#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3feq s ILE 3 N 0.00 0.03 0.02 2.28 2.07 -1.26 -3.09 121.20 121.25 3feq s ILE 3 Ca 0.00 -0.22 -0.01 0.00 -1.41 0.00 0.00 60.65 59.01 3feq s ILE 3 Cb 0.00 -0.83 -0.02 0.00 0.13 0.00 0.00 42.46 41.74 3feq s ILE 3 CO 0.00 -0.12 -0.01 -0.89 -1.91 0.00 0.00 174.94 172.01 3feq s THR 4 N -1.32 0.10 -0.11 4.00 2.01 0.72 -2.12 115.64 118.92 3feq s THR 4 Ca -0.12 -0.86 -0.01 0.00 0.31 0.00 0.00 61.69 61.01 3feq s THR 4 Cb -0.02 -0.27 0.03 0.00 0.01 0.00 0.00 72.50 72.25 3feq s THR 4 CO 0.07 -0.47 -0.01 -0.69 -0.69 0.00 0.00 174.62 172.83 3feq s VAL 5 N -1.40 0.57 -0.46 3.82 1.01 -0.58 -0.25 120.40 123.11 3feq s VAL 5 Ca -0.15 -0.13 -0.27 0.00 0.00 0.00 0.00 61.98 61.43 3feq s VAL 5 Cb -0.09 -0.77 0.03 0.00 0.00 0.00 0.00 36.38 35.54 3feq s VAL 5 CO -0.01 0.18 0.99 -0.76 0.00 0.00 0.00 175.10 175.51 3feq s LEU 6 N 1.88 3.89 -0.11 3.92 2.01 -0.66 -1.33 118.68 128.27 3feq s LEU 6 Ca 0.04 0.28 -0.05 0.00 0.01 0.00 0.00 54.13 54.41 3feq s LEU 6 Cb -0.13 -3.32 -0.04 0.00 0.01 0.00 0.00 46.19 42.71 3feq s LEU 6 CO -0.06 -1.10 0.06 0.00 1.01 0.00 0.00 176.35 176.26 3feq s GLN 7 N 3.95 3.31 -1.28 1.70 -2.07 -0.87 -0.99 119.66 123.41 3feq s GLN 7 Ca 0.41 -0.30 0.00 0.00 -1.82 0.00 0.00 55.36 53.65 3feq s GLN 7 Cb -0.09 -3.00 0.00 0.00 -1.09 0.00 0.00 33.01 28.82 3feq s GLN 7 CO 0.27 0.66 0.00 0.41 -1.32 0.00 0.00 175.29 175.31 3feq n GLY 8 N 2.31 -0.23 3.90 2.60 0.00 -1.25 -1.29 105.19 111.23 3feq n GLY 8 Ca -0.19 -0.26 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 3feq n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3feq s GLY 9 N -2.33 1.53 -0.74 -0.02 0.00 -0.95 -3.39 107.32 101.42 3feq s GLY 9 Ca 0.00 -0.43 -0.16 0.00 0.00 0.00 0.00 44.72 44.13 3feq s GLY 9 CO 0.00 -0.24 0.73 -1.31 0.00 0.00 0.00 173.10 172.28 3feq s ASN 10 N -4.13 6.54 -0.11 1.64 0.02 -0.39 -1.18 114.94 117.33 3feq s ASN 10 Ca 0.49 -2.25 -0.30 0.00 -1.02 0.00 0.00 52.86 49.78 3feq s ASN 10 Cb -0.10 -2.24 -0.03 0.00 0.02 0.00 0.00 41.25 38.90 3feq s ASN 10 CO 0.47 -0.76 1.36 -0.69 0.02 0.00 0.00 177.10 177.50 3feq s VAL 11 N 1.06 4.06 -0.22 1.60 1.01 -0.80 -2.47 120.40 124.64 3feq s VAL 11 Ca 0.15 1.31 -0.29 0.00 0.00 0.00 0.00 61.98 63.15 3feq s VAL 11 Cb -0.16 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 3feq s VAL 11 CO -0.04 -0.09 1.27 -0.22 0.00 0.00 0.00 175.10 176.03 3feq s LEU 12 N 3.32 4.06 -0.22 3.92 0.20 -0.59 -0.66 118.68 128.71 3feq s LEU 12 Ca 0.60 1.50 -0.08 0.00 0.69 0.00 0.00 54.13 56.84 3feq s LEU 12 Cb -0.26 -3.54 -0.04 0.00 -0.43 0.00 0.00 46.19 41.93 3feq s LEU 12 CO 0.20 -0.89 0.09 -0.62 -0.29 0.00 0.00 176.35 174.84 3feq s ASP 13 N 2.29 5.56 -0.09 3.68 -1.08 -0.53 -4.75 116.67 121.75 3feq s ASP 13 Ca 0.55 -0.02 0.08 0.00 -0.52 0.00 0.00 52.55 52.65 3feq s ASP 13 Cb -0.20 -1.98 -0.24 0.00 -1.46 0.00 0.00 42.92 39.04 3feq s ASP 13 CO 0.18 0.07 0.50 0.18 0.52 0.00 0.00 175.17 176.62 3feq n LEU 14 N 4.21 1.28 0.15 -1.34 4.77 -1.26 -1.22 117.00 123.59 3feq n LEU 14 Ca -0.16 0.30 0.13 0.00 -0.03 0.00 0.00 56.01 56.25 3feq n LEU 14 Cb 0.52 -0.14 0.38 0.00 -2.33 0.00 0.00 43.42 41.85 3feq n LEU 14 CO 0.34 0.53 0.87 1.05 -1.33 0.00 0.00 177.39 178.85 3feq h GLU 15 N 0.02 0.00 0.00 3.23 9.09 -1.97 -3.18 114.58 121.77 3feq h GLU 15 Ca -0.36 0.00 -0.30 0.00 0.05 0.00 0.00 59.36 58.75 3feq h GLU 15 Cb 2.04 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 29.08 3feq h GLU 15 CO 0.07 0.00 -2.13 0.54 0.05 0.00 0.00 179.01 177.54 3feq n ARG 16 N -2.56 1.26 -2.05 1.06 1.74 -1.25 -5.04 116.66 109.82 3feq n ARG 16 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 3feq n ARG 16 Cb 0.42 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 3feq n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3feq n GLY 17 N 2.04 0.91 3.04 -0.13 0.00 -0.36 -5.08 105.19 105.61 3feq n GLY 17 Ca -0.28 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 3feq n GLY 17 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3feq s VAL 18 N -2.82 0.11 0.43 1.61 -7.23 -0.97 -5.03 120.40 106.49 3feq s VAL 18 Ca 0.00 -0.89 -0.23 0.00 -1.81 0.00 0.00 61.98 59.05 3feq s VAL 18 Cb 0.00 -0.42 -0.09 0.00 0.56 0.00 0.00 36.38 36.44 3feq s VAL 18 CO 0.00 -0.49 1.06 -0.76 -0.31 0.00 0.00 175.10 174.60 3feq s LEU 19 N -1.55 4.04 -0.34 1.32 1.43 -1.26 -1.46 118.68 120.87 3feq s LEU 19 Ca -0.14 2.03 0.02 0.00 -1.03 0.00 0.00 54.13 55.02 3feq s LEU 19 Cb -0.08 -4.30 0.09 0.00 0.03 0.00 0.00 46.19 41.93 3feq s LEU 19 CO -0.01 -0.62 0.05 -0.76 0.23 0.00 0.00 176.35 175.24 3feq s LEU 20 N -2.92 4.61 0.49 1.79 1.43 0.17 -4.92 118.68 119.32 3feq s LEU 20 Ca 0.61 -1.98 -0.20 0.00 -1.03 0.00 0.00 54.13 51.52 3feq s LEU 20 Cb -0.21 -1.65 -0.08 0.00 0.03 0.00 0.00 46.19 44.27 3feq s LEU 20 CO 0.26 -0.37 1.04 -1.83 0.23 0.00 0.00 176.35 175.68 3feq s GLU 21 N 0.98 3.79 -1.65 1.70 1.03 -1.26 -1.91 118.70 121.39 3feq s GLU 21 Ca 0.07 1.38 -0.16 0.00 0.03 0.00 0.00 54.97 56.29 3feq s GLU 21 Cb -0.20 -2.11 0.13 0.00 -0.80 0.00 0.00 34.13 31.16 3feq s GLU 21 CO -0.07 -0.44 0.80 0.72 -1.33 0.00 0.00 175.26 174.94 3feq n HIS 22 N -0.95 -1.85 -3.44 4.83 8.25 -0.98 -4.93 115.22 116.16 3feq n HIS 22 Ca 0.09 0.82 -0.37 0.00 -0.26 0.00 0.00 57.72 58.00 3feq n HIS 22 Cb 0.52 -3.22 -0.07 0.00 1.12 0.00 0.00 29.99 28.35 3feq n HIS 22 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3feq s HIS 23 N -3.35 3.49 0.45 4.41 3.76 -0.32 -4.39 115.29 119.34 3feq s HIS 23 Ca 0.67 0.73 -0.11 0.00 -0.15 0.00 0.00 55.06 56.20 3feq s HIS 23 Cb -0.36 -2.43 -0.06 0.00 1.11 0.00 0.00 32.58 30.84 3feq s HIS 23 CO 0.91 0.21 0.83 -1.01 -0.85 0.00 0.00 174.74 174.82 3feq s HIS 24 N 0.52 3.50 -0.06 1.40 3.76 0.46 -2.24 115.29 122.63 3feq s HIS 24 Ca 0.21 1.10 0.02 0.00 -0.15 0.00 0.00 55.06 56.23 3feq s HIS 24 Cb -0.14 -2.50 0.02 0.00 1.11 0.00 0.00 32.58 31.07 3feq s HIS 24 CO 0.07 -0.22 -0.09 0.54 -0.85 0.00 0.00 174.74 174.18 3feq s VAL 25 N -2.54 0.91 -0.26 -0.90 0.11 -0.16 -1.69 120.40 115.88 3feq s VAL 25 Ca 0.52 -0.34 -0.06 0.00 -2.93 0.00 0.00 61.98 59.16 3feq s VAL 25 Cb -0.10 -0.87 -0.01 0.00 -1.53 0.00 0.00 36.38 33.87 3feq s VAL 25 CO 0.35 0.31 0.05 -0.69 -3.33 0.00 0.00 175.10 171.79 3feq s VAL 26 N 0.78 3.97 -0.22 2.04 1.01 0.14 -1.66 120.40 126.47 3feq s VAL 26 Ca -0.13 -0.42 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 3feq s VAL 26 Cb -0.15 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 33.27 3feq s VAL 26 CO 0.02 0.27 0.12 -0.63 0.00 0.00 0.00 175.10 174.89 3feq s ILE 27 N 1.54 5.13 -0.12 2.22 -1.09 0.65 -0.04 121.20 129.50 3feq s ILE 27 Ca 0.05 0.10 0.02 0.00 -2.23 0.00 0.00 60.65 58.59 3feq s ILE 27 Cb -0.16 -3.37 0.01 0.00 -1.58 0.00 0.00 42.46 37.37 3feq s ILE 27 CO 0.02 0.39 -0.19 -0.62 -1.23 0.00 0.00 174.94 173.31 3feq s ASP 28 N 0.82 2.78 1.77 3.58 3.68 -0.75 -0.20 116.67 128.34 3feq s ASP 28 Ca 0.06 -0.52 0.00 0.00 2.13 0.00 0.00 52.55 54.23 3feq s ASP 28 Cb -0.13 -1.27 0.00 0.00 -1.45 0.00 0.00 42.92 40.07 3feq s ASP 28 CO 0.02 0.06 0.00 0.61 0.13 0.00 0.00 175.17 175.99 3feq n GLY 29 N 4.08 2.73 0.37 2.66 0.00 -1.18 -2.32 105.19 111.53 3feq n GLY 29 Ca -0.20 0.12 0.06 0.00 0.00 0.00 0.00 46.02 46.01 3feq n GLY 29 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3feq n GLU 30 N 7.19 1.31 -4.27 1.61 1.02 -1.26 -4.14 120.64 122.10 3feq n GLU 30 Ca 0.00 -0.94 -0.28 0.00 -0.02 0.00 0.00 57.16 55.92 3feq n GLU 30 Cb 0.00 -1.18 -0.10 0.00 -0.02 0.00 0.00 31.44 30.14 3feq n GLU 30 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3feq s ARG 31 N -1.23 2.05 -0.24 3.49 0.52 -0.98 0.57 118.95 123.13 3feq s ARG 31 Ca 0.12 -1.19 -0.24 0.00 -0.52 0.00 0.00 55.73 53.89 3feq s ARG 31 Cb 0.10 -2.20 -0.01 0.00 0.52 0.00 0.00 34.95 33.37 3feq s ARG 31 CO 0.22 0.46 0.82 0.42 0.02 0.00 0.00 175.30 177.24 3feq s ILE 32 N -1.51 4.84 -0.19 1.52 1.01 0.09 -1.82 121.20 125.14 3feq s ILE 32 Ca 0.23 1.55 0.10 0.00 0.00 0.00 0.00 60.65 62.54 3feq s ILE 32 Cb -0.10 -4.11 -0.22 0.00 0.01 0.00 0.00 42.46 38.04 3feq s ILE 32 CO 0.14 -0.07 0.08 0.52 0.00 0.00 0.00 174.94 175.61 3feq n VAL 33 N 5.25 1.48 -3.77 2.92 0.31 0.95 0.12 118.33 125.59 3feq n VAL 33 Ca 0.05 -0.75 -0.13 0.00 -0.01 0.00 0.00 64.34 63.51 3feq n VAL 33 Cb 0.48 -0.93 -0.12 0.00 -0.91 0.00 0.00 33.84 32.35 3feq n VAL 33 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3feq s GLU 34 N -2.52 0.25 -0.19 5.55 2.02 -1.15 -4.76 118.70 117.89 3feq s GLU 34 Ca -0.18 0.39 0.01 0.00 0.02 0.00 0.00 54.97 55.21 3feq s GLU 34 Cb 0.07 0.05 0.04 0.00 0.10 0.00 0.00 34.13 34.39 3feq s GLU 34 CO 0.75 -0.07 -0.12 0.08 0.02 0.00 0.00 175.26 175.92 3feq s VAL 35 N 0.48 1.74 0.11 2.63 1.01 -1.26 0.27 120.40 125.39 3feq s VAL 35 Ca -0.03 -1.00 -0.18 0.00 0.00 0.00 0.00 61.98 60.77 3feq s VAL 35 Cb -0.04 -1.75 0.04 0.00 0.00 0.00 0.00 36.38 34.63 3feq s VAL 35 CO -0.02 0.25 0.45 0.28 0.00 0.00 0.00 175.10 176.06 3feq s THR 36 N 1.37 0.05 -0.57 3.92 -1.32 -0.68 -4.98 115.64 113.43 3feq s THR 36 Ca -0.00 -0.44 0.16 0.00 -1.21 0.00 0.00 61.69 60.20 3feq s THR 36 Cb -0.16 -1.10 0.72 0.00 -1.51 0.00 0.00 72.50 70.46 3feq s THR 36 CO -0.09 -0.24 1.64 -0.90 -2.21 0.00 0.00 174.62 172.82 3feq n ASP 37 N -0.11 5.01 -4.69 8.08 5.75 -1.26 0.18 116.55 129.51 3feq n ASP 37 Ca -0.17 -2.74 -0.39 0.00 -0.01 0.00 0.00 54.79 51.48 3feq n ASP 37 Cb 0.63 -0.61 0.04 0.00 -1.03 0.00 0.00 41.12 40.15 3feq n ASP 37 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3feq n ARG 38 N 0.61 1.51 -1.66 0.11 5.12 -1.26 -4.93 116.66 116.16 3feq n ARG 38 Ca 0.26 0.56 -0.43 0.00 -1.93 0.00 0.00 57.85 56.30 3feq n ARG 38 Cb 1.02 -2.38 -0.03 0.00 -1.16 0.00 0.00 32.46 29.90 3feq n ARG 38 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 3feq n PRO 39 N -0.68 2.77 -4.05 5.56 -0.04 -1.26 -4.76 135.00 132.54 3feq n PRO 39 Ca 0.10 1.01 -0.29 0.00 -0.04 0.00 0.00 63.50 64.28 3feq n PRO 39 Cb 0.44 -2.99 -0.06 0.00 -0.04 0.00 0.00 33.50 30.85 3feq n PRO 39 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3feq s VAL 40 N 4.60 4.56 -1.20 0.52 0.11 -1.26 -5.02 120.40 122.71 3feq s VAL 40 Ca 0.90 -0.82 -0.06 0.00 -2.93 0.00 0.00 61.98 59.07 3feq s VAL 40 Cb -0.46 -3.23 0.22 0.00 -1.53 0.00 0.00 36.38 31.38 3feq s VAL 40 CO 0.43 0.07 1.88 -0.67 -3.33 0.00 0.00 175.10 173.48 3feq n ASP 41 N 0.26 6.42 -4.49 3.54 4.64 -1.26 -4.97 116.55 120.69 3feq n ASP 41 Ca -0.08 -3.28 -0.43 0.00 -1.38 0.00 0.00 54.79 49.62 3feq n ASP 41 Cb 0.52 -1.35 -0.04 0.00 -1.04 0.00 0.00 41.12 39.21 3feq n ASP 41 CO 0.00 0.00 0.00 -1.48 -0.82 0.00 0.00 177.20 174.90 3feq s LEU 42 N -1.88 4.26 -0.07 -2.67 2.34 -1.26 -4.91 118.68 114.49 3feq s LEU 42 Ca 0.40 -0.60 -0.02 0.00 0.06 0.00 0.00 54.13 53.98 3feq s LEU 42 Cb 0.12 -2.66 -0.01 0.00 -0.56 0.00 0.00 46.19 43.08 3feq s LEU 42 CO -0.01 -1.27 -0.04 1.55 -1.06 0.00 0.00 176.35 175.53 3feq h PRO 43 N 9.37 0.00 -0.37 1.48 0.14 -2.02 -3.42 132.00 137.18 3feq h PRO 43 Ca -0.27 0.00 -0.26 0.00 0.14 0.00 0.00 66.00 65.61 3feq h PRO 43 Cb 1.07 0.00 -0.18 0.00 0.14 0.00 0.00 31.00 32.03 3feq h PRO 43 CO 1.11 0.00 -0.48 0.09 0.14 0.00 0.00 178.00 178.86 3feq n ASN 44 N -3.61 3.23 -4.81 1.44 4.13 -1.26 -5.04 115.26 109.35 3feq n ASN 44 Ca -0.01 -3.83 -0.38 0.00 1.68 0.00 0.00 54.58 52.03 3feq n ASN 44 Cb 0.05 -0.50 -0.06 0.00 -1.54 0.00 0.00 39.78 37.73 3feq n ASN 44 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3feq s ALA 45 N -3.40 3.61 -0.62 5.41 0.00 -1.26 -4.56 121.76 120.94 3feq s ALA 45 Ca 0.45 -0.09 -0.26 0.00 0.00 0.00 0.00 51.96 52.06 3feq s ALA 45 Cb 0.40 -2.55 -0.04 0.00 0.00 0.00 0.00 23.12 20.93 3feq s ALA 45 CO -0.02 0.37 2.05 -0.65 0.00 0.00 0.00 175.76 177.51 3feq s GLN 46 N -0.84 2.41 -0.11 0.00 1.11 -0.90 -4.83 119.66 116.50 3feq s GLN 46 Ca 0.27 0.71 -0.30 0.00 0.01 0.00 0.00 55.36 56.05 3feq s GLN 46 Cb -0.18 -4.54 -0.03 0.00 -1.01 0.00 0.00 33.01 27.25 3feq s GLN 46 CO 0.16 -3.06 1.32 0.00 0.01 0.00 0.00 175.29 173.72 3feq s ALA 47 N 10.38 3.61 -0.19 6.09 0.00 -1.26 -1.53 121.76 138.86 3feq s ALA 47 Ca 0.77 0.61 -0.03 0.00 0.00 0.00 0.00 51.96 53.31 3feq s ALA 47 Cb -0.13 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.37 3feq s ALA 47 CO 0.19 -1.08 -0.07 0.42 0.00 0.00 0.00 175.76 175.22 3feq s ILE 48 N 3.16 3.33 -0.37 0.00 1.01 -0.44 -4.97 121.20 122.91 3feq s ILE 48 Ca 0.58 -0.53 -0.25 0.00 0.00 0.00 0.00 60.65 60.45 3feq s ILE 48 Cb -0.25 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 39.76 3feq s ILE 48 CO 0.20 0.46 0.90 -0.62 0.00 0.00 0.00 174.94 175.88 3feq s ASP 49 N 1.04 6.65 -0.38 3.58 -1.08 -1.26 -2.04 116.67 123.17 3feq s ASP 49 Ca 0.00 0.51 0.05 0.00 -0.52 0.00 0.00 52.55 52.60 3feq s ASP 49 Cb -0.15 -2.45 0.45 0.00 -1.46 0.00 0.00 42.92 39.31 3feq s ASP 49 CO -0.00 -0.85 1.29 0.52 0.52 0.00 0.00 175.17 176.64 3feq n VAL 50 N 5.98 2.64 -2.08 1.11 0.31 -0.41 -4.94 118.33 120.94 3feq n VAL 50 Ca 0.06 -4.26 -0.41 0.00 -0.01 0.00 0.00 64.34 59.72 3feq n VAL 50 Cb 0.48 -1.18 -0.03 0.00 -0.91 0.00 0.00 33.84 32.21 3feq n VAL 50 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3feq s ARG 51 N -3.63 4.31 -1.35 5.55 3.03 -1.24 -3.09 118.95 122.53 3feq s ARG 51 Ca 0.52 2.21 -0.08 0.00 2.03 0.00 0.00 55.73 60.41 3feq s ARG 51 Cb 0.42 -3.15 0.05 0.00 -1.03 0.00 0.00 34.95 31.24 3feq s ARG 51 CO -0.04 -0.38 0.51 0.41 -1.13 0.00 0.00 175.30 174.67 3feq n GLY 52 N 2.49 -0.50 3.10 3.88 0.00 -1.22 -4.97 105.19 107.97 3feq n GLY 52 Ca 0.08 0.10 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 