 -0.21 118.95 128.20 1mf0 s ARG 385 Ca 0.03 1.45 -0.30 0.00 -0.13 0.00 0.00 55.73 56.78 1mf0 s ARG 385 Cb -0.14 -3.83 -0.08 0.00 -1.56 0.00 0.00 34.95 29.34 1mf0 s ARG 385 CO 0.02 -0.92 1.24 0.96 -0.81 0.00 0.00 175.30 175.79 1mf0 s ILE 386 N 3.97 3.40 0.49 4.11 -4.36 -0.09 -4.94 121.20 123.77 1mf0 s ILE 386 Ca 0.56 1.17 0.19 0.00 -0.26 0.00 0.00 60.65 62.31 1mf0 s ILE 386 Cb -0.19 -3.75 0.25 0.00 1.25 0.00 0.00 42.46 40.02 1mf0 s ILE 386 CO 0.19 0.19 2.10 1.55 0.24 0.00 0.00 174.94 179.20 1mf0 h PRO 387 N 5.22 0.00 -3.15 0.37 0.13 -1.94 -3.43 132.00 129.20 1mf0 h PRO 387 Ca -0.45 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.72 1mf0 h PRO 387 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 1mf0 h PRO 387 CO 0.75 0.09 0.15 1.52 -0.23 0.00 0.00 178.00 180.28 1mf0 s TYR 388 N -4.74 -0.06 0.14 1.56 1.13 -1.26 -5.13 117.35 109.00 1mf0 s TYR 388 Ca -0.04 -0.38 -0.31 0.00 -1.41 0.00 0.00 57.07 54.92 1mf0 s TYR 388 Cb 0.16 0.59 -0.10 0.00 -1.10 0.00 0.00 41.96 41.51 1mf0 s TYR 388 CO 0.65 -1.19 1.74 0.12 -2.51 0.00 0.00 175.55 174.36 1mf0 s PHE 389 N -3.91 2.50 0.15 -3.49 5.36 -1.26 -4.92 117.98 112.41 1mf0 s PHE 389 Ca 0.14 0.21 -0.32 0.00 -0.96 0.00 0.00 56.93 56.00 1mf0 s PHE 389 Cb -0.05 -4.10 -0.12 0.00 -0.34 0.00 0.00 43.02 38.41 1mf0 s PHE 389 CO 0.08 -4.38 1.76 -2.30 -1.46 0.00 0.00 175.22 168.92 1mf0 n PRO 390 N 5.01 2.69 0.09 10.12 -0.02 -1.26 -4.90 135.00 146.73 1mf0 n PRO 390 Ca 0.16 0.97 -0.06 0.00 -2.02 0.00 0.00 63.50 62.56 1mf0 n PRO 390 Cb 0.38 -2.83 0.09 0.00 -0.02 0.00 0.00 33.50 31.11 1mf0 n PRO 390 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mf0 h ALA 391 N 7.55 0.76 -2.11 3.55 0.00 -1.98 -3.40 119.26 123.62 1mf0 h ALA 391 Ca -0.45 -0.60 -0.64 0.00 0.00 0.00 0.00 54.91 53.22 1mf0 h ALA 391 Cb 1.22 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.79 1mf0 h ALA 391 CO 0.94 0.79 0.26 1.21 0.00 0.00 0.00 179.25 182.46 1mf0 s ASN 392 N -6.90 6.38 0.47 0.00 3.84 -1.26 -4.78 114.94 112.68 1mf0 s ASN 392 Ca -0.03 -0.19 0.12 0.00 0.21 0.00 0.00 52.86 52.97 1mf0 s ASN 392 Cb 0.11 -2.36 1.08 0.00 -0.55 0.00 0.00 41.25 39.54 1mf0 s ASN 392 CO 0.80 -0.85 2.09 -0.61 -2.79 0.00 0.00 177.10 175.75 1mf0 h GLN 393 N 8.92 0.26 0.00 0.43 -0.00 -1.79 -1.46 115.11 121.48 1mf0 h GLN 393 Ca -0.25 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.37 1mf0 h GLN 393 Cb 1.09 -0.06 -0.00 0.00 0.00 0.00 0.00 27.48 28.51 1mf0 h GLN 393 CO 0.93 0.17 -0.06 1.49 0.00 0.00 0.00 178.83 181.37 1mf0 h GLU 394 N 0.27 0.00 0.00 