3feq n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3feq s LYS 53 N -5.88 0.76 -0.08 1.61 1.02 -1.18 -4.66 119.74 111.32 3feq s LYS 53 Ca 0.35 -0.69 -0.30 0.00 0.02 0.00 0.00 55.97 55.36 3feq s LYS 53 Cb -0.18 -0.70 -0.02 0.00 -0.52 0.00 0.00 37.83 36.41 3feq s LYS 53 CO 0.44 0.17 1.13 0.99 -0.92 0.00 0.00 175.35 177.16 3feq s THR 54 N -0.91 4.45 -0.25 2.17 2.01 0.21 -1.27 115.64 122.06 3feq s THR 54 Ca -0.01 1.75 -0.05 0.00 0.31 0.00 0.00 61.69 63.69 3feq s THR 54 Cb -0.08 -4.13 -0.00 0.00 0.01 0.00 0.00 72.50 68.30 3feq s THR 54 CO 0.01 -0.01 0.02 0.54 -0.69 0.00 0.00 174.62 174.49 3feq s VAL 55 N 2.23 3.70 0.31 3.82 0.11 -1.03 0.69 120.40 130.23 3feq s VAL 55 Ca 0.53 -0.54 0.03 0.00 -2.93 0.00 0.00 61.98 59.06 3feq s VAL 55 Cb -0.22 -2.79 -0.05 0.00 -1.53 0.00 0.00 36.38 31.79 3feq s VAL 55 CO 0.20 0.27 0.10 0.00 -3.33 0.00 0.00 175.10 172.34 3feq s MET 56 N 1.50 1.59 0.50 1.54 0.23 -0.71 -1.55 119.30 122.40 3feq s MET 56 Ca 0.04 -1.89 -0.21 0.00 -1.03 0.00 0.00 55.69 52.60 3feq s MET 56 Cb -0.16 -0.51 -0.07 0.00 -1.53 0.00 0.00 34.83 32.57 3feq s MET 56 CO -0.00 -0.30 1.11 -2.14 -2.03 0.00 0.00 175.02 171.66 3feq s PRO 57 N -3.91 3.62 0.41 3.16 0.02 -1.26 -0.68 135.00 136.35 3feq s PRO 57 Ca 0.35 1.60 -0.26 0.00 0.02 0.00 0.00 61.00 62.71 3feq s PRO 57 Cb 0.07 -2.17 -0.10 0.00 0.02 0.00 0.00 34.50 32.32 3feq s PRO 57 CO 0.15 -0.63 1.38 0.41 -0.33 0.00 0.00 177.00 177.98 3feq n GLY 58 N 0.17 0.85 3.81 0.52 0.00 0.21 -4.44 105.19 106.32 3feq n GLY 58 Ca 0.09 0.24 -0.33 0.00 0.00 0.00 0.00 46.02 46.02 3feq n GLY 58 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3feq s PHE 59 N -1.16 3.09 -0.20 1.61 0.08 -0.65 -4.66 117.98 116.09 3feq s PHE 59 Ca 0.58 1.55 -0.01 0.00 0.12 0.00 0.00 56.93 59.17 3feq s PHE 59 Cb -0.49 -2.99 0.01 0.00 -0.57 0.00 0.00 43.02 38.98 3feq s PHE 59 CO 0.60 -0.75 -0.13 0.42 -0.10 0.00 0.00 175.22 175.26 3feq s ILE 60 N -2.20 2.59 -0.32 0.64 1.01 0.79 -0.88 121.20 122.83 3feq s ILE 60 Ca 0.65 -0.78 -0.15 0.00 0.00 0.00 0.00 60.65 60.36 3feq s ILE 60 Cb -0.14 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 3feq s ILE 60 CO 0.25 0.47 0.38 -0.62 0.00 0.00 0.00 174.94 175.42 3feq s ASP 61 N 1.36 6.22 0.00 3.58 -1.08 -0.59 -4.58 116.67 121.58 3feq s ASP 61 Ca 0.05 -0.01 0.30 0.00 -0.52 0.00 0.00 52.55 52.37 3feq s ASP 61 Cb -0.14 -2.21 1.40 0.00 -1.46 0.00 0.00 42.92 40.52 3feq s ASP 61 CO -0.09 -0.29 1.99 0.00 0.52 0.00 0.00 175.17 177.30 3feq s HIS 63 N -2.68 -0.94 0.18 0.00 5.65 -1.21 -4.52 115.29 111.77 3feq s HIS 63 Ca 0.25 -0.26 0.05 0.00 0.25 0.00 0.00 55.06 55.35 3feq s HIS 63 Cb 0.20 -0.10 -0.05 0.00 -1.18 0.00 0.00 32.58 31.45 3feq s HIS 63 CO 0.49 -1.05 -0.08 0.14 -0.65 0.00 0.00 174.74 173.58 3feq s VAL 64 N 1.74 1.20 -0.61 0.89 -7.23 -1.03 -1.03 120.40 114.34 3feq s VAL 64 Ca 0.16 -2.07 0.04 0.00 -1.81 0.00 0.00 61.98 58.30 3feq s VAL 64 Cb -0.11 -2.00 0.16 0.00 0.56 0.00 0.00 36.38 34.99 3feq s VAL 64 CO -0.08 -0.62 0.41 -1.00 -0.31 0.00 0.00 175.10 173.49 3feq s HIS 65 N -3.31 3.02 0.60 2.82 3.76 -1.26 0.17 115.29 121.10 3feq s HIS 65 Ca 0.20 -3.09 0.29 0.00 -0.15 0.00 0.00 55.06 52.31 3feq s HIS 65 Cb 0.03 -2.42 1.49 0.00 1.11 0.00 0.00 32.58 32.79 3feq s HIS 65 CO 0.03 -0.64 1.90 0.28 -0.85 0.00 0.00 174.74 175.46 3feq h VAL 66 N 4.72 0.31 -0.29 -0.90 2.07 -1.92 -0.23 116.25 120.00 3feq h VAL 66 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.62 3feq h VAL 66 Cb 0.82 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 3feq h VAL 66 CO 0.64 0.00 0.00 0.18 0.02 0.00 0.00 177.57 178.41 3feq n LEU 67 N -3.58 3.25 -4.57 2.57 4.77 -1.26 -4.63 117.00 113.55 3feq n LEU 67 Ca 0.07 -1.40 -0.43 0.00 -0.03 0.00 0.00 56.01 54.22 3feq n LEU 67 Cb 0.62 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 3feq n LEU 67 CO 0.25 0.67 1.82 0.00 -1.33 0.00 0.00 177.39 178.81 3feq s ALA 68 N -1.51 3.26 -0.90 -1.18 0.00 -0.10 -4.76 121.76 116.56 3feq s ALA 68 Ca 0.34 -2.83 0.25 0.00 0.00 0.00 0.00 51.96 49.73 3feq s ALA 68 Cb 0.21 -4.58 0.50 0.00 0.00 0.00 0.00 23.12 19.25 3feq s ALA 68 CO 0.29 -3.31 1.41 -1.13 0.00 0.00 0.00 175.76 173.02 3feq n SER 69 N 8.25 0.52 -3.89 0.00 3.41 -1.26 -0.56 113.62 120.09 3feq n SER 69 Ca 0.45 -0.12 -0.09 0.00 -0.26 0.00 0.00 58.87 58.85 3feq n SER 69 Cb 0.47 0.20 -0.08 0.00 -0.26 0.00 0.00 64.21 64.54 3feq n SER 69 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3feq s ASN 70 N -3.31 0.17 0.39 4.04 2.20 -1.26 -4.43 114.94 112.74 3feq s ASN 70 Ca 0.10 -0.68 0.17 0.00 -0.94 0.00 0.00 52.86 51.51 3feq s ASN 70 Cb 0.17 0.32 0.82 0.00 -2.00 0.00 0.00 41.25 40.55 3feq s ASN 70 CO 0.70 -0.70 1.83 0.00 -2.94 0.00 0.00 177.10 175.98 3feq h ALA 71 N 2.85 1.22 -1.42 3.54 0.00 -1.82 -3.37 119.26 120.25 3feq h ALA 71 Ca -0.34 -0.31 -0.56 0.00 0.00 0.00 0.00 54.91 53.70 3feq h ALA 71 Cb 1.19 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.84 3feq h ALA 71 CO 0.57 0.43 0.97 1.21 0.00 0.00 0.00 179.25 182.43 3feq s ASN 72 N -6.64 6.18 0.48 0.00 3.84 -1.26 -4.70 114.94 112.85 3feq s ASN 72 Ca -0.02 -0.51 0.18 0.00 0.21 0.00 0.00 52.86 52.73 3feq s ASN 72 Cb 0.13 -2.54 1.19 0.00 -0.55 0.00 0.00 41.25 39.49 3feq s ASN 72 CO 0.69 -1.75 2.06 -0.07 -2.79 0.00 0.00 177.10 175.24 3feq h LEU 73 N 12.68 0.00 -0.07 3.21 3.38 -1.85 -0.40 115.31 132.26 3feq h LEU 73 Ca -0.28 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.70 3feq h LEU 73 Cb 1.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 3feq h LEU 73 CO 1.26 0.13 0.00 1.23 0.09 0.00 0.00 178.44 181.15 3feq h GLY 74 N 0.45 0.06 2.00 0.83 0.00 -1.88 -1.86 103.07 102.67 3feq h GLY 74 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3feq h GLY 74 CO 0.02 -0.01 -0.23 -0.24 0.00 0.00 0.00 176.54 176.08 3feq h VAL 75 N 0.03 0.41 -0.78 4.60 3.04 -1.76 -2.74 116.25 119.04 3feq h VAL 75 Ca 0.03 -1.55 -0.00 0.00 -1.01 0.00 0.00 66.70 64.17 3feq h VAL 75 Cb 0.03 2.18 -0.04 0.00 -2.01 0.00 0.00 31.29 31.45 3feq h VAL 75 CO -0.05 0.23 0.48 -1.13 -1.01 0.00 0.00 177.57 176.09 3feq h ASN 76 N 0.00 0.93 0.74 3.17 -1.24 -0.89 -2.22 115.58 116.07 3feq h ASN 76 Ca -0.00 -0.05 -0.12 0.00 0.71 0.00 0.00 56.30 56.84 3feq h ASN 76 Cb 1.16 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 39.96 3feq h ASN 76 CO 0.03 0.70 -0.56 0.00 -1.29 0.00 0.00 177.43 176.32 3feq h ALA 77 N 1.46 0.94 -0.01 1.57 0.00 -1.03 -3.17 119.26 119.01 3feq h ALA 77 Ca 0.28 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3feq h ALA 77 Cb -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3feq h ALA 77 CO -0.05 0.70 -0.32 0.25 0.00 0.00 0.00 179.25 179.82 3feq n THR 78 N -3.67 0.00 -2.16 0.00 -2.24 -1.00 -4.47 114.28 100.74 3feq n THR 78 Ca -0.01 -0.20 -0.36 0.00 -2.27 0.00 0.00 64.05 61.21 3feq n THR 78 Cb 0.60 0.80 0.01 0.00 -2.10 0.00 0.00 70.33 69.64 3feq n THR 78 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3feq s GLN 79 N -2.44 3.43 0.91 -0.78 -2.07 -0.87 -4.98 119.66 112.86 3feq s GLN 79 Ca 0.23 1.79 -0.11 0.00 -1.82 0.00 0.00 55.36 55.45 3feq s GLN 79 Cb 0.19 -2.19 0.13 0.00 -1.09 0.00 0.00 33.01 30.05 3feq s GLN 79 CO 0.52 -0.83 1.05 -2.30 -1.32 0.00 0.00 175.29 172.41 3feq n PRO 80 N -0.98 -0.38 0.20 9.60 -0.02 -1.26 -4.73 135.00 137.43 3feq n PRO 80 Ca 0.10 -0.05 -0.13 0.00 -2.02 0.00 0.00 63.50 61.40 3feq n PRO 80 Cb 0.49 -2.31 -0.08 0.00 -0.02 0.00 0.00 33.50 31.58 3feq n PRO 80 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3feq h ASN 81 N -1.76 -0.45 -0.84 2.55 2.35 -1.97 -1.80 115.58 113.66 3feq h ASN 81 Ca -0.43 -0.12 0.05 0.00 -0.55 0.00 0.00 56.30 55.24 3feq h ASN 81 Cb 1.27 0.12 -0.05 0.00 0.05 0.00 0.00 38.32 39.71 3feq h ASN 81 CO 0.41 -0.08 0.55 -0.29 -1.65 0.00 0.00 177.43 176.37 3feq h ILE 82 N -0.88 1.08 -0.25 2.81 -0.00 -2.00 -0.96 117.51 117.31 3feq h ILE 82 Ca -0.05 -0.33 -0.07 0.00 -0.00 0.00 0.00 64.86 64.40 3feq h ILE 82 Cb 0.55 0.03 -0.01 0.00 -0.00 0.00 0.00 36.82 37.38 3feq h ILE 82 CO 0.09 0.18 -0.15 -0.07 -0.00 0.00 0.00 178.15 178.20 3feq h LEU 83 N 0.97 0.41 -0.64 2.19 3.38 -1.90 -1.02 115.31 118.70 3feq h LEU 83 Ca 0.35 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 3feq h LEU 83 Cb 0.15 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3feq h LEU 83 CO -0.12 0.58 0.04 0.00 0.09 0.00 0.00 178.44 179.03 3feq h ALA 84 N 1.46 0.85 0.73 1.53 0.00 -0.29 -2.43 119.26 121.11 3feq h ALA 84 Ca 0.07 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 3feq h ALA 84 Cb 0.49 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.05 3feq h ALA 84 CO 0.03 0.67 -0.35 0.00 0.00 0.00 0.00 179.25 179.60 3feq h ALA 85 N 1.01 -1.09 -0.79 0.00 0.00 -1.07 -3.19 119.26 114.12 3feq h ALA 85 Ca 0.18 -0.22 0.15 0.00 0.00 0.00 0.00 54.91 55.03 3feq h ALA 85 Cb 0.53 0.38 -0.15 0.00 0.00 0.00 0.00 17.79 18.55 3feq h ALA 85 CO 0.03 -1.02 -0.26 0.82 0.00 0.00 0.00 179.25 178.81 3feq h ILE 86 N -1.14 0.15 0.00 0.00 1.08 -1.24 0.14 117.51 116.51 3feq h ILE 86 Ca -0.10 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 3feq h ILE 86 Cb 0.76 0.15 0.00 0.00 -3.07 0.00 0.00 36.82 34.66 3feq h ILE 86 CO 0.17 0.00 0.00 0.54 -0.69 0.00 0.00 178.15 178.17 3feq n ARG 87 N -5.50 0.05 0.17 2.37 1.74 -0.92 -1.42 116.66 113.16 3feq n ARG 87 Ca 0.10 0.33 0.09 0.00 -0.77 0.00 0.00 57.85 57.60 3feq n ARG 87 Cb 0.40 -1.61 0.10 0.00 -1.02 0.00 0.00 32.46 30.33 3feq n ARG 87 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3feq h SER 88 N 0.00 0.00 -0.10 0.55 4.64 -0.95 -3.38 113.55 114.31 3feq h SER 88 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3feq h SER 88 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 3feq h SER 88 CO 0.00 0.15 0.07 -0.07 -0.87 0.00 0.00 176.83 176.10 3feq h LEU 89 N 0.00 0.12 -0.83 5.97 3.38 -1.29 -1.47 115.31 121.19 3feq h LEU 89 Ca -0.01 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.02 3feq h LEU 89 Cb 1.12 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.78 3feq h LEU 89 CO 0.02 0.09 0.51 -0.65 0.09 0.00 0.00 178.44 178.49 3feq h PRO 90 N 0.14 0.89 -0.22 1.13 0.11 -1.77 -1.30 132.00 130.98 3feq h PRO 90 Ca 0.04 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.15 3feq h PRO 90 Cb -0.02 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 30.84 3feq h PRO 90 CO -0.01 0.59 -0.12 0.82 -0.21 0.00 0.00 178.00 179.07 3feq h ILE 91 N 0.92 0.63 -0.53 4.15 2.04 -1.64 0.19 117.51 123.26 3feq h ILE 91 Ca 0.37 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.18 3feq h ILE 91 Cb 0.19 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 3feq h ILE 91 CO -0.18 0.00 0.17 -0.07 0.00 0.00 0.00 178.15 178.07 3feq h LEU 92 N -0.11 0.77 -0.56 1.44 3.38 -1.03 -2.16 115.31 117.04 3feq h LEU 92 Ca 0.12 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 3feq h LEU 92 Cb 0.29 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3feq h LEU 92 CO -0.28 0.77 0.03 -0.78 0.09 0.00 0.00 178.44 178.27 3feq h ASP 93 N 0.73 0.95 -0.15 -0.43 3.58 -0.87 -2.27 116.42 117.97 3feq h ASP 93 Ca 0.17 -0.29 -0.07 0.00 0.42 0.00 0.00 57.03 57.25 3feq h ASP 93 Cb 0.28 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 3feq h ASP 93 CO -0.01 1.00 -0.13 0.00 -2.88 0.00 0.00 179.24 177.23 3feq h ALA 94 N 0.97 1.22 -0.21 -0.78 0.00 -0.53 -2.62 119.26 117.31 3feq h ALA 94 Ca 0.16 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3feq h ALA 94 Cb 0.50 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3feq h ALA 94 CO 0.02 0.50 0.05 0.52 0.00 0.00 0.00 179.25 180.34 3feq h MET 95 N 0.47 0.35 -0.68 0.00 2.86 -1.07 -2.46 114.93 114.40 3feq h MET 95 Ca 0.09 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 3feq h MET 95 Cb 0.51 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 3feq h MET 95 CO 0.03 0.47 0.45 1.25 1.06 0.00 0.00 176.91 180.17 3feq h LEU 96 N 0.16 0.77 -1.91 1.22 5.85 -1.24 -0.86 115.31 119.31 3feq h LEU 96 Ca 0.07 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3feq h LEU 96 Cb 0.29 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 3feq h LEU 96 CO 0.00 0.56 -0.01 0.77 -0.34 0.00 0.00 178.44 179.42 3feq h SER 97 N 0.92 0.00 -0.08 1.25 4.64 -1.40 0.20 113.55 119.07 3feq h SER 97 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3feq h SER 97 Cb -0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 3feq h SER 97 CO -0.06 0.01 0.00 0.54 -0.87 0.00 0.00 176.83 176.46 3feq n ARG 98 N -3.13 1.40 -0.37 4.77 1.74 -0.35 -4.63 116.66 116.09 3feq n ARG 98 Ca -0.01 -0.60 0.00 0.00 -0.77 0.00 0.00 57.85 56.47 3feq n ARG 98 Cb 0.24 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 3feq n ARG 98 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3feq n GLY 99 N 0.99 0.77 3.57 -0.13 0.00 0.71 -4.76 105.19 106.34 3feq n GLY 99 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 3feq n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3feq s PHE 100 N -2.27 2.95 -0.25 1.61 0.08 -1.07 -1.63 117.98 117.41 3feq s PHE 100 Ca 0.00 0.48 0.22 0.00 0.12 0.00 0.00 56.93 57.75 3feq s PHE 100 Cb 0.00 -3.92 -0.20 0.00 -0.57 0.00 0.00 43.02 38.33 3feq s PHE 100 CO 0.00 -1.05 0.72 0.25 -0.10 0.00 0.00 175.22 175.04 3feq n THR 101 N 6.34 0.16 -4.07 0.64 -2.24 -0.06 -4.06 114.28 111.00 3feq n THR 101 Ca 0.07 -0.43 -0.14 0.00 -2.27 0.00 0.00 64.05 61.27 3feq n THR 101 Cb 0.48 0.05 -0.14 0.00 -2.10 0.00 0.00 70.33 68.62 3feq n THR 101 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3feq s SER 102 N -4.47 0.44 0.00 3.42 0.01 -1.11 -0.96 113.70 111.04 3feq s SER 102 