1.69 4.57 -1.91 -2.09 114.58 117.11 1mf0 h GLU 394 Ca 0.10 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.27 1mf0 h GLU 394 Cb 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1mf0 h GLU 394 CO -0.02 0.06 -0.04 0.82 -1.18 0.00 0.00 179.01 178.65 1mf0 h ILE 395 N 0.00 1.66 -1.15 2.32 2.04 -1.67 -3.25 117.51 117.46 1mf0 h ILE 395 Ca -0.00 -2.00 0.33 0.00 1.00 0.00 0.00 64.86 64.20 1mf0 h ILE 395 Cb 0.17 3.01 -0.05 0.00 -0.74 0.00 0.00 36.82 39.22 1mf0 h ILE 395 CO 0.01 0.52 0.88 0.25 0.00 0.00 0.00 178.15 179.81 1mf0 h LEU 396 N -0.81 0.00 -0.18 1.44 5.85 -1.32 0.83 115.31 121.13 1mf0 h LEU 396 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1mf0 h LEU 396 Cb 0.87 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1mf0 h LEU 396 CO 0.01 0.00 0.00 1.67 -0.34 0.00 0.00 178.44 179.78 1mf0 n GLN 397 N -4.05 0.19 -0.11 1.25 -0.06 -1.03 -3.47 117.38 110.10 1mf0 n GLN 397 Ca 0.25 0.24 0.04 0.00 -2.00 0.00 0.00 57.00 55.53 1mf0 n GLN 397 Cb 1.26 -1.76 0.10 0.00 -4.06 0.00 0.00 30.24 25.78 1mf0 n GLN 397 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1mf0 n LYS 398 N -2.09 2.57 -2.90 3.69 5.02 0.29 -5.02 118.16 119.71 1mf0 n LYS 398 Ca 0.05 -1.79 -0.31 0.00 -2.02 0.00 0.00 58.31 54.24 1mf0 n LYS 398 Cb 0.35 -1.19 -0.04 0.00 -0.02 0.00 0.00 35.03 34.13 1mf0 n LYS 398 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1mf0 s VAL 399 N -0.96 4.77 -0.21 -0.18 -7.23 -1.15 -4.86 120.40 110.59 1mf0 s VAL 399 Ca 0.16 0.66 -0.04 0.00 -1.81 0.00 0.00 61.98 60.96 1mf0 s VAL 399 Cb 0.09 -3.71 -0.01 0.00 0.56 0.00 0.00 36.38 33.30 1mf0 s VAL 399 CO 0.11 -0.47 -0.04 -0.70 -0.31 0.00 0.00 175.10 173.69 1mf0 s GLU 400 N -3.72 3.43 0.25 4.82 2.12 0.25 -4.94 118.70 120.91 1mf0 s GLU 400 Ca 0.52 -0.61 -0.15 0.00 0.36 0.00 0.00 54.97 55.09 1mf0 s GLU 400 Cb -0.10 -2.98 -0.08 0.00 0.26 0.00 0.00 34.13 31.22 1mf0 s GLU 400 CO 0.29 -0.11 0.66 0.14 -0.54 0.00 0.00 175.26 175.70 1mf0 s VAL 401 N 1.26 4.75 -0.18 3.70 -7.23 -1.26 -1.18 120.40 120.26 1mf0 s VAL 401 Ca 0.03 0.88 -0.15 0.00 -1.81 0.00 0.00 61.98 60.93 1mf0 s VAL 401 Cb -0.14 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 33.07 1mf0 s VAL 401 CO -0.01 -0.00 0.37 -1.61 -0.31 0.00 0.00 175.10 173.53 1mf0 s GLU 402 N -2.56 4.21 0.11 4.82 2.02 0.23 -4.95 118.70 122.58 1mf0 s GLU 402 Ca 0.47 0.18 0.04 0.00 0.02 0.00 0.00 54.97 55.69 1mf0 s GLU 402 Cb -0.13 -3.49 -0.04 0.00 0.10 0.00 0.00 34.13 30.57 1mf0 s GLU 402 CO 0.19 0.07 0.08 0.71 0.02 0.00 0.00 175.26 176.33 1mf0 s TYR 403 N 0.98 3.14 -0.11 1.61 2.02 -1.26 -1.23 117.35 122.50 1mf0 s TYR 403 Ca 0.19 0.03 0.01 0.00 -0.37 0.00 0.00 57.07 56.93 1mf0 s TYR 403 Cb -0.14 -1.57 -0.01 0.00 -0.40 0.00 0.00 41.96 39.84 1mf0 s TYR 403 CO 0.07 0.52 -0.15 -2.00 -1.57 0.00 0.00 175.55 172.41 1mf0 s GLU 404 N -2.62 3.16 -0.22 -0.62 2.56 -0.86 -4.93 118.70 115.17 1mf0 s GLU 404 Ca 0.29 -0.72 -0.08 0.00 0.00 0.00 0.00 54.97 54.46 1mf0 s GLU 404 Cb -0.11 -2.53 -0.04 0.00 2.00 0.00 0.00 34.13 33.45 1mf0 s GLU 404 CO 0.22 0.29 0.10 0.99 -0.56 0.00 0.00 175.26 176.29 1mf0 s THR 405 N 0.14 4.81 -0.03 -1.70 2.01 -1.26 -1.26 115.64 118.35 1mf0 s THR 405 Ca -0.08 -0.01 0.07 0.00 0.31 0.00 0.00 61.69 61.98 1mf0 s THR 405 Cb -0.15 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.12 1mf0 s THR 405 CO 0.05 0.38 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.36 1mf0 s LEU 406 N 1.00 2.15 0.30 4.42 1.43 0.24 -4.93 118.68 123.29 1mf0 s LEU 406 Ca 0.05 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.41 1mf0 s LEU 406 Cb -0.14 -1.38 -0.12 0.00 0.03 0.00 0.00 46.19 44.58 1mf0 s LEU 406 CO 0.03 0.31 1.46 -0.81 0.23 0.00 0.00 176.35 177.57 1mf0 n PRO 407 N 2.53 2.37 -2.19 1.29 -0.04 -1.26 0.13 135.00 137.82 1mf0 n PRO 407 Ca -0.16 0.84 -0.28 0.00 -0.04 0.00 0.00 63.50 63.85 1mf0 n PRO 407 Cb 0.51 -2.53 0.03 0.00 -0.04 0.00 0.00 33.50 31.47 1mf0 n PRO 407 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1mf0 s GLY 408 N 0.18 1.61 0.02 0.55 0.00 -0.29 -4.66 107.32 104.72 1mf0 s GLY 408 Ca 0.62 -0.48 0.22 0.00 0.00 0.00 0.00 44.72 45.08 1mf0 s GLY 408 CO 0.54 -0.19 0.71 -2.67 0.00 0.00 0.00 173.10 171.49 1mf0 n TRP 409 N -2.70 0.16 -3.82 1.90 2.14 -1.26 -4.80 117.44 109.06 1mf0 n TRP 409 Ca 0.05 0.05 -0.26 0.00 2.07 0.00 0.00 57.50 59.40 1mf0 n TRP 409 Cb 0.57 -0.46 0.00 0.00 -0.81 0.00 0.00 31.31 30.61 1mf0 n TRP 409 CO 0.00 0.00 0.00 1.63 2.07 0.00 0.00 177.69 181.39 1mf0 n LYS 410 N -2.13 -1.45 -3.52 -2.67 5.02 -1.18 -4.97 118.16 107.26 1mf0 n LYS 410 Ca -0.01 0.70 -0.10 0.00 -2.02 0.00 0.00 58.31 56.88 1mf0 n LYS 410 Cb 0.50 -2.30 -0.03 0.00 -0.02 0.00 0.00 35.03 33.19 1mf0 n LYS 410 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mf0 s ALA 411 N -3.03 -1.84 -0.19 7.82 0.00 -0.89 -5.00 121.76 118.64 1mf0 s ALA 411 Ca 0.04 1.17 -0.29 0.00 0.00 0.00 0.00 51.96 52.88 1mf0 s ALA 411 Cb -0.02 0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1mf0 s ALA 411 CO 0.90 -0.56 1.07 0.34 0.00 0.00 0.00 175.76 177.51 1mf0 s ASP 412 N -2.00 7.11 0.00 0.00 3.68 -1.26 -4.58 