Ca -0.03 -0.11 0.04 0.00 1.31 0.00 0.00 55.95 57.16 3feq s SER 102 Cb 0.13 -0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.31 3feq s SER 102 CO 0.86 0.02 -0.14 0.68 0.41 0.00 0.00 173.24 175.08 3feq s VAL 103 N -0.21 1.07 -0.49 3.43 -7.23 0.58 -1.54 120.40 116.01 3feq s VAL 103 Ca 0.00 -0.67 -0.18 0.00 -1.81 0.00 0.00 61.98 59.32 3feq s VAL 103 Cb -0.02 -0.91 0.06 0.00 0.56 0.00 0.00 36.38 36.06 3feq s VAL 103 CO -0.00 0.23 0.55 -0.60 -0.31 0.00 0.00 175.10 174.97 3feq s ARG 104 N -0.51 3.09 -0.02 4.82 3.52 0.28 -0.62 118.95 129.52 3feq s ARG 104 Ca 0.04 -0.96 -0.30 0.00 -0.13 0.00 0.00 55.73 54.39 3feq s ARG 104 Cb -0.06 -4.08 -0.03 0.00 -1.56 0.00 0.00 34.95 29.22 3feq s ARG 104 CO -0.00 -1.13 1.04 0.34 -0.81 0.00 0.00 175.30 174.74 3feq s ASP 105 N 2.54 7.27 -0.60 -2.12 -1.08 -0.55 -2.45 116.67 119.67 3feq s ASP 105 Ca 0.12 1.69 -0.02 0.00 -0.52 0.00 0.00 52.55 53.83 3feq s ASP 105 Cb -0.20 -2.57 0.41 0.00 -1.46 0.00 0.00 42.92 39.10 3feq s ASP 105 CO 0.11 -0.37 2.03 0.00 0.52 0.00 0.00 175.17 177.47 3feq n ALA 106 N 4.32 6.10 0.00 3.66 0.00 0.13 -2.70 120.51 132.02 3feq n ALA 106 Ca 0.08 -3.13 0.00 0.00 0.00 0.00 0.00 53.44 50.39 3feq n ALA 106 Cb 0.49 -1.70 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3feq n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3feq n GLY 107 N -0.69 2.27 0.00 0.00 0.00 -1.26 -4.71 105.19 100.80 3feq n GLY 107 Ca 0.57 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 45.51 3feq n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3feq n GLY 108 N 1.33 2.05 3.77 -0.02 0.00 -0.07 -4.70 105.19 107.54 3feq n GLY 108 Ca 0.00 -0.48 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 3feq n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq s ALA 109 N -0.25 2.63 0.28 4.61 0.00 -1.26 -4.84 121.76 122.94 3feq s ALA 109 Ca 0.00 0.89 0.02 0.00 0.00 0.00 0.00 51.96 52.87 3feq s ALA 109 Cb 0.00 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.72 3feq s ALA 109 CO 0.00 -0.93 0.08 -0.40 0.00 0.00 0.00 175.76 174.51 3feq n ASP 110 N -1.43 1.41 0.13 0.00 5.75 -1.26 -2.51 116.55 118.64 3feq n ASP 110 Ca 0.12 -2.43 0.05 0.00 -0.01 0.00 0.00 54.79 52.52 3feq n ASP 110 Cb 0.50 0.61 0.48 0.00 -1.03 0.00 0.00 41.12 41.68 3feq n ASP 110 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3feq h TRP 111 N 1.40 0.24 -0.44 2.11 7.01 -1.84 -2.37 115.95 122.06 3feq h TRP 111 Ca -0.22 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 60.73 3feq h TRP 111 Cb 0.80 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.77 3feq h TRP 111 CO 0.00 0.23 0.10 0.77 -2.79 0.00 0.00 178.44 176.76 3feq h SER 112 N 0.24 0.66 -0.13 2.65 0.02 -1.96 -1.22 113.55 113.80 3feq h SER 112 Ca 0.06 -0.24 -0.08 0.00 -0.84 0.00 0.00 61.79 60.69 3feq h SER 112 Cb 0.13 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3feq h SER 112 CO -0.00 0.73 -0.16 -0.07 -1.14 0.00 0.00 176.83 176.18 3feq h LEU 113 N 0.57 0.51 -0.33 5.07 3.38 -1.87 -1.34 115.31 121.31 3feq h LEU 113 Ca 0.14 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.97 3feq h LEU 113 Cb 0.33 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3feq h LEU 113 CO 0.00 0.70 0.19 -0.03 0.09 0.00 0.00 178.44 179.39 3feq h MET 114 N 0.48 0.39 -0.69 1.13 4.05 -1.25 -2.91 114.93 116.12 3feq h MET 114 Ca 0.08 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.46 3feq h MET 114 Cb 0.56 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.24 3feq h MET 114 CO 0.04 0.25 0.37 1.96 0.23 0.00 0.00 176.91 179.77 3feq h GLN 115 N 0.40 0.96 -0.48 0.39 1.08 -0.86 -2.55 115.11 114.05 3feq h GLN 115 Ca 0.13 -0.11 0.05 0.00 -1.45 0.00 0.00 58.65 57.27 3feq h GLN 115 Cb -0.00 -0.19 -0.05 0.00 -0.05 0.00 0.00 27.48 27.19 3feq h GLN 115 CO -0.06 0.72 0.20 0.00 -0.95 0.00 0.00 178.83 178.74 3feq h ALA 116 N 1.19 0.59 -0.41 3.87 0.00 -1.07 0.26 119.26 123.68 3feq h ALA 116 Ca 0.24 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 3feq h ALA 116 Cb 0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3feq h ALA 116 CO -0.04 -0.18 -0.26 -0.39 0.00 0.00 0.00 179.25 178.38 3feq h VAL 117 N 0.39 1.27 -0.00 0.00 -1.51 -1.43 0.21 116.25 115.17 3feq h VAL 117 Ca 0.22 -1.41 -0.13 0.00 -1.23 0.00 0.00 66.70 64.15 3feq h VAL 117 Cb 0.19 1.23 -0.02 0.00 -2.13 0.00 0.00 31.29 30.57 3feq h VAL 117 CO -0.20 0.48 -0.62 -0.33 -1.23 0.00 0.00 177.57 175.67 3feq h GLU 118 N 0.74 0.01 -0.12 5.19 5.08 -0.95 -1.20 114.58 123.34 3feq h GLU 118 Ca 0.09 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3feq h GLU 118 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 3feq h GLU 118 CO 0.07 0.63 0.00 0.25 -1.00 0.00 0.00 179.01 178.96 3feq n THR 119 N -3.81 0.14 -0.94 1.13 -2.24 0.84 -4.93 114.28 104.49 3feq n THR 119 Ca -0.01 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 3feq n THR 119 Cb 0.62 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 3feq n THR 119 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3feq n GLY 120 N 1.13 0.44 0.10 3.38 0.00 -0.46 -4.86 105.19 104.92 3feq n GLY 120 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 3feq n GLY 120 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3feq n LEU 121 N 0.00 0.35 -3.62 0.99 7.94 0.67 -4.69 117.00 118.64 3feq n LEU 121 Ca 0.00 0.66 -0.15 0.00 -1.11 0.00 0.00 56.01 55.40 3feq n LEU 121 Cb 0.11 -0.69 -0.07 0.00 0.53 0.00 0.00 43.42 43.30 3feq n LEU 121 CO 0.00 -0.75 0.32 -0.69 -1.11 0.00 0.00 177.39 175.16 3feq s VAL 122 N -3.33 0.01 -0.26 1.96 1.01 -0.88 -4.95 120.40 113.96 3feq s VAL 122 Ca -0.01 -0.07 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 3feq s VAL 122 Cb 0.04 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 3feq s VAL 122 CO 0.14 -0.04 0.41 -0.55 0.00 0.00 0.00 175.10 175.06 3feq s SER 123 N -0.56 6.32 0.00 3.32 0.15 -1.26 -4.16 113.70 117.51 3feq s SER 123 Ca -0.07 0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.96 3feq s SER 123 Cb -0.03 -2.23 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 3feq s SER 123 CO 0.05 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 174.91 3feq n GLY 124 N 4.51 -1.41 3.74 9.45 0.00 -1.26 -3.24 105.19 116.98 3feq n GLY 124 Ca -0.07 -0.99 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 3feq n GLY 124 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3feq s PRO 125 N -1.12 1.95 0.26 1.61 0.02 -1.26 -4.95 135.00 131.50 3feq s PRO 125 Ca 0.00 1.30 -0.31 0.00 0.02 0.00 0.00 61.00 62.01 3feq s PRO 125 Cb 0.00 -1.85 -0.12 0.00 0.02 0.00 0.00 34.50 32.55 3feq s PRO 125 CO 0.00 -1.89 1.66 -2.13 -0.33 0.00 0.00 177.00 174.31 3feq n ARG 126 N -3.63 2.76 -4.04 5.54 0.63 -0.13 -4.80 116.66 112.98 3feq n ARG 126 Ca 0.10 0.99 -0.35 0.00 -0.92 0.00 0.00 57.85 57.67 3feq n ARG 126 Cb 0.53 -2.80 -0.11 0.00 0.45 0.00 0.00 32.46 30.53 3feq n ARG 126 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3feq s ILE 127 N 0.50 4.52 -0.61 5.15 1.01 -1.26 -0.31 121.20 130.20 3feq s ILE 127 Ca 0.69 -0.12 -0.16 0.00 0.00 0.00 0.00 60.65 61.05 3feq s ILE 127 Cb -0.49 -3.04 0.15 0.00 0.01 0.00 0.00 42.46 39.08 3feq s ILE 127 CO 0.42 0.44 0.58 -0.36 0.00 0.00 0.00 174.94 176.02 3feq s PHE 128 N 0.61 3.33 0.14 3.97 0.40 0.21 -4.83 117.98 121.80 3feq s PHE 128 Ca 0.02 -1.40 -0.27 0.00 -0.60 0.00 0.00 56.93 54.68 3feq s PHE 128 Cb -0.13 -3.83 -0.07 0.00 0.51 0.00 0.00 43.02 39.49 3feq s PHE 128 CO 0.02 -1.05 0.85 -1.25 0.70 0.00 0.00 175.22 174.49 3feq s PRO 129 N 1.43 4.64 0.24 0.24 0.04 -1.26 -1.49 135.00 138.84 3feq s PRO 129 Ca 0.07 1.27 0.24 0.00 0.04 0.00 0.00 61.00 62.62 3feq s PRO 129 Cb -0.25 -3.31 0.35 0.00 0.04 0.00 0.00 34.50 31.33 3feq s PRO 129 CO 0.01 0.42 1.42 0.77 0.04 0.00 0.00 177.00 179.66 3feq h SER 130 N 4.85 0.00 0.00 6.66 0.02 -1.66 0.93 113.55 124.35 3feq h SER 130 Ca -0.45 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 3feq h SER 130 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 3feq h SER 130 CO 0.69 0.03 0.00 0.61 -1.14 0.00 0.00 176.83 177.02 3feq n GLY 131 N 1.23 1.74 3.16 -3.77 0.00 -1.04 -4.65 105.19 101.86 3feq n GLY 131 Ca 0.03 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 3feq n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3feq s LYS 132 N 0.00 2.24 0.33 1.61 1.02 -1.26 -0.90 119.74 122.77 3feq s LYS 132 Ca 0.00 -0.70 -0.29 0.00 0.02 0.00 0.00 55.97 55.00 3feq s LYS 132 Cb 0.00 -1.83 -0.12 0.00 -0.52 0.00 0.00 37.83 35.36 3feq s LYS 132 CO 0.00 0.22 1.44 0.00 -0.92 0.00 0.00 175.35 176.09 3feq n ALA 133 N 3.32 1.89 -2.68 5.17 0.00 -0.46 -4.66 120.51 123.10 3feq n ALA 133 Ca -0.19 0.37 -0.40 0.00 0.00 0.00 0.00 53.44 53.21 3feq n ALA 133 Cb 0.53 -2.36 -0.05 0.00 0.00 0.00 0.00 19.45 17.57 3feq n ALA 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3feq s LEU 134 N -1.03 4.19 0.01 0.00 1.43 0.01 -0.01 118.68 123.28 3feq s LEU 134 Ca 0.59 0.97 0.04 0.00 -1.03 0.00 0.00 54.13 54.69 3feq s LEU 134 Cb -0.54 -2.99 -0.01 0.00 0.03 0.00 0.00 46.19 42.68 3feq s LEU 134 CO 0.58 -0.26 -0.12 -0.55 0.23 0.00 0.00 176.35 176.23 3feq s SER 135 N 1.09 1.38 0.94 2.29 0.15 -0.62 -1.03 113.70 117.89 3feq s SER 135 Ca 0.32 -0.28 -0.12 0.00 0.70 0.00 0.00 55.95 56.57 3feq s SER 135 Cb -0.16 -0.13 0.16 0.00 -1.71 0.00 0.00 66.02 64.17 3feq s SER 135 CO 0.12 0.10 1.11 0.00 1.20 0.00 0.00 173.24 175.77 3feq s GLN 136 N -0.53 0.88 0.20 5.44 -2.07 -1.26 -1.10 119.66 121.21 3feq s GLN 136 Ca 0.03 0.50 -0.31 0.00 -1.82 0.00 0.00 55.36 53.76 3feq s GLN 136 Cb -0.05 -1.79 -0.10 0.00 -1.09 0.00 0.00 33.01 29.98 3feq s GLN 136 CO 0.00 -2.42 1.50 0.99 -1.32 0.00 0.00 175.29 174.04 3feq s THR 137 N -3.07 2.69 -0.35 3.63 2.01 -1.26 -1.31 115.64 117.98 3feq s THR 137 Ca 0.64 0.53 0.00 0.00 0.31 0.00 0.00 61.69 63.17 3feq s THR 137 Cb -0.17 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.00 3feq s THR 137 CO 0.56 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 175.16 3feq n GLY 138 N 3.07 0.56 1.97 4.40 0.00 -1.26 -5.00 105.19 108.92 3feq n GLY 138 Ca 0.11 -0.20 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 3feq n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3feq n GLY 139 N -1.35 -0.22 0.22 -0.02 0.00 -0.43 -4.34 105.19 99.05 3feq n GLY 139 Ca -0.03 -1.86 0.14 0.00 0.00 0.00 0.00 46.02 44.28 3feq n GLY 139 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3feq h HIS 140 N -0.90 0.00 -0.01 1.61 2.76 -1.83 -0.69 115.15 116.08 3feq h HIS 140 Ca -0.19 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.98 3feq h HIS 140 Cb 0.61 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.57 3feq h HIS 140 CO 0.00 0.00 -0.02 0.41 -1.30 0.00 0.00 177.93 177.02 3feq n GLY 141 N -1.23 -0.22 3.54 5.26 0.00 -1.26 -4.52 105.19 106.76 3feq n GLY 141 Ca -0.02 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 3feq n GLY 141 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3feq s ASP 142 N -1.06 6.36 -0.15 1.61 -1.08 -0.27 -4.68 116.67 117.40 3feq s ASP 142 Ca 0.14 -0.15 0.17 0.00 -0.52 0.00 0.00 52.55 52.19 3feq s ASP 142 Cb 0.10 -2.32 0.76 0.00 -1.46 0.00 0.00 42.92 40.00 3feq s ASP 142 CO 0.17 -0.70 1.68 0.49 0.52 0.00 0.00 175.17 177.33 3feq n PHE 143 N 6.16 1.69 -2.70 -5.34 3.72 -1.26 -4.48 117.46 115.25 3feq n PHE 143 Ca -0.02 -0.64 -0.41 0.00 -0.05 0.00 0.00 57.45 56.33 3feq n PHE 143 Cb 0.48 -0.32 -0.04 0.00 -0.94 0.00 0.00 39.48 38.66 3feq n PHE 143 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3feq s ARG 144 N -2.11 4.65 0.70 -1.08 0.52 -1.26 -4.88 118.95 115.48 3feq s ARG 144 Ca 0.53 1.48 -0.15 0.00 -0.52 0.00 0.00 55.73 57.06 3feq s ARG 144 Cb 0.36 -3.39 0.02 0.00 0.52 0.00 0.00 34.95 32.47 3feq s ARG 144 CO 0.23 0.12 1.18 -1.25 0.02 0.00 0.00 175.30 175.60 3feq s PRO 145 N 0.25 2.36 0.00 3.54 0.04 -1.26 -4.77 135.00 135.16 3feq s PRO 145 Ca 0.49 1.67 -0.00 0.00 0.04 0.00 0.00 61.00 63.19 3feq s PRO 145 Cb -0.23 -1.87 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 3feq s PRO 145 CO 0.30 -1.64 0.50 -2.13 0.04 0.00 0.00 177.00 174.07 3feq n ARG 146 N -2.56 0.00 0.00 4.56 0.63 -1.26 -5.10 116.66 112.92 3feq n ARG 146 Ca 0.13 -0.25 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 3feq n ARG 146 Cb 0.51 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.92 3feq n ARG 146 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3feq n SER 154 N 3.78 0.00 0.00 6.15 3.41 -1.26 -5.22 113.62 120.48 3feq n SER 154 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3feq n SER 154 Cb 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3feq n SER 154 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3feq s PHE 157 N -0.72 2.94 0.22 0.00 2.99 -1.26 -5.01 117.98 117.14 3feq s PHE 157 Ca -0.08 0.26 -0.30 0.00 0.00 0.00 0.00 56.93 56.80 3feq s PHE 157 Cb -0.05 -3.86 -0.09 0.00 0.00 0.00 0.00 43.02 39.02 3feq s PHE 157 CO 0.01 -1.08 1.37 1.03 -0.00 0.00 0.00 175.22 176.55 3feq s ARG 158 N 3.59 4.33 0.00 0.44 1.81 -1.26 -4.92 118.95 122.94 3feq s ARG 158 Ca 0.34 2.17 0.21 0.00 -1.72 0.00 0.00 55.73 56.72 3feq s ARG 158 Cb -0.11 -3.16 1.07 0.00 -0.45 0.00 0.00 34.95 32.30 3feq s ARG 158 CO 0.24 -0.34 1.67 0.25 -0.68 0.00 0.00 175.30 176.45 3feq n THR 159 N 2.56 0.34 0.22 0.02 -2.24 -1.26 -1.91 114.28 112.01 3feq n THR 159 Ca 0.07 0.08 0.12 0.00 -2.27 0.00 0.00 64.05 62.05 3feq n THR 159 Cb 0.42 -0.74 0.23 0.00 -2.10 0.00 0.00 70.33 68.13 3feq n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3feq n GLY 160 N 0.49 1.83 3.75 3.38 0.00 -1.26 -4.87 105.19 108.51 3feq n GLY 160 Ca 0.10 -0.74 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 3feq n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq s ALA 161 N -1.42 3.50 -0.02 4.61 0.00 -0.80 -3.31 121.76 124.32 3feq s ALA 161 Ca 0.40 -0.12 -0.17 0.00 0.00 0.00 0.00 51.96 52.07 3feq s ALA 161 Cb 0.23 -2.65 -0.33 0.00 0.00 0.00 0.00 23.12 20.37 3feq s ALA 161 CO 0.32 0.10 0.86 0.82 0.00 0.00 0.00 175.76 177.86 3feq h ILE 162 N 4.43 1.29 -0.77 0.00 1.08 -1.89 -3.37 117.51 118.27 3feq h ILE 162 Ca -0.44 -2.58 -0.64 0.00 -0.39 0.00 0.00 64.86 60.82 3feq h ILE 162 Cb 1.19 3.02 -0.11 0.00 -3.07 0.00 0.00 36.82 37.86 3feq h ILE 162 CO 0.72 0.77 -0.48 0.00 -0.69 0.00 0.00 178.15 178.47 3feq s ALA 163 N -2.52 3.96 0.01 1.87 0.00 -1.26 -1.35 121.76 122.47 3feq s ALA 163 Ca -0.13 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 50.77 3feq s ALA 163 Cb 0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 3feq s ALA 163 CO 0.87 -0.14 -0.07 -0.98 0.00 0.00 0.00 175.76 175.44 3feq s ARG 164 N -3.94 0.52 -0.18 0.00 1.70 0.99 -4.77 118.95 113.28 3feq s ARG 164 Ca 0.21 -0.38 -0.22 0.00 -0.47 0.00 0.00 55.73 54.86 3feq s ARG 164 Cb 0.02 -0.45 -0.02 0.00 -0.57 0.00 0.00 34.95 33.93 3feq s ARG 164 CO 0.12 0.12 0.69 0.08 -1.08 0.00 0.00 175.30 175.22 3feq s VAL 165 N -0.49 4.98 -0.13 4.99 1.01 -1.26 -1.60 120.40 127.90 3feq s VAL 165 Ca -0.01 1.33 -0.08 0.00 0.00 0.00 0.00 61.98 63.23 3feq s VAL 165 Cb -0.05 -4.01 0.05 0.00 0.00 0.00 0.00 36.38 32.38 3feq s VAL 165 CO 0.00 0.10 0.33 0.68 0.00 0.00 0.00 175.10 176.20 3feq s VAL 166 N 1.90 -0.03 0.13 2.92 -7.23 -0.26 -4.96 120.40 112.87 3feq s VAL 166 Ca 0.32 0.11 0.09 0.00 -1.81 0.00 0.00 61.98 60.68 3feq s VAL 166 Cb -0.16 -0.49 -0.04 0.00 0.56 0.00 0.00 36.38 36.25 3feq s VAL 166 CO 0.11 0.04 -0.20 -1.81 -0.31 0.00 0.00 175.10 172.93 3feq s ASP 167 N 1.18 2.67 0.00 4.85 1.01 -1.26 -4.02 116.67 121.10 3feq s ASP 167 Ca -0.08 -0.76 0.00 0.00 0.71 0.00 0.00 52.55 52.42 3feq s ASP 167 Cb -0.09 -0.16 0.00 0.00 1.01 0.00 0.00 42.92 43.69 3feq s ASP 167 CO -0.09 0.03 0.00 0.61 0.21 0.00 0.00 175.17 175.93 3feq n GLY 168 N 0.75 2.42 0.13 0.21 0.00 -1.26 -4.23 105.19 103.22 3feq n GLY 168 Ca -0.17 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.00 3feq n GLY 168 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3feq h VAL 169 N 0.00 1.14 -0.01 1.61 2.07 -1.94 0.19 116.25 119.31 3feq h VAL 169 Ca 0.00 -0.39 -0.13 0.00 0.82 0.00 0.00 66.70 67.00 3feq h VAL 169 Cb 0.00 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 3feq h VAL 169 CO 0.00 0.14 -0.59 -0.33 0.02 0.00 0.00 177.57 176.80 3feq h GLU 170 N 0.26 0.03 -0.12 1.57 4.39 -1.99 -1.84 114.58 116.88 3feq h GLU 170 Ca 0.08 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 3feq h GLU 170 Cb 0.11 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3feq h GLU 170 CO -0.01 0.62 0.07 0.78 -1.16 0.00 0.00 179.01 179.30 3feq h GLY 171 N 1.74 0.18 1.74 -3.84 0.00 -1.54 -0.82 103.07 100.53 3feq h GLY 171 Ca -0.01 -0.08 -0.25 0.00 0.00 0.00 0.00 47.33 47.00 3feq h GLY 171 CO 0.08 0.07 -1.17 -0.39 0.00 0.00 0.00 176.54 175.13 3feq h VAL 172 N 0.11 1.55 0.05 4.60 -1.51 -0.85 -0.06 116.25 120.14 3feq h VAL 172 Ca 0.04 -3.19 0.03 0.00 -1.23 0.00 0.00 66.70 62.35 3feq h VAL 172 Cb 0.05 2.89 -0.04 0.00 -2.13 0.00 0.00 31.29 32.06 3feq h VAL 172 CO -0.01 0.92 -0.28 0.03 -1.23 0.00 0.00 177.57 177.00 3feq h ARG 173 N 0.04 -0.43 -0.06 5.19 3.08 -1.31 -0.28 114.38 120.60 3feq h ARG 173 Ca -0.09 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.02 3feq h ARG 173 Cb 1.90 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 31.99 3feq h ARG 173 CO 0.17 -0.29 -0.27 1.25 -1.07 0.00 0.00 179.97 179.76 3feq h LEU 174 N -0.45 -0.82 -0.69 3.04 5.85 -0.99 -2.40 115.31 118.85 3feq h LEU 174 Ca 0.05 0.12 0.13 0.00 0.84 0.00 0.00 57.88 59.02 3feq h LEU 174 Cb 0.51 0.35 -0.09 0.00 0.37 0.00 0.00 40.66 41.80 3feq h LEU 174 CO -0.21 -0.33 0.23 0.00 -0.34 0.00 0.00 178.44 177.80 3feq h ALA 175 N 0.47 0.92 0.13 1.25 0.00 -0.72 -0.14 119.26 121.16 3feq h ALA 175 Ca 0.08 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3feq h ALA 175 Cb 0.50 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3feq h ALA 175 CO -0.28 -0.24 -0.06 0.28 0.00 0.00 0.00 179.25 178.94 3feq h VAL 176 N 0.37 0.93 -0.56 0.00 2.07 -0.93 -0.53 116.25 117.61 3feq h VAL 176 Ca 0.37 -0.22 0.10 0.00 0.82 0.00 0.00 66.70 67.77 3feq h VAL 176 Cb 0.56 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 3feq h VAL 176 CO -0.40 0.05 0.38 0.03 0.02 0.00 0.00 177.57 177.66 3feq h ARG 177 N -0.27 0.31 -0.18 1.57 3.08 -0.88 -0.08 114.38 117.94 3feq h ARG 177 Ca -0.02 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 3feq h ARG 177 Cb 0.22 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 3feq h ARG 177 CO 0.03 0.21 -0.18 0.93 -1.07 0.00 0.00 179.97 179.89 3feq h GLU 178 N 0.32 0.43 -0.18 0.04 5.08 -0.62 -1.60 114.58 118.05 3feq h GLU 178 Ca 0.26 -0.23 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 3feq h GLU 178 Cb 0.61 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3feq h GLU 178 CO -0.06 0.79 -0.29 0.93 -1.00 0.00 0.00 179.01 179.38 3feq h GLU 179 N 0.08 0.36 0.04 2.33 4.39 0.23 -0.90 114.58 121.11 3feq h GLU 179 Ca 0.03 -0.14 -0.24 0.00 0.34 0.00 0.00 59.36 59.35 3feq h GLU 179 Cb 0.71 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 3feq h GLU 179 CO 0.04 0.62 -1.03 0.82 -1.16 0.00 0.00 179.01 178.30 3feq h ILE 180 N 0.31 1.44 -0.69 3.13 2.04 -1.06 -1.40 117.51 121.29 3feq h ILE 180 Ca 0.04 -2.66 -0.03 0.00 1.00 0.00 0.00 64.86 63.22 3feq h ILE 180 Cb 0.68 2.59 -0.03 0.00 -0.74 0.00 0.00 36.82 39.32 3feq h ILE 180 CO 0.05 0.79 0.31 -0.61 0.00 0.00 0.00 178.15 178.69 3feq h GLN 181 N 0.17 1.01 0.00 2.37 -0.00 -1.03 -0.42 115.11 117.20 3feq h GLN 181 Ca -0.09 -0.16 0.00 0.00 -0.00 0.00 0.00 58.65 58.39 3feq h GLN 181 Cb 1.70 -0.17 0.00 0.00 0.00 0.00 0.00 27.48 29.00 3feq h GLN 181 CO 0.17 0.81 0.00 1.63 0.00 0.00 0.00 178.83 181.44 3feq n LYS 182 N -4.42 0.44 -0.07 1.69 5.02 -0.37 -4.86 118.16 115.58 3feq n LYS 182 Ca 0.05 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 3feq n LYS 182 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 3feq n LYS 182 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3feq n GLY 183 N 0.22 1.06 3.75 0.72 0.00 -0.17 -4.24 105.19 106.54 3feq n GLY 183 Ca 0.12 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3feq n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq n ALA 184 N -1.72 1.90 0.07 4.61 0.00 -0.60 -4.68 120.51 120.09 3feq n ALA 184 Ca 0.00 0.23 0.02 0.00 0.00 0.00 0.00 53.44 53.69 3feq n ALA 184 Cb 0.00 -2.38 -0.05 0.00 0.00 0.00 0.00 19.45 17.03 3feq n ALA 184 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3feq h THR 185 N 2.14 0.51 -3.42 0.00 1.35 -1.13 -3.45 112.91 108.91 3feq h THR 185 Ca -0.51 -1.91 -0.01 0.00 -0.55 0.00 0.00 66.41 63.43 3feq h THR 185 Cb 1.28 2.05 -0.07 0.00 -1.73 0.00 0.00 68.15 69.68 3feq h THR 185 CO 0.60 0.29 0.01 0.00 -0.25 0.00 0.00 175.52 176.17 3feq s GLN 186 N -2.99 1.65 -0.17 4.72 0.00 -1.23 -4.64 119.66 117.01 3feq s GLN 186 Ca -0.01 -1.17 -0.03 0.00 -0.00 0.00 0.00 55.36 54.15 3feq s GLN 186 Cb 0.08 0.52 -0.02 0.00 0.00 0.00 0.00 33.01 33.60 3feq s GLN 186 CO 0.79 -0.71 -0.05 0.42 0.00 0.00 0.00 175.29 175.74 3feq s ILE 187 N -3.94 3.65 -0.19 3.63 -1.09 -0.80 -4.27 121.20 118.20 3feq s ILE 187 Ca 0.18 -0.43 -0.07 0.00 -2.23 0.00 0.00 60.65 58.10 3feq s ILE 187 Cb -0.03 -2.61 -0.04 0.00 -1.58 0.00 0.00 42.46 38.21 3feq s ILE 187 CO 0.09 0.48 0.06 -0.75 -1.23 0.00 0.00 174.94 173.58 3feq s LYS 188 N 0.64 3.94 0.09 2.79 2.47 -1.26 0.48 119.74 128.89 3feq s LYS 188 Ca -0.03 -0.36 0.05 0.00 -1.56 0.00 0.00 55.97 54.07 3feq s LYS 188 Cb -0.15 -3.22 -0.03 0.00 -1.46 0.00 0.00 37.83 32.98 3feq s LYS 188 CO 0.02 0.23 -0.13 0.96 0.16 0.00 0.00 175.35 176.59 3feq s ILE 189 N 0.47 1.15 -0.36 5.43 -4.36 -0.64 -0.81 121.20 122.08 3feq s ILE 189 Ca 0.03 -1.48 -0.17 0.00 -0.26 0.00 0.00 60.65 58.77 3feq s ILE 189 Cb -0.13 -1.25 -0.00 0.00 1.25 0.00 0.00 42.46 42.33 3feq s ILE 189 CO 0.01 -0.34 0.43 -0.04 0.24 0.00 0.00 174.94 175.24 3feq s MET 190 N -2.18 3.49 0.00 0.37 -1.94 -0.20 -1.61 119.30 117.23 3feq s MET 190 Ca 0.02 -0.39 0.08 0.00 -1.71 0.00 0.00 55.69 53.70 3feq s MET 190 Cb -0.07 -3.84 0.20 0.00 2.01 0.00 0.00 34.83 33.13 3feq s MET 190 CO 0.02 -0.63 1.10 0.00 -0.01 0.00 0.00 175.02 175.49 3feq n ALA 191 N 5.56 2.22 -3.82 3.03 0.00 -0.47 -4.59 120.51 122.44 3feq n ALA 191 Ca -0.07 -0.98 -0.07 0.00 0.00 0.00 0.00 53.44 52.32 3feq n ALA 191 Cb 0.49 -0.33 -0.02 0.00 0.00 0.00 0.00 19.45 19.59 3feq n ALA 191 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3feq s SER 192 N -0.93 -0.26 0.96 0.00 1.04 -1.17 -1.79 113.70 111.55 3feq s SER 192 Ca 0.16 -0.54 -0.10 0.00 0.48 0.00 0.00 55.95 55.95 3feq s SER 192 Cb 0.09 0.67 0.17 0.00 0.10 0.00 0.00 66.02 67.06 3feq s SER 192 CO 0.12 -1.24 1.13 -0.83 0.98 0.00 0.00 173.24 173.40 3feq s GLY 193 N -2.91 1.66 0.00 7.32 0.00 -0.59 -4.54 107.32 108.26 3feq s GLY 193 Ca 0.11 0.48 0.00 0.00 0.00 0.00 0.00 44.72 45.31 3feq s GLY 193 CO 0.05 0.95 0.00 0.61 0.00 0.00 0.00 173.10 174.71 3feq n GLY 194 N 0.36 5.45 0.41 0.20 0.00 -1.26 -4.66 105.19 105.70 3feq n GLY 194 Ca 0.10 -1.16 -0.08 0.00 0.00 0.00 0.00 46.02 44.88 3feq n GLY 194 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3feq n VAL 195 N 0.00 0.52 0.60 1.61 0.31 -1.26 -4.39 118.33 115.71 3feq n VAL 195 Ca 0.00 -0.16 0.06 0.00 -0.01 0.00 0.00 64.34 64.23 3feq n VAL 195 Cb 0.00 -1.27 0.18 0.00 -0.91 0.00 0.00 33.84 31.84 3feq n VAL 195 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3feq n ALA 196 N -3.13 2.63 -2.51 3.52 0.00 -1.26 -4.53 120.51 115.23 3feq n ALA 196 Ca -0.17 -0.75 -0.31 0.00 0.00 0.00 0.00 53.44 52.21 3feq n ALA 196 Cb 0.65 -0.99 -0.12 0.00 0.00 0.00 0.00 19.45 18.99 3feq n ALA 196 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3feq s SER 197 N -0.85 4.06 0.05 0.00 1.04 -1.26 -4.73 113.70 112.00 3feq s SER 197 Ca 0.26 -0.38 -0.24 0.00 0.48 0.00 0.00 55.95 56.07 3feq s SER 197 Cb 0.15 -0.73 -0.17 0.00 0.10 0.00 0.00 66.02 65.38 3feq s SER 197 CO 0.15 0.24 1.58 1.55 0.98 0.00 0.00 173.24 177.74 3feq h PRO 198 N 4.30 -0.04 0.00 4.02 0.13 -1.88 -3.39 132.00 135.13 3feq h PRO 198 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3feq h PRO 198 Cb 1.16 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3feq h PRO 198 CO 0.49 0.12 -1.49 0.25 -0.23 0.00 0.00 178.00 177.15 3feq n THR 199 N -5.03 0.00 -3.57 1.56 -2.24 -1.26 -4.90 114.28 98.84 3feq n THR 199 Ca -0.08 -0.24 -0.39 0.00 -2.27 0.00 0.00 64.05 61.07 3feq n THR 199 Cb 0.12 0.51 -0.11 0.00 -2.10 0.00 0.00 70.33 68.75 3feq n THR 199 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3feq s ASP 200 N -3.74 6.02 0.71 3.42 1.47 -1.26 -5.08 116.67 118.20 3feq s ASP 200 Ca 0.00 -0.20 -0.15 0.00 1.18 0.00 0.00 52.55 53.38 3feq s ASP 200 Cb 0.15 -2.12 0.03 0.00 -0.34 0.00 0.00 42.92 40.63 3feq s ASP 200 CO 0.89 -0.13 1.18 -2.16 0.68 0.00 0.00 175.17 175.62 3feq s PRO 201 N 1.74 2.36 0.36 2.11 0.04 -1.26 -4.06 135.00 136.28 3feq s PRO 201 Ca 0.07 1.65 0.19 0.00 0.04 0.00 0.00 61.00 62.95 3feq s PRO 201 Cb -0.17 -1.87 0.26 0.00 0.04 0.00 0.00 34.50 32.76 3feq s PRO 201 CO 0.11 -1.64 1.54 0.97 0.04 0.00 0.00 177.00 178.02 3feq h ILE 202 N -0.16 0.50 0.00 0.56 2.10 -1.83 -3.23 117.51 115.45 3feq h ILE 202 Ca -0.47 -1.65 0.00 0.00 1.08 0.00 0.00 64.86 63.81 3feq h ILE 202 Cb 1.28 2.20 0.00 0.00 -1.09 0.00 0.00 36.82 39.21 3feq h ILE 202 CO 0.51 0.28 0.00 0.00 -1.08 0.00 0.00 178.15 177.86 3feq h ALA 203 N 1.71 1.00 -2.20 0.18 0.00 -1.93 -3.35 119.26 114.67 3feq h ALA 203 Ca -0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.43 3feq h ALA 203 Cb 1.18 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.99 3feq h ALA 203 CO 0.04 0.00 -0.11 0.54 0.00 0.00 0.00 179.25 179.72 3feq s ASN 204 N -5.71 6.16 0.19 0.00 6.03 -1.22 -4.93 114.94 115.46 3feq s ASN 204 Ca 0.02 0.49 0.03 0.00 -1.03 0.00 0.00 52.86 52.38 3feq s ASN 204 Cb 0.08 -1.93 -0.03 0.00 -3.03 0.00 0.00 41.25 36.33 3feq s ASN 204 CO 0.56 -0.46 0.33 0.42 -2.03 0.00 0.00 177.10 175.91 3feq s THR 205 N -2.46 5.29 -0.02 0.54 -4.23 -1.26 -1.54 115.64 111.95 3feq s THR 205 Ca 0.44 -0.75 0.04 0.00 -1.18 0.00 0.00 61.69 60.23 3feq s THR 205 Cb -0.10 -3.78 -0.01 0.00 1.34 0.00 0.00 72.50 69.95 3feq s THR 205 CO 0.38 -0.19 -0.14 -1.10 -0.54 0.00 0.00 174.62 173.03 3feq s GLN 206 N -3.52 1.26 0.06 3.99 -0.21 -0.74 -4.79 119.66 115.71 3feq s GLN 206 Ca 0.35 -0.49 0.00 0.00 0.02 0.00 0.00 55.36 55.24 3feq s GLN 206 Cb -0.10 -1.17 0.00 0.00 1.00 0.00 0.00 33.01 32.73 3feq s GLN 206 CO 0.29 0.26 0.00 0.66 -2.12 0.00 0.00 175.29 174.38 3feq n TYR 207 N 2.92 -0.80 -1.17 0.91 0.53 -1.26 -4.46 117.16 113.83 3feq n TYR 207 Ca -0.16 0.42 -0.29 0.00 -1.02 0.00 0.00 57.90 56.85 3feq n TYR 207 Cb 0.54 -1.88 0.16 0.00 -1.03 0.00 0.00 39.34 37.13 3feq n TYR 207 CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 3feq s SER 208 N -1.12 2.94 0.23 7.72 1.04 -1.26 -4.87 113.70 118.38 3feq s SER 208 Ca 0.00 1.32 -0.02 0.00 0.48 0.00 0.00 55.95 57.73 3feq s SER 208 Cb 0.00 -1.99 0.23 0.00 0.10 0.00 0.00 66.02 64.36 3feq s SER 208 CO 0.00 -2.95 1.63 -0.33 0.98 0.00 0.00 173.24 172.57 3feq h GLU 209 N -1.76 0.64 -0.36 4.02 5.08 -1.96 -2.34 114.58 117.89 3feq h GLU 209 Ca -0.52 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 