116.67 119.63 1mf0 s ASP 412 Ca 0.01 1.47 0.08 0.00 2.13 0.00 0.00 52.55 56.25 1mf0 s ASP 412 Cb -0.01 -2.54 0.15 0.00 -1.45 0.00 0.00 42.92 39.07 1mf0 s ASP 412 CO -0.05 -0.63 0.98 0.35 0.13 0.00 0.00 175.17 175.96 1mf0 n THR 413 N 5.12 0.51 0.31 1.71 -2.24 -1.26 -4.63 114.28 113.79 1mf0 n THR 413 Ca 0.11 -0.75 0.19 0.00 -2.27 0.00 0.00 64.05 61.33 1mf0 n THR 413 Cb 0.46 0.83 1.02 0.00 -2.10 0.00 0.00 70.33 70.55 1mf0 n THR 413 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1mf0 h THR 414 N 1.56 0.00 -0.02 4.28 1.35 -1.91 -1.06 112.91 117.12 1mf0 h THR 414 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1mf0 h THR 414 Cb 0.51 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1mf0 h THR 414 CO 0.00 0.00 -0.22 0.61 -0.25 0.00 0.00 175.52 175.66 1mf0 n GLY 415 N -1.15 0.11 3.77 5.82 0.00 -1.26 -4.83 105.19 107.64 1mf0 n GLY 415 Ca -0.02 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.10 1mf0 n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mf0 s ALA 416 N -1.78 3.31 0.00 4.61 0.00 -0.40 -4.90 121.76 122.59 1mf0 s ALA 416 Ca 0.16 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.38 1mf0 s ALA 416 Cb 0.14 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1mf0 s ALA 416 CO 0.35 -0.81 0.00 0.54 0.00 0.00 0.00 175.76 175.84 1mf0 n ARG 417 N 0.25 1.35 -4.11 0.00 5.12 -1.26 -4.68 116.66 113.33 1mf0 n ARG 417 Ca 0.03 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.82 1mf0 n ARG 417 Cb 0.43 -0.11 -0.11 0.00 -1.16 0.00 0.00 32.46 31.51 1mf0 n ARG 417 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1mf0 s LYS 418 N -0.18 0.68 0.53 5.56 1.02 -1.26 -4.40 119.74 121.70 1mf0 s LYS 418 Ca 0.00 -1.01 0.30 0.00 0.02 0.00 0.00 55.97 55.28 1mf0 s LYS 418 Cb 0.00 -0.30 1.45 0.00 -0.52 0.00 0.00 37.83 38.46 1mf0 s LYS 418 CO 0.00 0.03 1.91 2.35 -0.92 0.00 0.00 175.35 178.73 1mf0 h TRP 419 N 3.86 0.02 0.00 3.18 2.91 -1.96 0.11 115.95 124.07 1mf0 h TRP 419 Ca -0.36 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.66 1mf0 h TRP 419 Cb 1.19 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 1mf0 h TRP 419 CO 0.63 0.00 -0.08 0.93 -1.03 0.00 0.00 178.44 178.89 1mf0 h GLU 420 N 0.01 0.00 -0.22 2.65 3.07 -2.00 -3.17 114.58 114.92 1mf0 h GLU 420 Ca 0.39 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 59.11 1mf0 h GLU 420 Cb 1.53 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.43 1mf0 h GLU 420 CO -0.01 0.00 -0.44 -0.44 -1.40 0.00 0.00 179.01 176.72 1mf0 h ASP 421 N 0.00 0.59 -3.88 1.42 3.32 -1.18 -3.44 116.42 113.25 1mf0 h ASP 421 Ca 0.00 -0.27 -0.52 0.00 0.02 0.00 0.00 57.03 56.26 1mf0 h ASP 421 Cb 0.83 -0.17 0.06 0.00 0.22 0.00 0.00 39.33 40.27 1mf0 h ASP 421 CO 0.00 0.95 0.62 -0.76 -1.72 0.00 0.00 179.24 178.33 1mf0 s LEU 422 N -8.46 4.43 0.59 1.55 1.43 -1.20 -4.93 118.68 112.09 1mf0 s LEU 422 Ca -0.07 2.64 -0.08 0.00 -1.03 0.00 0.00 54.13 55.58 1mf0 s LEU 422 Cb 0.12 -3.66 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 1mf0 s LEU 422 CO 0.83 -0.51 0.95 -2.16 0.23 0.00 0.00 176.35 175.69 1mf0 s PRO 423 N -1.78 3.31 0.00 1.29 0.04 -1.26 -4.78 135.00 131.81 1mf0 s PRO 423 Ca 0.49 0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.92 1mf0 s PRO 423 Cb -0.39 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 31.96 1mf0 s PRO 423 CO 0.51 -0.59 0.25 -2.30 0.04 0.00 0.00 177.00 174.92 1mf0 n PRO 424 N -2.63 0.00 -0.25 0.56 -0.02 -1.26 -0.77 135.00 130.62 1mf0 n PRO 424 Ca 0.04 0.25 0.32 0.00 -2.02 0.00 0.00 63.50 62.10 1mf0 n PRO 424 Cb 0.56 -0.50 0.74 0.00 -0.02 0.00 0.00 33.50 34.27 1mf0 n PRO 424 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1mf0 h GLN 425 N 0.00 0.00 -0.00 -0.52 7.50 -1.88 0.24 115.11 120.45 1mf0 h GLN 425 Ca 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.15 1mf0 h GLN 425 Cb 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.53 1mf0 h GLN 425 CO 0.00 0.00 -0.00 0.00 -1.50 0.00 0.00 178.83 177.33 1mf0 h ALA 426 N 1.42 0.00 -0.91 3.87 0.00 -1.28 -1.13 119.26 121.23 1mf0 h ALA 426 Ca 0.50 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1mf0 h ALA 426 Cb 2.07 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.81 1mf0 h ALA 426 CO -0.01 -0.26 0.59 1.96 0.00 0.00 0.00 179.25 181.54 1mf0 h GLN 427 N -0.47 1.12 -0.34 0.00 4.20 0.76 -1.62 115.11 118.76 1mf0 h GLN 427 Ca 0.00 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1mf0 h GLN 427 Cb 0.48 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 1mf0 h GLN 427 CO 0.00 0.74 -0.00 1.03 -0.67 0.00 0.00 178.83 179.93 1mf0 h SER 428 N 1.15 0.50 -0.29 1.46 0.87 -0.98 -1.77 113.55 114.50 1mf0 h SER 428 Ca 0.36 -0.09 -0.10 0.00 -1.23 0.00 0.00 61.79 60.73 1mf0 h SER 428 Cb -0.00 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 1mf0 h SER 428 CO -0.12 0.57 -0.15 0.22 -0.53 0.00 0.00 176.83 176.82 1mf0 h TYR 429 N 0.51 0.81 0.21 2.24 3.20 -0.26 0.66 116.97 124.33 1mf0 h TYR 429 Ca 0.11 -0.16 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 1mf0 h TYR 429 Cb 0.33 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.40 1mf0 h TYR 429 