57.54 3feq h GLU 209 Cb 1.31 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 3feq h GLU 209 CO 0.56 0.87 0.19 -0.44 -1.00 0.00 0.00 179.01 179.19 3feq h ASP 210 N 0.55 0.45 -0.40 1.42 3.32 -1.99 -1.66 116.42 118.11 3feq h ASP 210 Ca 0.07 -0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.05 3feq h ASP 210 Cb 0.79 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.20 3feq h ASP 210 CO 0.07 0.42 0.22 -0.33 -1.72 0.00 0.00 179.24 177.89 3feq h GLU 211 N 0.45 0.43 0.19 3.56 5.08 -1.87 -1.01 114.58 121.41 3feq h GLU 211 Ca 0.13 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3feq h GLU 211 Cb 0.07 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3feq h GLU 211 CO -0.02 0.28 -0.09 0.82 -1.00 0.00 0.00 179.01 179.00 3feq h ILE 212 N 0.44 0.86 -0.98 3.13 2.04 -1.30 -1.05 117.51 120.65 3feq h ILE 212 Ca 0.17 -0.23 0.17 0.00 1.00 0.00 0.00 64.86 65.97 3feq h ILE 212 Cb 0.05 1.01 -0.09 0.00 -0.74 0.00 0.00 36.82 37.04 3feq h ILE 212 CO -0.10 0.05 0.61 0.03 0.00 0.00 0.00 178.15 178.75 3feq h ARG 213 N -0.36 0.73 -0.51 2.37 3.08 -1.19 0.19 114.38 118.69 3feq h ARG 213 Ca -0.03 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 3feq h ARG 213 Cb 0.28 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3feq h ARG 213 CO 0.04 0.48 0.20 0.00 -1.07 0.00 0.00 179.97 179.62 3feq h ALA 214 N 1.61 0.66 -0.40 0.04 0.00 -0.64 -0.64 119.26 119.89 3feq h ALA 214 Ca 0.54 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 3feq h ALA 214 Cb 0.85 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3feq h ALA 214 CO -0.31 0.27 0.13 0.82 0.00 0.00 0.00 179.25 180.16 3feq h ILE 215 N 0.68 1.21 -0.81 0.00 2.04 0.21 -2.26 117.51 118.58 3feq h ILE 215 Ca 0.17 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.30 3feq h ILE 215 Cb 0.21 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 3feq h ILE 215 CO -0.01 0.24 0.37 0.58 0.00 0.00 0.00 178.15 179.33 3feq h VAL 216 N 0.50 1.26 -0.41 1.67 2.07 -0.48 -1.54 116.25 119.32 3feq h VAL 216 Ca 0.13 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 3feq h VAL 216 Cb 0.25 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3feq h VAL 216 CO -0.01 0.31 0.22 0.44 0.02 0.00 0.00 177.57 178.56 3feq h ASP 217 N 1.15 0.52 0.12 0.57 3.32 -0.98 -1.15 116.42 119.96 3feq h ASP 217 Ca 0.27 -0.10 -0.14 0.00 0.02 0.00 0.00 57.03 57.09 3feq h ASP 217 Cb 0.15 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 3feq h ASP 217 CO -0.03 0.47 -0.49 -0.33 -1.72 0.00 0.00 179.24 177.14 3feq h GLU 218 N 0.53 0.43 -0.41 3.56 4.39 -0.92 0.11 114.58 122.26 3feq h GLU 218 Ca 0.14 -0.25 -0.10 0.00 0.34 0.00 0.00 59.36 59.49 3feq h GLU 218 Cb 0.07 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 3feq h GLU 218 CO -0.02 0.83 -0.14 0.00 -1.16 0.00 0.00 179.01 178.51 3feq h ALA 219 N 1.13 0.58 -0.67 3.43 0.00 -1.16 -2.92 119.26 119.64 3feq h ALA 219 Ca 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 3feq h ALA 219 Cb 0.98 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 3feq h ALA 219 CO 0.09 0.49 0.32 0.93 0.00 0.00 0.00 179.25 181.08 3feq h GLU 220 N 0.65 0.97 -0.14 0.00 5.08 -0.78 0.18 114.58 120.54 3feq h GLU 220 Ca 0.10 -0.14 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 3feq h GLU 220 Cb 0.69 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 3feq h GLU 220 CO 0.05 0.77 0.19 0.00 -1.00 0.00 0.00 179.01 179.02 3feq h ALA 221 N 1.15 1.65 -0.58 3.43 0.00 -0.64 0.55 119.26 124.82 3feq h ALA 221 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3feq h ALA 221 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3feq h ALA 221 CO -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 178.96 3feq n ALA 222 N -2.25 3.06 -3.80 0.00 0.00 -0.98 -4.94 120.51 111.60 3feq n ALA 222 Ca 0.01 -1.66 -0.25 0.00 0.00 0.00 0.00 53.44 51.53 3feq n ALA 222 Cb 0.30 -0.94 0.03 0.00 0.00 0.00 0.00 19.45 18.84 3feq n ALA 222 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3feq n ASN 223 N 0.87 -2.43 -0.97 0.00 3.02 0.18 -5.02 115.26 110.90 3feq n ASN 223 Ca 0.24 -0.82 0.00 0.00 -0.03 0.00 0.00 54.58 53.97 3feq n ASN 223 Cb 0.88 -3.92 0.00 0.00 -0.61 0.00 0.00 39.78 36.13 3feq n ASN 223 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 3feq n THR 224 N -4.44 0.00 -4.45 3.41 5.66 0.58 -5.01 114.28 110.04 3feq n THR 224 Ca -0.18 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.61 3feq n THR 224 Cb 0.62 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.30 3feq n THR 224 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 3feq s TYR 225 N -1.78 1.90 -0.20 1.09 -0.85 -1.26 -3.00 117.35 113.25 3feq s TYR 225 Ca 0.00 -1.02 -0.07 0.00 -0.52 0.00 0.00 57.07 55.46 3feq s TYR 225 Cb 0.00 -1.24 -0.04 0.00 0.38 0.00 0.00 41.96 41.07 3feq s TYR 225 CO 0.00 -0.06 0.07 0.08 -1.52 0.00 0.00 175.55 174.12 3feq s VAL 226 N -3.33 4.67 -0.12 -3.49 1.01 -1.26 -1.90 120.40 115.99 3feq s VAL 226 Ca 0.35 -0.07 -0.15 0.00 0.00 0.00 0.00 61.98 62.12 3feq s VAL 226 Cb 0.08 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 33.28 3feq s VAL 226 CO 0.15 0.42 0.35 0.00 0.00 0.00 0.00 175.10 176.02 3feq s MET 227 N 0.77 4.17 -0.10 2.72 0.23 0.18 -1.28 119.30 125.99 3feq s MET 227 Ca 0.04 0.22 0.03 0.00 -1.03 0.00 0.00 55.69 54.95 3feq s MET 227 Cb -0.13 -3.38 0.01 0.00 -1.53 0.00 0.00 34.83 29.79 3feq s MET 227 CO 0.02 0.33 -0.20 0.00 -2.03 0.00 0.00 175.02 173.13 3feq s ALA 228 N 0.16 1.96 0.06 3.16 0.00 0.44 -1.62 121.76 125.92 3feq s ALA 228 Ca 0.20 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 50.99 3feq s ALA 228 Cb -0.14 -0.81 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 3feq s ALA 228 CO 0.07 0.15 1.08 -1.58 0.00 0.00 0.00 175.76 175.48 3feq s HIS 229 N 0.58 3.57 -0.29 0.00 2.46 -0.63 -0.27 115.29 120.71 3feq s HIS 229 Ca -0.14 1.53 -0.16 0.00 0.47 0.00 0.00 55.06 56.76 3feq s HIS 229 Cb -0.17 -3.26 0.15 0.00 -0.13 0.00 0.00 32.58 29.18 3feq s HIS 229 CO 0.05 -0.58 1.01 0.00 -2.47 0.00 0.00 174.74 172.74 3feq s ALA 230 N 0.76 -2.31 -0.10 1.58 0.00 -1.15 -1.37 121.76 119.17 3feq s ALA 230 Ca 0.54 2.17 -0.11 0.00 0.00 0.00 0.00 51.96 54.56 3feq s ALA 230 Cb -0.26 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.09 3feq s ALA 230 CO 0.30 -0.34 -0.21 0.66 0.00 0.00 0.00 175.76 176.16 3feq n TYR 231 N 3.59 0.00 -2.04 0.00 4.01 -1.26 -1.57 117.16 119.89 3feq n TYR 231 Ca -0.18 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.23 3feq n TYR 231 Cb 0.57 -0.30 0.01 0.00 -0.31 0.00 0.00 39.34 39.31 3feq n TYR 231 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3feq s THR 232 N -2.25 3.96 0.33 -0.72 -4.23 -1.26 -1.56 115.64 109.90 3feq s THR 232 Ca -0.17 0.89 0.04 0.00 -1.18 0.00 0.00 61.69 61.27 3feq s THR 232 Cb 0.02 -3.44 0.29 0.00 1.34 0.00 0.00 72.50 70.72 3feq s THR 232 CO 0.26 -0.58 1.92 1.23 -0.54 0.00 0.00 174.62 176.90 3feq h GLY 233 N 0.36 1.17 0.96 3.99 0.00 -1.78 0.19 103.07 107.98 3feq h GLY 233 Ca -0.46 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 46.51 3feq h GLY 233 CO 0.58 0.23 0.12 -0.09 0.00 0.00 0.00 176.54 177.38 3feq h ARG 234 N 0.86 0.29 -0.40 4.80 2.43 -1.92 -2.01 114.38 118.42 3feq h ARG 234 Ca 0.38 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.40 3feq h ARG 234 Cb 0.33 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 3feq h ARG 234 CO -0.15 0.25 -0.22 0.00 -1.51 0.00 0.00 179.97 178.34 3feq h ALA 235 N 1.02 0.86 -0.13 2.80 0.00 -1.73 -3.11 119.26 118.98 3feq h ALA 235 Ca 0.07 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 3feq h ALA 235 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3feq h ALA 235 CO -0.01 0.63 -0.30 0.82 0.00 0.00 0.00 179.25 180.39 3feq h ILE 236 N 0.69 1.26 0.15 0.00 2.04 -0.81 -3.03 117.51 117.82 3feq h ILE 236 Ca 0.10 -1.25 -0.32 0.00 1.00 0.00 0.00 64.86 64.39 3feq h ILE 236 Cb 0.74 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 3feq h ILE 236 CO 0.06 0.38 -1.56 0.00 0.00 0.00 0.00 178.15 177.02 3feq h ALA 237 N 1.47 0.20 0.00 1.87 0.00 -1.30 -2.31 119.26 119.19 3feq h ALA 237 Ca 0.03 -1.08 -0.09 0.00 0.00 0.00 0.00 54.91 53.76 3feq h ALA 237 Cb 0.65 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3feq h ALA 237 CO 0.05 1.07 -0.44 0.07 0.00 0.00 0.00 179.25 179.99 3feq h ARG 238 N 0.08 0.00 -0.53 0.00 0.11 -1.57 0.12 114.38 112.59 3feq h ARG 238 Ca -0.26 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.71 3feq h ARG 238 Cb 2.05 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 33.11 3feq h ARG 238 CO 0.18 0.44 -0.08 0.00 0.10 0.00 0.00 179.97 180.61 3feq h ALA 239 N 1.56 0.73 0.05 0.08 0.00 -1.49 -2.70 119.26 117.49 3feq h ALA 239 Ca -0.00 -0.34 -0.23 0.00 0.00 0.00 0.00 54.91 54.33 3feq h ALA 239 Cb 0.84 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3feq h ALA 239 CO 0.06 0.62 -1.04 0.28 0.00 0.00 0.00 179.25 179.17 3feq h VAL 240 N 0.87 1.49 0.00 0.00 2.07 -0.74 -2.44 116.25 117.51 3feq h VAL 240 Ca 0.14 -2.80 -0.04 0.00 0.82 0.00 0.00 66.70 64.82 3feq h VAL 240 Cb 0.65 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 3feq h VAL 240 CO 0.04 0.82 -0.18 0.03 0.02 0.00 0.00 177.57 178.30 3feq h ARG 241 N 0.12 0.00 0.00 1.57 3.08 -0.82 -2.40 114.38 115.93 3feq h ARG 241 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3feq h ARG 241 Cb 1.72 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.77 3feq h ARG 241 CO 0.17 0.18 -0.52 0.00 -1.07 0.00 0.00 179.97 178.73 3feq n GLY 243 N 1.17 1.64 3.76 0.00 0.00 -0.90 -4.56 105.19 106.30 3feq n GLY 243 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3feq n GLY 243 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3feq s VAL 244 N -2.00 2.41 -0.17 1.61 -7.23 -0.96 -4.80 120.40 109.27 3feq s VAL 244 Ca 0.00 0.36 -0.12 0.00 -1.81 0.00 0.00 61.98 60.41 3feq s VAL 244 Cb 0.00 -3.20 -0.22 0.00 0.56 0.00 0.00 36.38 33.51 3feq s VAL 244 CO 0.00 0.04 0.24 -1.14 -0.31 0.00 0.00 175.10 173.93 3feq n ARG 245 N -0.17 0.67 -5.09 4.82 0.63 -0.40 -4.72 116.66 112.40 3feq n ARG 245 Ca 0.05 0.37 -0.29 0.00 -0.92 0.00 0.00 57.85 57.06 3feq n ARG 245 Cb 0.44 -1.70 -0.16 0.00 0.45 0.00 0.00 32.46 31.48 3feq n ARG 245 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3feq s THR 246 N -2.48 1.80 -0.14 5.15 -4.23 -1.16 -1.34 115.64 113.24 3feq s THR 246 Ca -0.26 -0.92 -0.09 0.00 -1.18 0.00 0.00 61.69 59.24 3feq s THR 246 Cb 0.07 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.33 3feq s THR 246 CO 0.68 0.51 0.16 -0.63 -0.54 0.00 0.00 174.62 174.79 3feq s ILE 247 N -0.07 5.45 -0.02 2.99 -1.09 -0.59 -0.42 121.20 127.45 3feq s ILE 247 Ca -0.04 0.25 -0.02 0.00 -2.23 0.00 0.00 60.65 58.61 3feq s ILE 247 Cb -0.13 -3.45 -0.04 0.00 -1.58 0.00 0.00 42.46 37.27 3feq s ILE 247 CO 0.03 0.55 0.13 -1.61 -1.23 0.00 0.00 174.94 172.81 3feq s GLU 248 N -0.53 3.26 1.13 2.79 0.41 0.63 -0.50 118.70 125.89 3feq s GLU 248 Ca 0.13 -0.38 0.00 0.00 -0.41 0.00 0.00 54.97 54.31 3feq s GLU 248 Cb -0.12 -2.99 0.00 0.00 -1.78 0.00 0.00 34.13 29.24 3feq s GLU 248 CO 0.03 0.67 0.00 0.72 -0.49 0.00 0.00 175.26 176.19 3feq n HIS 249 N 1.17 0.00 -1.94 1.61 8.25 0.34 -2.93 115.22 121.72 3feq n HIS 249 Ca -0.13 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.22 3feq n HIS 249 Cb 0.53 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.62 3feq n HIS 249 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3feq n GLY 250 N 0.00 0.32 0.27 -1.41 0.00 -0.61 -3.99 105.19 99.77 3feq n GLY 250 Ca 0.00 -0.44 0.15 0.00 0.00 0.00 0.00 46.02 45.73 3feq n GLY 250 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3feq h ASN 251 N 0.00 0.00 -0.83 1.61 4.21 -1.77 -3.16 115.58 115.65 3feq h ASN 251 Ca -0.26 0.00 -0.58 0.00 1.21 0.00 0.00 56.30 56.67 3feq h ASN 251 Cb 1.06 0.00 -0.40 0.00 -1.12 0.00 0.00 38.32 37.86 3feq h ASN 251 CO 0.33 0.09 -0.42 0.18 -1.29 0.00 0.00 177.43 176.32 3feq n LEU 252 N -3.39 5.58 -4.76 1.61 4.77 -0.60 -4.26 117.00 115.94 3feq n LEU 252 Ca -0.01 -4.66 -0.36 0.00 -0.03 0.00 0.00 56.01 50.95 3feq n LEU 252 Cb 0.25 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 40.86 3feq n LEU 252 CO 0.28 1.96 0.83 0.68 -1.33 0.00 0.00 177.39 179.81 3feq s VAL 253 N -4.68 2.89 0.44 4.08 -7.23 -1.19 -2.22 120.40 112.49 3feq s VAL 253 Ca 0.54 0.58 0.08 0.00 -1.81 0.00 0.00 61.98 61.38 3feq s VAL 253 Cb 0.43 -3.25 0.02 0.00 0.56 0.00 0.00 36.38 34.14 3feq s VAL 253 CO 0.02 -0.09 0.58 1.51 -0.31 0.00 0.00 175.10 176.81 3feq s ASP 254 N -1.57 5.52 0.43 4.85 1.47 -1.26 -4.86 116.67 121.25 3feq s ASP 254 Ca 0.73 -0.52 0.26 0.00 1.18 0.00 0.00 52.55 54.20 3feq s ASP 254 Cb -0.28 -0.51 0.66 0.00 -0.34 0.00 0.00 42.92 42.46 3feq s ASP 254 CO 0.32 -0.84 1.72 1.05 0.68 0.00 0.00 175.17 178.10 3feq h GLU 255 N 0.61 0.00 -0.42 2.11 9.09 -1.98 -2.39 114.58 121.60 3feq h GLU 255 Ca -0.39 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.02 3feq h GLU 255 Cb 1.28 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.36 3feq h GLU 255 CO 0.45 0.00 0.26 0.00 0.05 0.00 0.00 179.01 179.78 3feq h ALA 256 N 2.08 0.54 -0.22 1.06 0.00 -1.99 0.12 119.26 120.84 3feq h ALA 256 Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 3feq h ALA 256 Cb 0.83 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 3feq h ALA 256 CO 0.00 0.02 -0.36 0.00 0.00 0.00 0.00 179.25 178.90 3feq h ALA 257 N 1.13 0.34 -0.57 0.00 0.00 -1.86 -1.69 119.26 116.61 3feq h ALA 257 Ca 0.15 -0.44 0.08 0.00 0.00 0.00 0.00 54.91 54.71 3feq h ALA 257 Cb -0.02 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 