CO 0.01 0.83 -0.10 0.28 -1.64 0.00 0.00 178.16 177.55 1mf0 h VAL 430 N 0.65 0.88 -0.39 1.81 2.07 -0.77 -2.73 116.25 117.77 1mf0 h VAL 430 Ca 0.11 -0.58 0.08 0.00 0.82 0.00 0.00 66.70 67.12 1mf0 h VAL 430 Cb 0.63 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 31.53 1mf0 h VAL 430 CO 0.04 0.13 -0.08 0.03 0.02 0.00 0.00 177.57 177.71 1mf0 h ARG 431 N -0.58 0.02 -0.80 1.57 3.08 -1.22 0.15 114.38 116.60 1mf0 h ARG 431 Ca -0.03 -0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.18 1mf0 h ARG 431 Cb 0.43 -0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.32 1mf0 h ARG 431 CO 0.05 0.01 -0.20 0.35 -1.07 0.00 0.00 179.97 179.11 1mf0 h PHE 432 N 0.02 -0.42 -0.09 3.04 3.57 -0.75 1.41 116.94 123.72 1mf0 h PHE 432 Ca 0.19 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 1mf0 h PHE 432 Cb 0.29 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 1mf0 h PHE 432 CO -0.34 -0.34 -0.02 0.28 -2.23 0.00 0.00 178.31 175.66 1mf0 h VAL 433 N 0.00 1.28 -0.96 1.41 2.07 -0.95 -1.77 116.25 117.33 1mf0 h VAL 433 Ca 0.38 -0.91 0.14 0.00 0.82 0.00 0.00 66.70 67.14 1mf0 h VAL 433 Cb 0.59 1.72 -0.09 0.00 -1.52 0.00 0.00 31.29 31.98 1mf0 h VAL 433 CO -0.82 0.26 0.58 -0.08 0.02 0.00 0.00 177.57 177.52 1mf0 h GLU 434 N -0.15 0.83 0.14 1.57 4.81 0.21 -2.55 114.58 119.42 1mf0 h GLU 434 Ca 0.02 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1mf0 h GLU 434 Cb 0.41 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1mf0 h GLU 434 CO 0.01 0.55 -0.06 -0.91 -0.73 0.00 0.00 179.01 177.86 1mf0 h ASN 435 N 0.85 -0.15 0.23 1.04 2.35 0.19 -2.55 115.58 117.54 1mf0 h ASN 435 Ca 0.51 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1mf0 h ASN 435 Cb 0.62 0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.03 1mf0 h ASN 435 CO -0.31 0.44 0.00 1.41 -1.65 0.00 0.00 177.43 177.32 1mf0 n HIS 436 N -4.87 0.06 0.59 1.19 8.25 -0.68 -1.51 115.22 118.24 1mf0 n HIS 436 Ca -0.06 0.03 0.06 0.00 -0.26 0.00 0.00 57.72 57.48 1mf0 n HIS 436 Cb 0.24 -0.54 -0.05 0.00 1.12 0.00 0.00 29.99 30.76 1mf0 n HIS 436 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1mf0 n MET 437 N -1.56 2.59 -2.59 -0.41 2.81 -0.97 -4.91 117.12 112.08 1mf0 n MET 437 Ca 0.01 -0.21 -0.18 0.00 -1.81 0.00 0.00 57.70 55.51 1mf0 n MET 437 Cb 0.08 -1.11 -0.00 0.00 -0.71 0.00 0.00 33.22 31.47 1mf0 n MET 437 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1mf0 n GLY 438 N 1.21 -0.50 2.83 3.03 0.00 -0.57 -4.96 105.19 106.23 1mf0 n GLY 438 Ca 0.03 0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 