3feq h ALA 257 CO -0.03 0.41 0.22 0.00 0.00 0.00 0.00 179.25 179.85 3feq h ALA 258 N 0.63 0.73 -0.26 0.00 0.00 -1.34 0.13 119.26 119.14 3feq h ALA 258 Ca 0.02 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3feq h ALA 258 Cb 0.95 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3feq h ALA 258 CO 0.08 -0.18 0.14 -0.22 0.00 0.00 0.00 179.25 179.07 3feq h LYS 259 N 0.41 0.28 -0.97 0.00 3.64 -0.56 0.63 116.57 120.00 3feq h LYS 259 Ca 0.28 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.71 3feq h LYS 259 Cb 0.31 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.01 3feq h LYS 259 CO -0.27 0.19 0.63 1.25 -2.27 0.00 0.00 179.45 178.97 3feq h LEU 260 N 0.29 0.99 -0.27 5.20 5.85 -0.85 0.12 115.31 126.64 3feq h LEU 260 Ca 0.11 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 3feq h LEU 260 Cb 0.02 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 3feq h LEU 260 CO -0.06 0.64 -0.00 0.24 -0.34 0.00 0.00 178.44 178.91 3feq h MET 261 N 1.12 0.48 -0.42 1.25 2.86 0.14 -0.23 114.93 120.15 3feq h MET 261 Ca 0.41 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 3feq h MET 261 Cb 0.17 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 3feq h MET 261 CO -0.16 0.64 0.24 1.25 1.06 0.00 0.00 176.91 179.95 3feq h HIS 262 N 0.26 0.56 -0.65 -0.22 -0.00 -0.49 -1.57 115.15 113.04 3feq h HIS 262 Ca 0.08 -0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.53 3feq h HIS 262 Cb 0.43 -0.18 -0.07 0.00 -0.00 0.00 0.00 27.41 27.59 3feq h HIS 262 CO 0.04 0.40 0.31 1.49 -0.00 0.00 0.00 177.93 180.17 3feq h GLU 263 N 0.55 0.53 0.00 5.26 4.81 -0.47 -2.53 114.58 122.72 3feq h GLU 263 Ca 0.15 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3feq h GLU 263 Cb 0.02 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.28 3feq h GLU 263 CO -0.03 0.35 0.00 0.72 -0.73 0.00 0.00 179.01 179.32 3feq n HIS 264 N -4.89 0.06 -1.51 0.92 8.25 -0.12 -4.89 115.22 113.03 3feq n HIS 264 Ca 0.09 0.02 -0.04 0.00 -0.26 0.00 0.00 57.72 57.53 3feq n HIS 264 Cb 0.25 -0.53 -0.01 0.00 1.12 0.00 0.00 29.99 30.82 3feq n HIS 264 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3feq n GLY 265 N 1.18 0.48 3.80 -1.41 0.00 -0.86 -5.03 105.19 103.35 3feq n GLY 265 Ca 0.06 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.87 3feq n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq s ALA 266 N -2.17 3.47 0.53 4.61 0.00 -0.65 -5.03 121.76 122.53 3feq s ALA 266 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.19 3feq s ALA 266 Cb 0.00 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.30 3feq s ALA 266 CO 0.00 0.33 0.77 -0.06 0.00 0.00 0.00 175.76 176.79 3feq s PHE 267 N -1.27 2.98 0.01 0.00 0.08 -0.45 -4.42 117.98 114.92 3feq s PHE 267 Ca 0.37 0.12 0.03 0.00 0.12 0.00 0.00 56.93 57.57 3feq s PHE 267 Cb -0.20 -2.66 -0.01 0.00 -0.57 0.00 0.00 43.02 39.58 3feq s PHE 267 CO 0.23 -0.76 -0.10 0.08 -0.10 0.00 0.00 175.22 174.57 3feq s VAL 268 N -2.75 0.80 -0.40 -0.44 1.01 -0.72 -1.55 120.40 116.36 3feq s VAL 268 Ca 0.55 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.97 3feq s VAL 268 Cb -0.10 -0.70 0.11 0.00 0.00 0.00 0.00 36.38 35.69 3feq s VAL 268 CO 0.39 0.12 0.15 -0.69 0.00 0.00 0.00 175.10 175.07 3feq s VAL 269 N -0.45 1.98 0.54 2.92 1.01 0.35 0.00 120.40 126.75 3feq s VAL 269 Ca 0.02 -2.50 -0.20 0.00 0.00 0.00 0.00 61.98 59.30 3feq s VAL 269 Cb -0.05 -2.43 -0.06 0.00 0.00 0.00 0.00 36.38 33.85 3feq s VAL 269 CO 0.00 -0.72 1.15 -2.84 0.00 0.00 0.00 175.10 172.69 3feq s PRO 270 N 0.59 3.34 -0.39 2.72 0.02 -1.26 -0.50 135.00 139.52 3feq s PRO 270 Ca 0.14 1.67 0.11 0.00 0.02 0.00 0.00 61.00 62.93 3feq s PRO 270 Cb -0.22 -2.04 0.43 0.00 0.02 0.00 0.00 34.50 32.70 3feq s PRO 270 CO -0.07 -0.87 1.03 0.25 -0.33 0.00 0.00 177.00 177.01 3feq n THR 271 N -1.25 1.77 0.04 0.99 -2.24 -1.26 -3.42 114.28 108.91 3feq n THR 271 Ca 0.11 -4.16 0.12 0.00 -2.27 0.00 0.00 64.05 57.85 3feq n THR 271 Cb 0.50 -0.45 0.58 0.00 -2.10 0.00 0.00 70.33 68.86 3feq n THR 271 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3feq h LEU 272 N 2.77 0.18 -1.21 3.22 3.38 -1.84 -2.48 115.31 119.33 3feq h LEU 272 Ca 0.13 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 3feq h LEU 272 Cb 1.02 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 3feq h LEU 272 CO 0.70 0.12 0.06 1.62 0.09 0.00 0.00 178.44 181.02 3feq h VAL 273 N 0.21 1.20 -0.10 1.22 3.04 -1.85 -2.67 116.25 117.31 3feq h VAL 273 Ca 0.18 -0.74 -0.04 0.00 -1.01 0.00 0.00 66.70 65.08 3feq h VAL 273 Cb 0.44 0.84 -0.01 0.00 -2.01 0.00 0.00 31.29 30.55 3feq h VAL 273 CO -0.03 0.26 -0.14 0.00 -1.01 0.00 0.00 177.57 176.65 3feq h THR 274 N 0.58 1.16 0.00 3.17 1.03 -1.55 -2.02 112.91 115.28 3feq h THR 274 Ca 0.13 -0.70 -0.09 0.00 -0.01 0.00 0.00 66.41 65.73 3feq h THR 274 Cb 0.29 1.24 -0.01 0.00 -1.07 0.00 0.00 68.15 68.60 3feq h THR 274 CO 0.00 0.21 -0.44 1.88 -0.01 0.00 0.00 175.52 177.16 3feq h TYR 275 N 0.14 0.00 -0.01 0.00 0.05 -1.62 -1.49 116.97 114.04 3feq h TYR 275 Ca 0.03 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.56 3feq h TYR 275 Cb 0.34 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.10 3feq h TYR 275 CO 0.00 0.44 -0.99 -0.44 -1.05 0.00 0.00 178.16 176.13 3feq h ASP 276 N 0.00 0.80 -0.38 3.88 3.45 -1.40 -2.12 116.42 120.65 3feq h ASP 276 Ca -0.00 -0.63 -0.15 0.00 0.43 0.00 0.00 57.03 56.68 3feq h ASP 276 Cb 1.22 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 39.73 3feq h ASP 276 CO 0.06 1.43 -0.33 0.00 -1.57 0.00 0.00 179.24 178.82 3feq h ALA 277 N 0.52 0.55 0.00 3.45 0.00 -1.33 -2.55 119.26 119.90 3feq h ALA 277 Ca -0.11 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3feq h ALA 277 Cb 1.63 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.30 3feq h ALA 277 CO 0.19 0.62 0.00 -0.07 0.00 0.00 0.00 179.25 179.98 3feq h LEU 278 N 0.70 0.00 -0.03 0.00 3.38 -1.33 -0.31 115.31 117.72 3feq h LEU 278 Ca 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3feq h LEU 278 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3feq h LEU 278 CO 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 178.44 178.55 3feq h ALA 279 N 2.02 0.05 0.04 1.53 0.00 -1.16 -2.98 119.26 118.76 3feq h ALA 279 Ca 0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 3feq h ALA 279 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3feq h ALA 279 CO 0.00 -0.11 -0.02 0.87 0.00 0.00 0.00 179.25 179.99 3feq h LYS 280 N -0.43 -0.05 -0.64 0.00 6.56 -1.21 -3.39 116.57 117.41 3feq h LYS 280 Ca 0.00 0.00 -0.47 0.00 -1.06 0.00 0.00 60.65 59.12 3feq h LYS 280 Cb 0.64 0.01 -0.37 0.00 -0.57 0.00 0.00 32.23 31.94 3feq h LYS 280 CO 0.01 0.60 -0.78 0.72 -2.06 0.00 0.00 179.45 177.94 3feq n HIS 281 N -4.77 2.35 0.00 -1.35 8.25 -0.15 -4.85 115.22 114.70 3feq n HIS 281 Ca -0.09 -2.12 0.00 0.00 -0.26 0.00 0.00 57.72 55.26 3feq n HIS 281 Cb 0.33 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.12 3feq n HIS 281 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3feq n GLY 282 N -0.76 -0.52 0.27 -1.41 0.00 -1.12 -1.97 105.19 99.68 3feq n GLY 282 Ca 0.40 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.60 3feq n GLY 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq h ALA 283 N -2.00 1.00 -0.18 4.61 0.00 -1.82 -2.76 119.26 118.11 3feq h ALA 283 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3feq h ALA 283 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3feq h ALA 283 CO 0.00 0.00 -0.56 1.49 0.00 0.00 0.00 179.25 180.18 3feq h GLU 284 N 0.00 0.55 -0.56 0.00 4.81 -1.89 -3.22 114.58 114.27 3feq h GLU 284 Ca 0.00 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 3feq h GLU 284 Cb 0.16 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3feq h GLU 284 CO 0.00 0.96 0.00 1.19 -0.73 0.00 0.00 179.01 180.43 3feq n PHE 285 N -3.95 1.95 -0.16 0.92 3.72 -0.83 -4.94 117.46 114.16 3feq n PHE 285 Ca -0.03 -0.73 0.00 0.00 -0.05 0.00 0.00 57.45 56.64 3feq n PHE 285 Cb 0.61 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 3feq n PHE 285 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3feq n GLY 286 N 0.60 0.77 3.69 1.37 0.00 -1.22 -4.24 105.19 106.16 3feq n GLY 286 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 3feq n GLY 286 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3feq s MET 287 N -0.84 4.39 0.10 1.61 0.00 -1.19 -4.36 119.30 119.02 3feq s MET 287 Ca 0.00 1.49 -0.28 0.00 0.00 0.00 0.00 55.69 56.89 3feq s MET 287 Cb 0.00 -3.55 -0.16 0.00 0.00 0.00 0.00 34.83 31.12 3feq s MET 287 CO 0.00 -0.37 0.65 -2.30 0.00 0.00 0.00 175.02 173.00 3feq n PRO 288 N 5.10 0.00 0.05 4.11 -0.01 -1.26 -4.27 135.00 138.72 3feq n PRO 288 Ca 0.10 0.00 0.19 0.00 -0.01 0.00 0.00 63.50 63.78 3feq n PRO 288 Cb 0.48 -1.04 0.72 0.00 -0.01 0.00 0.00 33.50 33.64 3feq n PRO 288 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 175.50 174.14 3feq h PRO 289 N 1.59 0.00 -0.01 0.52 0.11 -1.96 -0.89 132.00 131.37 3feq h PRO 289 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3feq h PRO 289 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3feq h PRO 289 CO 0.52 0.00 -0.26 -0.85 -0.21 0.00 0.00 178.00 177.20 3feq n GLU 290 N -4.21 0.85 0.04 1.05 0.00 -1.26 -2.99 120.64 114.12 3feq n GLU 290 Ca 0.08 -0.50 -0.13 0.00 0.00 0.00 0.00 57.16 56.61 3feq n GLU 290 Cb 0.55 -1.49 -0.14 0.00 0.00 0.00 0.00 31.44 30.36 3feq n GLU 290 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 3feq h SER 291 N 1.23 0.21 1.61 -1.84 0.02 -1.39 -3.33 113.55 110.05 3feq h SER 291 Ca 0.00 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 3feq h SER 291 Cb 0.51 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.98 3feq h SER 291 CO 0.00 1.25 0.00 0.58 -1.14 0.00 0.00 176.83 177.52 3feq h VAL 292 N 0.04 0.00 -0.69 2.27 2.07 -1.57 -2.87 116.25 115.50 3feq h VAL 292 Ca -0.19 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.50 3feq h VAL 292 Cb 1.95 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 33.45 3feq h VAL 292 CO 0.14 0.00 0.18 0.00 0.02 0.00 0.00 177.57 177.91 3feq h ALA 293 N 2.07 1.02 0.00 1.67 0.00 -1.66 -3.25 119.26 119.11 3feq h ALA 293 Ca 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3feq h ALA 293 Cb 0.80 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3feq h ALA 293 CO 0.00 0.64 -0.12 0.87 0.00 0.00 0.00 179.25 180.65 3feq h LYS 294 N 1.03 0.00 0.00 0.00 1.57 -1.61 -3.28 116.57 114.28 3feq h LYS 294 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 3feq h LYS 294 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3feq h LYS 294 CO -0.00 0.12 0.00 -0.24 -0.57 0.00 0.00 179.45 178.75 3feq h VAL 295 N 0.00 0.00 -0.68 0.50 3.04 -1.58 -3.23 116.25 114.30 3feq h VAL 295 Ca -0.00 -0.73 0.00 0.00 -1.01 0.00 0.00 66.70 64.96 3feq h VAL 295 Cb 0.81 1.71 -0.03 0.00 -2.01 0.00 0.00 31.29 31.77 3feq h VAL 295 CO 0.02 0.00 0.43 0.00 -1.01 0.00 0.00 177.57 177.00 3feq h ALA 296 N 2.16 0.86 0.07 3.17 0.00 -1.71 -3.31 119.26 120.50 3feq h ALA 296 Ca 0.00 -0.06 -0.26 0.00 0.00 0.00 0.00 54.91 54.59 3feq h ALA 296 Cb 0.81 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.34 3feq h ALA 296 CO 0.00 0.31 -1.11 0.66 0.00 0.00 0.00 179.25 179.11 3feq h SER 297 N 0.92 0.53 0.74 0.00 4.64 -1.80 -3.34 113.55 115.24 3feq h SER 297 Ca 0.25 -0.49 -0.16 0.00 -0.47 0.00 0.00 61.79 60.92 3feq h SER 297 Cb -0.07 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 61.83 3feq h SER 297 CO -0.05 1.33 -0.75 -0.37 -0.87 0.00 0.00 176.83 176.12 3feq h VAL 298 N 0.17 1.54 0.00 0.95 -1.51 -1.72 -3.25 116.25 112.42 3feq h VAL 298 Ca -0.12 -2.56 -0.06 0.00 -1.23 0.00 0.00 66.70 62.73 3feq h VAL 298 Cb 1.79 2.38 -0.01 0.00 -2.13 0.00 0.00 31.29 33.32 3feq h VAL 298 CO 0.19 0.73 -0.28 0.06 -1.23 0.00 0.00 177.57 177.04 3feq h GLN 299 N 0.00 0.00 0.00 5.19 3.07 -1.68 -2.90 115.11 118.80 3feq h GLN 299 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 3feq h GLN 299 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.88 3feq h GLN 299 CO 0.10 0.28 0.00 1.04 0.09 0.00 0.00 178.83 180.34 3feq n GLN 300 N -3.36 0.00 0.00 0.06 1.13 -1.23 -2.77 117.38 111.22 3feq n GLN 300 Ca 0.01 0.44 0.04 0.00 -1.94 0.00 0.00 57.00 55.55 3feq n GLN 300 Cb 0.50 -1.31 0.22 0.00 0.11 0.00 0.00 30.24 29.77 3feq n GLN 300 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3feq n LYS 301 N -1.63 0.16 0.10 -1.09 4.01 -1.24 -3.70 118.16 114.77 3feq n LYS 301 Ca 0.00 0.16 -0.13 0.00 -0.51 0.00 0.00 58.31 57.82 3feq n LYS 301 Cb 0.00 -1.50 -0.08 0.00 -0.51 0.00 0.00 35.03 32.94 3feq n LYS 301 CO 0.00 0.00 0.00 0.78 -1.11 0.00 0.00 177.40 177.07 3feq h GLY 302 N 1.39 -0.24 1.00 0.72 0.00 -1.32 0.25 103.07 104.86 3feq h GLY 302 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3feq h GLY 302 CO 0.00 -0.09 0.20 -0.09 0.00 0.00 0.00 176.54 176.57 3feq h ARG 303 N -0.45 0.40 -0.44 4.80 2.43 -1.69 -3.03 114.38 116.40 3feq h ARG 303 Ca -0.02 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3feq h ARG 303 Cb 0.35 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 3feq h ARG 303 CO 0.04 0.27 0.29 1.49 -1.51 0.00 0.00 179.97 180.55 3feq h GLU 304 N 0.42 0.58 -0.59 0.20 4.81 -1.67 -2.69 114.58 115.64 3feq h GLU 304 Ca 0.11 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 3feq h GLU 304 Cb -0.04 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 3feq h GLU 304 CO -0.03 0.39 0.07 0.66 -0.73 0.00 0.00 179.01 179.37 3feq h SER 305 N 0.60 0.93 -0.94 1.04 4.64 -0.38 -2.70 113.55 116.73 3feq h SER 305 Ca 0.16 -0.22 0.21 0.00 -0.47 0.00 0.00 61.79 61.47 3feq h SER 305 Cb -0.07 -0.25 -0.08 0.00 -0.31 0.00 0.00 62.40 61.70 3feq h SER 305 CO -0.04 0.94 0.61 -0.07 -0.87 0.00 0.00 176.83 177.41 3feq h LEU 306 N 0.91 0.48 -0.20 5.97 4.07 -1.50 0.18 115.31 125.22 3feq h LEU 306 Ca 0.18 0.06 -0.10 0.00 0.08 0.00 0.00 57.88 58.10 3feq h LEU 306 Cb 0.43 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.14 3feq h LEU 306 CO 0.01 0.18 -0.27 -0.33 -1.08 0.00 0.00 178.44 176.96 3feq h GLU 307 N 0.47 0.53 -0.89 1.13 5.08 -1.60 -2.19 114.58 117.10 3feq h GLU 307 Ca 0.50 -0.30 0.06 0.00 -1.00 0.00 0.00 59.36 58.62 3feq h GLU 307 Cb 1.17 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.38 3feq h GLU 307 CO -0.22 0.90 0.56 0.82 -1.00 0.00 0.00 179.01 180.07 3feq h ILE 308 N 0.19 1.06 -0.40 3.13 2.04 -0.93 0.10 117.51 122.71 3feq h ILE 308 Ca 0.02 -0.35 -0.09 0.00 1.00 0.00 0.00 64.86 65.44 3feq h ILE 308 Cb 0.84 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 3feq h ILE 308 CO 0.06 0.19 -0.09 1.88 0.00 0.00 0.00 178.15 180.19 3feq h TYR 309 N 1.03 0.87 -0.71 1.37 0.05 -1.14 -1.41 116.97 117.04 3feq h TYR 309 Ca 0.39 -0.19 -0.07 0.00 0.05 0.00 0.00 58.73 58.91 3feq h TYR 309 Cb 0.15 -0.21 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 3feq h TYR 309 CO -0.02 0.90 0.17 0.00 -1.05 0.00 0.00 178.16 178.16 3feq h ALA 310 N 0.85 0.97 -0.36 3.88 0.00 -1.02 0.87 119.26 124.44 3feq h ALA 310 Ca 0.10 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 3feq h ALA 310 Cb 0.62 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3feq h ALA 310 CO 0.04 0.67 -0.27 -0.91 0.00 0.00 0.00 179.25 178.77 3feq h ASN 311 N 1.07 0.77 1.66 0.00 2.35 -0.76 -2.44 115.58 118.23 3feq h ASN 311 Ca 0.22 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 3feq h ASN 311 Cb 0.37 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.53 3feq h ASN 311 CO 0.00 1.