1mf0 n GLY 438 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mf0 s VAL 439 N -2.90 0.24 0.40 1.61 1.01 -1.05 -5.06 120.40 114.64 1mf0 s VAL 439 Ca 0.08 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 1mf0 s VAL 439 Cb -0.04 -0.34 -0.08 0.00 0.00 0.00 0.00 36.38 35.92 1mf0 s VAL 439 CO 0.10 0.17 1.15 0.00 0.00 0.00 0.00 175.10 176.52 1mf0 s ALA 440 N 1.09 3.14 -0.30 5.51 0.00 -1.26 -4.41 121.76 125.52 1mf0 s ALA 440 Ca -0.09 0.93 -0.21 0.00 0.00 0.00 0.00 51.96 52.59 1mf0 s ALA 440 Cb -0.14 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 1mf0 s ALA 440 CO -0.02 -0.49 0.68 0.08 0.00 0.00 0.00 175.76 176.01 1mf0 s VAL 441 N -1.45 4.89 -0.04 0.00 1.01 -1.26 -0.45 120.40 123.11 1mf0 s VAL 441 Ca 0.57 0.99 0.12 0.00 0.00 0.00 0.00 61.98 63.66 1mf0 s VAL 441 Cb -0.29 -4.04 -0.23 0.00 0.00 0.00 0.00 36.38 31.81 1mf0 s VAL 441 CO 0.37 -0.16 0.68 0.50 0.00 0.00 0.00 175.10 176.49 1mf0 h LYS 442 N 8.14 0.00 -4.62 2.72 3.64 -0.65 -3.43 116.57 122.37 1mf0 h LYS 442 Ca -0.26 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 58.85 1mf0 h LYS 442 Cb 1.11 0.00 -0.20 0.00 -0.41 0.00 0.00 32.23 32.73 1mf0 h LYS 442 CO 0.83 0.51 -0.73 -1.58 -2.27 0.00 0.00 179.45 176.20 1mf0 s TRP 443 N -2.60 0.73 -0.09 1.91 0.51 -0.91 -1.36 118.94 117.12 1mf0 s TRP 443 Ca -0.04 -0.55 0.00 0.00 -2.12 0.00 0.00 56.10 53.40 1mf0 s TRP 443 Cb 0.08 -0.43 0.02 0.00 -0.81 0.00 0.00 33.47 32.33 1mf0 s TRP 443 CO 0.82 -0.08 -0.08 0.08 -0.51 0.00 0.00 176.95 177.18 1mf0 s VAL 444 N -1.63 0.99 -0.17 4.03 1.01 0.14 -0.93 120.40 123.84 1mf0 s VAL 444 Ca -0.07 -0.31 -0.11 0.00 0.00 0.00 0.00 61.98 61.49 1mf0 s VAL 444 Cb -0.08 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 1mf0 s VAL 444 CO -0.00 0.35 0.19 -0.83 0.00 0.00 0.00 175.10 174.80 1mf0 s GLY 445 N 1.34 2.13 -0.04 4.51 0.00 0.89 0.44 107.32 116.58 1mf0 s GLY 445 Ca -0.02 -0.60 0.06 0.00 0.00 0.00 0.00 44.72 44.16 1mf0 s GLY 445 CO -0.04 0.11 0.96 3.33 0.00 0.00 0.00 173.10 177.46 1mf0 n VAL 446 N 3.15 0.89 -3.73 1.40 0.24 -1.01 -1.39 118.33 117.88 1mf0 n VAL 446 Ca -0.16 -1.01 0.01 0.00 -2.04 0.00 0.00 64.34 61.15 1mf0 n VAL 446 Cb 0.53 0.36 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 1mf0 n VAL 446 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1mf0 s GLY 447 N -1.42 -0.30 0.11 7.63 0.00 -1.16 -4.36 107.32 107.82 1mf0 s GLY 447 Ca 0.10 0.43 0.07 0.00 0.00 0.00 0.00 44.72 45.33 1mf0 s GLY 447 CO 0.01 1.52 1.24 0.50 0.00 0.00 0.00 173.10 176.37 1mf0 h LYS 448 N 2.00 0.00 -7.37 2.90 1.57 -1.95 -3.45 116.57 110.28 1mf0 h LYS 448 Ca -0.28 -0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 57.99 1mf0 h LYS 448 Cb 1.20 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.61 1mf0 h LYS 448 CO 0.29 0.97 0.37 0.45 -0.57 0.00 0.00 179.45 180.96 1mf0 s SER 449 N -6.67 5.27 0.36 0.86 0.15 -1.26 -4.05 113.70 108.36 1mf0 s SER 449 Ca 0.01 1.48 0.09 0.00 0.70 0.00 0.00 55.95 58.22 1mf0 s SER 449 Cb 0.10 -2.34 0.81 0.00 -1.71 0.00 0.00 66.02 62.88 1mf0 s SER 449 CO 0.82 -1.49 1.88 -0.09 1.20 0.00 0.00 173.24 175.56 1mf0 h ARG 450 N -0.76 0.68 0.00 5.44 2.43 -1.30 -1.43 114.38 119.44 1mf0 h ARG 450 Ca -0.45 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1mf0 h ARG 450 Cb 1.23 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1mf0 h ARG 450 CO 0.59 0.45 -0.08 1.05 -1.51 0.00 0.00 179.97 180.46 1mf0 h GLU 451 N 0.70 0.00 -3.64 0.20 9.09 -1.93 -3.37 114.58 115.63 1mf0 h GLU 451 Ca 0.42 0.00 -0.63 0.00 0.05 0.00 0.00 59.36 59.20 1mf0 h GLU 451 Cb 0.65 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.76 1mf0 h GLU 451 CO -0.19 0.00 3.18 0.43 0.05 0.00 0.00 179.01 182.48 1mf0 n SER 452 N -3.02 5.52 -3.68 3.06 7.64 -0.54 -4.75 113.62 117.85 1mf0 n SER 452 Ca 0.04 -2.64 -0.14 0.00 1.01 0.00 0.00 58.87 57.14 1mf0 n SER 452 Cb 0.53 -1.45 -0.08 0.00 -1.01 0.00 0.00 64.21 62.19 1mf0 n SER 452 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1mf0 s MET 453 N 3.15 0.69 -0.01 1.43 0.00 -1.26 -2.39 119.30 120.92 1mf0 s MET 453 Ca 0.55 0.50 0.07 0.00 0.00 0.00 0.00 55.69 56.81 1mf0 s MET 453 Cb 0.15 0.33 -0.03 0.00 0.00 0.00 0.00 34.83 35.28 1mf0 s MET 453 CO -0.04 -0.13 -0.21 0.42 0.00 0.00 0.00 175.02 175.06 1mf0 s ILE 454 N -0.22 2.55 -0.23 10.11 1.01 0.17 -4.78 121.20 129.81 1mf0 s ILE 454 Ca -0.04 -1.05 -0.02 0.00 0.00 0.00 0.00 60.65 59.55 1mf0 s ILE 454 Cb -0.03 -1.98 0.02 0.00 0.01 0.00 0.00 42.46 40.47 1mf0 s ILE 454 CO 0.03 0.50 -0.08 -1.58 0.00 0.00 0.00 174.94 173.80 1mf0 s GLN 455 N -0.93 3.00 0.45 2.79 0.74 -1.26 -0.69 119.66 123.77 1mf0 s GLN 455 Ca 0.12 -0.86 0.28 0.00 0.05 0.00 0.00 55.36 54.95 1mf0 s GLN 455 Cb -0.10 -2.92 0.89 0.00 1.10 0.00 0.00 33.01 31.98 1mf0 s GLN 455 CO 0.01 -0.31 1.80 -0.07 -0.55 0.00 0.00 175.29 176.17 1mf0 h LEU 456 N 8.02 0.00 0.00 3.68 3.38 -1.48 -3.44 115.31 125.47 1mf0 h LEU 456 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1mf0 h LEU 456 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1mf0 h LEU 456 CO 0.59 0.00 0.00 2.22 0.09 0.00 0.00 178.44 181.34