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.78 3feq h ALA 312 N 1.05 1.00 -1.86 -0.83 0.00 -1.25 -3.48 119.26 113.89 3feq h ALA 312 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3feq h ALA 312 Cb 0.79 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.59 3feq h ALA 312 CO 0.06 0.00 -0.06 0.41 0.00 0.00 0.00 179.25 179.67 3feq n GLY 313 N 1.08 0.60 3.67 0.00 0.00 -0.50 -4.75 105.19 105.29 3feq n GLY 313 Ca 0.04 -0.52 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 3feq n GLY 313 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3feq s VAL 314 N -3.03 5.26 0.37 1.61 1.01 0.18 -4.77 120.40 121.03 3feq s VAL 314 Ca 0.02 0.53 -0.28 0.00 0.00 0.00 0.00 61.98 62.25 3feq s VAL 314 Cb -0.01 -3.65 -0.11 0.00 0.00 0.00 0.00 36.38 32.61 3feq s VAL 314 CO 0.06 0.29 1.46 0.29 0.00 0.00 0.00 175.10 177.19 3feq n LYS 315 N 4.37 2.58 -4.38 2.72 4.01 -1.26 -4.58 118.16 121.62 3feq n LYS 315 Ca -0.11 0.91 -0.33 0.00 -0.51 0.00 0.00 58.31 58.27 3feq n LYS 315 Cb 0.51 -2.61 -0.16 0.00 -0.51 0.00 0.00 35.03 32.27 3feq n LYS 315 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 3feq s MET 316 N -2.04 3.10 0.39 1.97 -1.94 -1.26 -1.75 119.30 117.78 3feq s MET 316 Ca 0.54 -0.80 0.01 0.00 -1.71 0.00 0.00 55.69 53.73 3feq s MET 316 Cb -0.49 -2.58 -0.02 0.00 2.01 0.00 0.00 34.83 33.75 3feq s MET 316 CO 0.63 -0.09 0.60 0.20 -0.01 0.00 0.00 175.02 176.35 3feq s GLY 317 N 1.03 1.48 0.17 -0.03 0.00 0.10 -4.43 107.32 105.64 3feq s GLY 317 Ca -0.01 -1.05 -0.27 0.00 0.00 0.00 0.00 44.72 43.38 3feq s GLY 317 CO -0.05 -0.93 0.85 -0.12 0.00 0.00 0.00 173.10 172.85 3feq s PHE 318 N -2.41 3.90 -0.15 1.90 5.36 -0.20 -4.04 117.98 122.34 3feq s PHE 318 Ca 0.44 1.73 -0.19 0.00 -0.96 0.00 0.00 56.93 57.95 3feq s PHE 318 Cb -0.10 -2.88 0.05 0.00 -0.34 0.00 0.00 43.02 39.75 3feq s PHE 318 CO 0.36 0.42 0.51 0.20 -1.46 0.00 0.00 175.22 175.26 3feq s GLY 319 N -0.86 -0.38 -0.06 13.12 0.00 -1.22 -0.60 107.32 117.32 3feq s GLY 319 Ca 0.39 1.28 -0.06 0.00 0.00 0.00 0.00 44.72 46.34 3feq s GLY 319 CO 0.28 1.06 -0.11 1.44 0.00 0.00 0.00 173.10 175.77 3feq n SER 320 N 2.33 0.62 -2.77 1.64 7.64 -1.10 -4.28 113.62 117.68 3feq n SER 320 Ca -0.15 0.12 -0.17 0.00 1.01 0.00 0.00 58.87 59.68 3feq n SER 320 Cb 0.56 -0.58 0.06 0.00 -1.01 0.00 0.00 64.21 63.24 3feq n SER 320 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3feq n ASP 321 N -3.12 -5.01 -4.85 6.43 2.03 -0.20 -3.86 116.55 107.97 3feq n ASP 321 Ca -0.04 -0.40 -0.34 0.00 0.52 0.00 0.00 54.79 54.53 3feq n ASP 321 Cb 0.16 -3.83 -0.06 0.00 -0.72 0.00 0.00 41.12 36.67 3feq n ASP 321 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3feq s LEU 322 N -5.61 4.21 0.02 -2.67 1.43 -1.26 -4.81 118.68 110.00 3feq s LEU 322 Ca 0.40 1.13 0.07 0.00 -1.03 0.00 0.00 54.13 54.70 3feq s LEU 322 Cb -0.18 -3.66 -0.03 0.00 0.03 0.00 0.00 46.19 42.36 3feq s LEU 322 CO 0.54 -0.04 -0.21 -0.76 0.23 0.00 0.00 176.35 176.10 3feq s LEU 323 N -2.50 2.41 0.00 1.79 1.43 -1.26 -4.55 118.68 116.00 3feq s LEU 323 Ca 0.46 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 53.11 3feq s LEU 323 Cb -0.13 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.66 3feq s LEU 323 CO 0.20 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.66 3feq n GLY 324 N 1.84 2.05 0.16 -3.19 0.00 0.27 -2.45 105.19 103.88 3feq n GLY 324 Ca -0.16 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.43 3feq n GLY 324 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3feq h GLU 325 N 0.00 0.00 0.00 1.61 9.09 -1.88 -1.82 114.58 121.58 3feq h GLU 325 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3feq h GLU 325 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3feq h GLU 325 CO 0.00 0.00 0.00 -1.33 0.05 0.00 0.00 179.01 177.73 3feq n MET 326 N -2.41 0.27 0.27 1.06 2.81 -1.03 -3.17 117.12 114.93 3feq n MET 326 Ca 0.01 0.11 0.15 0.00 -1.81 0.00 0.00 57.70 56.16 3feq n MET 326 Cb 0.22 -1.50 0.87 0.00 -0.71 0.00 0.00 33.22 32.11 3feq n MET 326 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3feq h HIS 327 N 0.00 0.00 -0.53 2.03 3.86 -1.45 -2.69 115.15 116.37 3feq h HIS 327 Ca 0.00 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.27 3feq h HIS 327 Cb 0.10 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.54 3feq h HIS 327 CO 0.00 0.00 0.35 0.00 0.86 0.00 0.00 177.93 179.14 3feq h ALA 328 N 1.95 1.86 0.00 2.45 0.00 -1.82 -2.96 119.26 120.74 3feq h ALA 328 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3feq h ALA 328 Cb 0.11 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3feq h ALA 328 CO -0.00 0.06 0.00 1.19 0.00 0.00 0.00 179.25 180.50 3feq n PHE 329 N -4.47 0.00 -0.28 0.00 3.01 -1.01 -4.38 117.46 110.33 3feq n PHE 329 Ca 0.07 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.59 3feq n PHE 329 Cb 0.23 -0.04 0.21 0.00 -0.01 0.00 0.00 39.48 39.86 3feq n PHE 329 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 3feq h GLN 330 N 0.11 0.52 0.00 -1.08 4.15 -1.75 -1.32 115.11 115.73 3feq h GLN 330 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 3feq h GLN 330 Cb 0.22 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.79 3feq h GLN 330 CO 0.00 0.34 0.00 0.43 -1.93 0.00 0.00 178.83 177.67 3feq n SER 331 N -4.94 0.85 0.30 -0.69 7.64 -1.26 -3.24 113.62 112.29 3feq n SER 331 Ca 0.16 0.58 0.19 0.00 1.01 0.00 0.00 58.87 60.81 3feq n SER 331 Cb 0.43 -0.81 0.99 0.00 -1.01 0.00 0.00 64.21 63.81 3feq n SER 331 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3feq h GLY 332 N 4.49 0.00 2.00 0.23 0.00 -1.40 -1.88 103.07 106.51 3feq h GLY 332 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3feq h GLY 332 CO 0.00 0.00 -0.25 -2.09 0.00 0.00 0.00 176.54 174.20 3feq h GLU 333 N 0.00 0.00 0.50 4.80 4.57 -1.72 -2.57 114.58 120.16 3feq h GLU 333 Ca 0.02 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 3feq h GLU 333 Cb 0.34 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 3feq h GLU 333 CO -0.00 0.25 -0.40 0.74 -1.18 0.00 0.00 179.01 178.41 3feq h PHE 334 N 0.00 -1.09 -0.87 0.92 0.04 -1.60 -2.54 116.94 111.79 3feq h PHE 334 Ca -0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.74 3feq h PHE 334 Cb 0.61 0.41 -0.04 0.00 2.20 0.00 0.00 35.95 39.13 3feq h PHE 334 CO 0.00 -0.58 0.45 -0.09 -0.60 0.00 0.00 178.31 177.49 3feq h ARG 335 N -0.90 1.23 -0.58 1.51 2.43 -1.66 0.83 114.38 117.24 3feq h ARG 335 Ca -0.05 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 58.91 3feq h ARG 335 Cb 0.76 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 3feq h ARG 335 CO -0.01 0.92 0.18 0.82 -1.51 0.00 0.00 179.97 180.38 3feq h ILE 336 N 1.23 1.22 0.06 1.20 2.04 -1.46 -1.02 117.51 120.78 3feq h ILE 336 Ca 0.30 -0.77 -0.28 0.00 1.00 0.00 0.00 64.86 65.11 3feq h ILE 336 Cb 0.07 0.58 0.03 0.00 -0.74 0.00 0.00 36.82 36.76 3feq h ILE 336 CO -0.04 0.29 -1.14 0.03 0.00 0.00 0.00 178.15 177.29 3feq h ARG 337 N 0.85 0.67 -1.00 2.37 3.08 -1.00 -3.19 114.38 116.16 3feq h ARG 337 Ca 0.19 -0.80 0.16 0.00 0.07 0.00 0.00 59.98 59.61 3feq h ARG 337 Cb 0.25 0.24 -0.10 0.00 0.08 0.00 0.00 29.97 30.44 3feq h ARG 337 CO -0.01 1.36 0.62 0.00 -1.07 0.00 0.00 179.97 180.87 3feq h ALA 338 N 0.35 1.61 0.00 0.04 0.00 -0.38 -1.09 119.26 119.79 3feq h ALA 338 Ca -0.16 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3feq h ALA 338 Cb 1.80 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.46 3feq h ALA 338 CO 0.22 0.05 -0.08 0.93 0.00 0.00 0.00 179.25 180.38 3feq h GLU 339 N 0.85 0.00 0.00 0.00 5.08 -1.18 -3.32 114.58 116.00 3feq h GLU 339 Ca 0.55 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.68 3feq h GLU 339 Cb 0.74 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 3feq h GLU 339 CO -0.34 0.08 -1.72 0.28 -1.00 0.00 0.00 179.01 176.31 3feq n VAL 340 N -3.30 1.39 -4.12 3.13 0.31 -0.69 -4.97 118.33 110.09 3feq n VAL 340 Ca -0.01 -0.12 -0.29 0.00 -0.01 0.00 0.00 64.34 63.92 3feq n VAL 340 Cb 0.28 -2.01 -0.07 0.00 -0.91 0.00 0.00 33.84 31.13 3feq n VAL 340 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3feq s LEU 341 N -7.51 3.57 0.71 7.52 1.43 -0.50 -5.04 118.68 118.86 3feq s LEU 341 Ca -0.30 -0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 52.46 3feq s LEU 341 Cb 0.09 -2.26 -0.07 0.00 0.03 0.00 0.00 46.19 43.98 3feq s LEU 341 CO 0.40 0.14 0.26 0.61 0.23 0.00 0.00 176.35 177.99 3feq n GLY 342 N 0.24 -2.19 0.00 -3.19 0.00 -1.26 -3.90 105.19 94.89 3feq n GLY 342 Ca -0.10 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.63 3feq n GLY 342 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3feq n ASN 343 N 0.64 0.00 -0.03 1.61 6.94 -1.26 -0.88 115.26 122.28 3feq n ASN 343 Ca 0.08 -0.65 -0.13 0.00 -0.02 0.00 0.00 54.58 53.87 3feq n ASN 343 Cb 0.50 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.84 3feq n ASN 343 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3feq h LEU 344 N 0.00 0.17 -0.70 -4.53 6.46 -1.88 -3.08 115.31 111.75 3feq h LEU 344 Ca 0.00 -0.44 0.06 0.00 -0.12 0.00 0.00 57.88 57.39 3feq h LEU 344 Cb 0.00 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 39.83 3feq h LEU 344 CO 0.00 0.57 0.39 -0.08 -0.62 0.00 0.00 178.44 178.70 3feq h GLU 345 N -0.23 0.70 -0.72 1.25 4.57 -1.32 -0.90 114.58 117.93 3feq h GLU 345 Ca 0.02 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 3feq h GLU 345 Cb 0.51 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.91 3feq h GLU 345 CO 0.01 0.46 0.37 0.00 -1.18 0.00 0.00 179.01 178.67 3feq h ALA 346 N 1.36 1.29 0.00 2.92 0.00 -1.57 -2.00 119.26 121.26 3feq h ALA 346 Ca 0.31 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 3feq h ALA 346 Cb 0.20 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3feq h ALA 346 CO -0.19 0.56 -0.88 -0.07 0.00 0.00 0.00 179.25 178.68 3feq h LEU 347 N 1.02 0.00 -1.02 0.00 3.38 -1.34 -3.13 115.31 114.22 3feq h LEU 347 Ca 0.25 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 3feq h LEU 347 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3feq h LEU 347 CO -0.04 0.88 0.12 0.03 0.09 0.00 0.00 178.44 179.52 3feq h ARG 348 N 0.00 0.83 0.00 1.13 3.08 -0.63 -2.96 114.38 115.83 3feq h ARG 348 Ca -0.01 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 3feq h ARG 348 Cb 1.57 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.49 3feq h ARG 348 CO 0.11 0.75 -0.27 0.66 -1.07 0.00 0.00 179.97 180.16 3feq h SER 349 N 0.80 0.00 -0.56 7.04 4.64 -1.32 -1.61 113.55 122.53 3feq h SER 349 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3feq h SER 349 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3feq h SER 349 CO 0.00 0.27 0.00 0.00 -0.87 0.00 0.00 176.83 176.23 3feq n ALA 350 N -2.39 2.40 -1.38 5.18 0.00 -1.14 -1.03 120.51 122.15 3feq n ALA 350 Ca -0.02 -1.15 0.00 0.00 0.00 0.00 0.00 53.44 52.28 3feq n ALA 350 Cb 0.35 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3feq n ALA 350 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3feq n THR 351 N 1.58 0.00 -0.08 0.00 -2.24 -0.68 -0.15 114.28 112.71 3feq n THR 351 Ca 0.22 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.87 3feq n THR 351 Cb 0.62 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.80 3feq n THR 351 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3feq h THR 352 N 0.00 1.31 -0.64 4.28 1.35 -1.45 0.99 112.91 118.75 3feq h THR 352 Ca 0.00 -1.35 -0.07 0.00 -0.55 0.00 0.00 66.41 64.44 3feq h THR 352 Cb 0.00 1.63 -0.03 0.00 -1.73 0.00 0.00 68.15 68.03 3feq h THR 352 CO 0.00 0.42 0.13 0.58 -0.25 0.00 0.00 175.52 176.40 3feq h VAL 353 N 0.30 1.25 -0.30 6.82 2.07 -1.64 -2.66 116.25 122.09 3feq h VAL 353 Ca 0.05 -0.96 -0.14 0.00 0.82 0.00 0.00 66.70 66.46 3feq h VAL 353 Cb 0.75 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 3feq h VAL 353 CO 0.05 0.36 -0.37 0.00 0.02 0.00 0.00 177.57 177.64 3feq h ALA 354 N 1.17 0.45 -0.42 1.67 0.00 -1.58 -1.81 119.26 118.75 3feq h ALA 354 Ca 0.20 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3feq h ALA 354 Cb 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3feq h ALA 354 CO 0.01 0.53 0.21 0.00 0.00 0.00 0.00 179.25 180.00 3feq h ALA 355 N 0.70 1.59 -0.30 0.00 0.00 -0.80 -1.16 119.26 119.29 3feq h ALA 355 Ca 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3feq h ALA 355 Cb 0.96 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3feq h ALA 355 CO 0.09 0.34 0.11 1.49 0.00 0.00 0.00 179.25 181.28 3feq h GLU 356 N 0.58 0.45 0.02 0.00 4.81 -1.15 0.92 114.58 120.20 3feq h GLU 356 Ca 0.15 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.31 3feq h GLU 356 Cb 0.05 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 3feq h GLU 356 CO -0.02 0.48 -0.13 0.82 -0.73 0.00 0.00 179.01 179.43 3feq h ILE 357 N 0.33 0.69 0.00 2.32 2.04 -0.39 0.89 117.51 123.40 3feq h ILE 357 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.96 3feq h ILE 357 Cb 0.20 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3feq h ILE 357 CO -0.01 0.00 0.00 1.33 0.00 0.00 0.00 178.15 179.47 3feq n VAL 358 N -5.25 0.00 -3.33 1.67 0.24 -0.57 -4.87 118.33 106.21 3feq n VAL 358 Ca -0.06 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 62.06 3feq n VAL 358 Cb 0.18 -0.18 0.07 0.00 -1.47 0.00 0.00 33.84 32.43 3feq n VAL 358 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3feq n ASN 359 N -0.61 -4.59 -0.40 -1.34 3.02 0.31 -4.97 115.26 106.69 3feq n ASN 359 Ca 0.04 -0.46 0.03 0.00 -0.03 0.00 0.00 54.58 54.16 3feq n ASN 359 Cb 0.02 -4.23 0.04 0.00 -0.61 0.00 0.00 39.78 35.00 3feq n ASN 359 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3feq n MET 360 N -4.01 0.34 -3.14 3.52 2.81 0.31 -5.00 117.12 111.95 3feq n MET 360 Ca -0.06 -1.44 -0.33 0.00 -1.81 0.00 0.00 57.70 54.06 3feq n MET 360 Cb 0.57 -0.76 -0.06 0.00 -0.71 0.00 0.00 33.22 32.26 3feq n MET 360 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 3feq s GLN 361 N -0.77 4.05 0.00 0.03 -2.07 -1.18 0.13 119.66 119.84 3feq s GLN 361 Ca 0.09 0.69 0.00 0.00 -1.82 0.00 0.00 55.36 54.32 3feq s GLN 361 Cb 0.08 -2.54 0.00 0.00 -1.09 0.00 0.00 33.01 29.46 3feq s GLN 361 CO 0.01 0.22 0.00 0.41 -1.32 0.00 0.00 175.29 174.60 3feq n GLY 362 N -0.12 1.88 0.10 2.60 0.00 -1.26 -4.78 105.19 103.61 3feq n GLY 362 Ca 0.02 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 3feq n GLY 362 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3feq h GLN 363 N 0.00 0.00 -5.39 1.61 7.50 -1.19 -3.36 115.11 114.28 3feq h GLN 363 Ca 0.00 -0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.59 3feq h GLN 363 Cb 0.00 0.00 -0.13 0.00 0.05 0.00 0.00 27.48 27.40 3feq h GLN 363 CO 0.00 1.00 -0.59 -0.51 -1.50 0.00 0.00 178.83 177.23 3feq s LEU 364 N -7.87 2.46 0.00 1.46 1.43 0.34 -0.67 118.68 115.84 3feq s LEU 364 Ca -0.29 -1.42 0.00 0.00 -1.03 0.00 0.00 54.13 51.40 3feq s LEU 364 Cb 0.06 -0.61 0.00 0.00 0.03 0.00 0.00 46.19 45.67 3feq s LEU 364 CO 0.59 -0.58 0.00 0.61 0.23 0.00 0.00 176.35 177.20 3feq n GLY 365 N -0.87 0.80 3.19 -3.19 0.00 -1.26 -4.41 105.19 99.45 3feq n GLY 365 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 3feq n GLY 365 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3feq s VAL 366 N -3.20 -0.02 -0.82 1.61 0.11 -1.26 -3.72 120.40 113.09 3feq s VAL 366 Ca 0.00 0.07 -0.22 0.00 -2.93 0.00 0.00 61.98 58.90 3feq s VAL 366 Cb 0.00 -0.49 0.08 0.00 -1.53 0.00 0.00 36.38 34.44 3feq s VAL 366 CO 0.00 0.03 1.16 -0.63 -3.33 0.00 0.00 175.10 172.32 3feq s ILE 367 N 0.86 4.28 0.20 7.04 1.01 -1.26 -4.81 121.20 128.51 3feq s ILE 367 Ca -0.06 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 3feq s ILE 367 Cb -0.06 -4.82 -0.04 0.00 0.01 0.00 0.00 42.46 37.54 3feq s ILE 367 CO -0.06 -1.63 0.11 0.00 0.00 0.00 0.00 174.94 173.36 3feq s ALA 368 N 4.08 1.21 0.13 9.38 0.00 -1.26 -5.04 121.76 130.25 3feq s ALA 368 Ca 0.32 -1.68 -0.31 0.00 0.00 0.00 0.00 51.96 50.29 3feq s ALA 368 Cb -0.09 1.21 -0.09 0.00 0.00 0.00 0.00 23.12 24.16 3feq s ALA 368 CO 0.01 -0.54 1.46 0.08 0.00 0.00 0.00 175.76 176.77 3feq s VAL 369 N -4.06 3.08 0.00 0.00 1.01 -1.26 -3.06 120.40 116.11 3feq s VAL 369 Ca 0.36 0.76 0.00 0.00 0.00 0.00 0.00 61.98 63.09 3feq s VAL 369 Cb 0.07 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.97 3feq s VAL 369 CO 0.10 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.86 3feq n GLY 370 N 3.61 0.94 3.85 4.51 0.00 0.33 -5.00 105.19 113.43 3feq n GLY 370 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 3feq n GLY 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq s ALA 371 N -2.37 2.86 0.15 4.61 0.00 -1.17 -4.76 121.76 121.08 3feq s ALA 371 Ca 0.00 -0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.60 3feq s ALA 371 Cb 0.00 -3.11 -0.07 0.00 0.00 0.00 0.00 23.12 19.94 3feq s ALA 371 CO 0.00 -1.02 1.05 0.42 0.00 0.00 0.00 175.76 176.21 3feq s ILE 372 N -3.15 4.09 -1.18 0.00 1.01 0.16 -0.73 121.20 121.39 3feq s ILE 372 Ca 0.57 1.78 -0.17 0.00 0.00 0.00 0.00 60.65 62.83 3feq s ILE 372 Cb -0.12 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 3feq s ILE 372 CO 0.54 0.29 2.13 0.00 0.00 0.00 0.00 174.94 177.90 3feq n ALA 373 N 2.53 4.70 -3.51 9.38 0.00 0.19 -4.79 120.51 129.02 3feq n ALA 373 Ca 0.03 -3.61 -0.42 0.00 0.00 0.00 0.00 53.44 49.44 3feq n ALA 373 Cb 0.47 -3.56 -0.07 0.00 0.00 0.00 0.00 19.45 16.29 3feq n ALA 373 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3feq s ASP 374 N 3.89 5.93 0.17 0.00 1.11 -1.26 -2.17 116.67 124.34 3feq s ASP 374 Ca 0.52 -2.34 0.10 0.00 0.18 0.00 0.00 52.55 51.01 3feq s ASP 374 Cb 0.14 -2.05 -0.04 0.00 1.07 0.00 0.00 42.92 42.04 3feq s ASP 374 CO -0.01 -0.60 -0.20 -0.76 1.18 0.00 0.00 175.17 174.79 3feq s LEU 375 N 0.72 2.61 -0.06 1.23 2.01 -0.44 0.67 118.68 125.43 3feq s LEU 375 Ca 0.11 -0.72 0.06 0.00 0.01 0.00 0.00 54.13 53.59 3feq s LEU 375 Cb -0.21 -1.37 -0.01 0.00 0.01 0.00 0.00 46.19 44.61 3feq s LEU 375 CO -0.03 0.14 -0.24 -0.69 1.01 0.00 0.00 176.35 176.54 3feq s VAL 376 N -1.49 1.96 -0.20 -1.59 1.01 0.15 -0.43 120.40 119.81 3feq s VAL 376 Ca 0.20 -1.01 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 3feq s VAL 376 Cb -0.09 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 3feq s VAL 376 CO 0.11 0.55 0.06 -0.69 0.00 0.00 0.00 175.10 175.12 3feq s VAL 377 N -0.10 4.59 -0.14 2.92 1.01 0.13 -1.73 120.40 127.07 3feq s VAL 377 Ca -0.04 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.84 3feq s VAL 377 Cb -0.14 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.18 3feq s VAL 377 CO 0.04 0.42 -0.14 -0.22 0.00 0.00 0.00 175.10 175.20 3feq s LEU 378 N 0.75 1.66 -1.03 3.92 2.96 0.22 -2.22 118.68 124.94 3feq s LEU 378 Ca 0.03 -0.46 -0.23 0.00 -0.22 0.00 0.00 54.13 53.26 3feq s LEU 378 Cb -0.13 -1.13 0.02 0.00 0.50 0.00 0.00 46.19 45.45 3feq s LEU 378 CO 0.02 -0.04 1.63 -0.62 -1.32 0.00 0.00 176.35 176.02 3feq s ASP 379 N 1.37 6.12 0.00 3.68 2.15 -0.45 -0.62 116.67 128.92 3feq s ASP 379 Ca 0.02 -1.37 0.00 0.00 0.43 0.00 0.00 52.55 51.63 3feq s ASP 379 Cb -0.13 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 3feq s ASP 379 CO -0.08 -1.87 0.00 0.61 -0.17 0.00 0.00 175.17 173.66 3feq n GLY 380 N 6.66 0.92 3.15 2.66 0.00 -1.26 -4.96 105.19 112.36 3feq n GLY 380 Ca 0.37 -2.22 -0.34 0.00 0.00 0.00 0.00 46.02 43.83 3feq n GLY 380 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3feq s ASN 381 N -0.01 4.81 0.53 1.61 2.47 -1.26 -3.81 114.94 119.28 3feq s ASN 381 Ca 0.00 -1.34 0.24 0.00 0.42 0.00 0.00 52.86 52.18 3feq s ASN 381 Cb 0.00 -1.68 1.46 0.00 -1.45 0.00 0.00 41.25 39.58 3feq s ASN 381 CO 0.00 -0.26 2.12 1.55 -3.72 0.00 0.00 177.10 176.79 3feq h PRO 382 N 7.95 0.00 0.00 0.43 0.13 -1.95 -2.03 132.00 136.53 3feq h PRO 382 Ca -0.20 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.91 3feq h PRO 382 Cb 1.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 3feq h PRO 382 CO 0.52 0.09 -0.07 -0.07 -0.23 0.00 0.00 178.00 178.24 3feq h LEU 383 N 0.00 0.00 0.00 1.56 4.07 -1.93 -3.22 115.31 115.79 3feq h LEU 383 Ca -0.00 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.77 3feq h LEU 383 Cb 0.20 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.91 3feq h LEU 383 CO 0.01 0.07 -1.67 -0.62 -1.08 0.00 0.00 178.44 175.15 3feq n GLU 384 N -3.74 0.27 -3.65 1.13 1.02 -1.07 -4.76 120.64 109.83 3feq n GLU 384 Ca -0.02 0.09 -0.39 0.00 -0.02 0.00 0.00 57.16 56.82 3feq n GLU 384 Cb 0.17 -1.06 -0.10 0.00 -0.02 0.00 0.00 31.44 30.43 3feq n GLU 384 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3feq s ASP 385 N -5.67 5.51 0.61 1.62 2.15 -0.79 -4.94 116.67 115.16 3feq s ASP 385 Ca -0.16 -1.72 0.38 0.00 0.43 0.00 0.00 52.55 51.48 3feq s ASP 385 Cb 0.05 -1.94 1.97 0.00 -0.30 0.00 0.00 42.92 42.71 3feq s ASP 385 CO 0.24 -0.56 2.22 -0.29 -0.17 0.00 0.00 175.17 176.60 3feq h ILE 386 N 6.19 0.11 -0.10 4.11 6.09 -1.82 -2.63 117.51 129.46 3feq h ILE 386 Ca -0.20 -0.22 0.03 0.00 -1.37 0.00 0.00 64.86 63.10 3feq h ILE 386 Cb 1.07 1.19 -0.00 0.00 0.47 0.00 0.00 36.82 39.55 3feq h ILE 386 CO 0.75 0.02 0.16 1.23 -3.07 0.00 0.00 178.15 177.25 3feq h GLY 387 N 0.69 0.00 2.00 8.18 0.00 -1.92 -1.91 103.07 110.12 3feq h GLY 387 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3feq h GLY 387 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 3feq n VAL 388 N -3.52 0.75 -0.02 4.60 0.24 -0.99 -2.89 118.33 116.50 3feq n VAL 388 Ca -0.00 0.16 -0.02 0.00 -2.04 0.00 0.00 64.34 62.43 3feq n VAL 388 Cb 0.26 -0.92 -0.03 0.00 -1.47 0.00 0.00 33.84 31.68 3feq n VAL 388 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 3feq n VAL 389 N -1.74 0.28 0.09 3.34 0.31 -0.78 -4.42 118.33 115.42 3feq n VAL 389 Ca 0.04 -0.16 0.02 0.00 -0.01 0.00 0.00 64.34 64.23 3feq n VAL 389 Cb 0.23 -0.86 0.19 0.00 -0.91 0.00 0.00 33.84 32.49 3feq n VAL 389 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3feq n ALA 390 N -2.24 3.22 -1.39 3.52 0.00 -0.81 -4.19 120.51 118.62 3feq n ALA 390 Ca -0.07 -0.94 0.03 0.00 0.00 0.00 0.00 53.44 52.46 3feq n ALA 390 Cb 0.63 -1.07 0.20 0.00 0.00 0.00 0.00 19.45 19.21 3feq n ALA 390 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3feq n ASP 391 N 0.26 2.37 -2.84 0.00 -0.08 -1.20 -4.20 116.55 110.86 3feq n ASP 391 Ca 0.14 -3.63 -0.01 0.00 -1.51 0.00 0.00 54.79 49.78 3feq n ASP 391 Cb 0.73 -0.56 -0.01 0.00 2.34 0.00 0.00 41.12 43.62 3feq n ASP 391 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 3feq n GLU 392 N -1.10 -2.78 0.00 -0.67 2.13 -1.26 -3.80 120.64 113.16 3feq n GLU 392 Ca 0.25 2.33 0.00 0.00 0.66 0.00 0.00 57.16 60.40 3feq n GLU 392 Cb 0.85 -4.03 0.00 0.00 0.27 0.00 0.00 31.44 28.53 3feq n GLU 392 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3feq n GLY 393 N 1.11 0.55 4.63 8.31 0.00 -1.26 -4.81 105.19 113.72 3feq n GLY 393 Ca -0.06 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.54 3feq n GLY 393 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq n ALA 394 N 4.92 0.00 -0.81 4.61 0.00 -1.25 -2.57 120.51 125.41 3feq n ALA 394 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3feq n ALA 394 Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.70 3feq n ALA 394 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3feq n ARG 395 N 0.00 3.07 -3.78 0.00 0.63 -1.26 -4.88 116.66 110.43 3feq n ARG 395 Ca 0.00 -2.71 -0.37 0.00 -0.92 0.00 0.00 57.85 53.85 3feq n ARG 395 Cb 0.00 -1.76 -0.13 0.00 0.45 0.00 0.00 32.46 31.02 3feq n ARG 395 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3feq s VAL 396 N -2.42 3.82 -0.43 5.15 0.11 -1.06 -1.34 120.40 124.23 3feq s VAL 396 Ca 0.39 -0.77 0.16 0.00 -2.93 0.00 0.00 61.98 58.84 3feq s VAL 396 Cb 0.30 -2.99 -0.20 0.00 -1.53 0.00 0.00 36.38 31.96 3feq s VAL 396 CO 0.11 0.07 0.53 -1.84 -3.33 0.00 0.00 175.10 170.64 3feq n GLU 397 N 4.84 1.25 -4.12 1.54 0.00 -0.94 -4.59 120.64 118.61 3feq n GLU 397 Ca -0.15 -0.06 -0.16 0.00 0.00 0.00 0.00 57.16 56.79 3feq n GLU 397 Cb 0.48 -1.30 -0.15 0.00 0.00 0.00 0.00 31.44 30.47 3feq n GLU 397 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 3feq s TYR 398 N -2.75 0.44 -0.08 -1.84 2.02 -1.19 -0.92 117.35 113.01 3feq s TYR 398 Ca 0.01 -0.08 0.01 0.00 -0.37 0.00 0.00 57.07 56.64 3feq s TYR 398 Cb 0.11 -0.30 0.02 0.00 -0.40 0.00 0.00 41.96 41.39 3feq s TYR 398 CO 0.65 -0.02 -0.09 0.08 -1.57 0.00 0.00 175.55 174.60 3feq s VAL 399 N 0.00 1.01 -0.11 0.71 1.01 -1.00 -0.69 120.40 121.33 3feq s VAL 399 Ca 0.00 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.64 3feq s VAL 399 Cb -0.03 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 3feq s VAL 399 CO -0.00 0.34 -0.15 -0.76 0.00 0.00 0.00 175.10 174.53 3feq s LEU 400 N 1.11 2.61 -0.11 3.92 1.02 0.42 -0.93 118.68 126.73 3feq s LEU 400 Ca -0.06 -0.34 0.01 0.00 0.02 0.00 0.00 54.13 53.76 3feq s LEU 400 Cb -0.14 -1.56 0.02 0.00 0.02 0.00 0.00 46.19 44.52 3feq s LEU 400 CO -0.01 0.21 -0.11 -1.58 0.02 0.00 0.00 176.35 174.87 3feq s GLN 401 N 0.10 1.84 -1.01 1.70 0.74 0.85 -1.33 119.66 122.56 3feq s GLN 401 Ca -0.07 -0.41 -0.20 0.00 0.05 0.00 0.00 55.36 54.73 3feq s GLN 401 Cb -0.15 -1.69 0.03 0.00 1.10 0.00 0.00 33.01 32.30 3feq s GLN 401 CO 0.05 -0.15 0.61 0.54 -0.55 0.00 0.00 175.29 175.80 3feq n ARG 402 N 4.48 -0.73 0.00 1.67 1.74 -0.92 -1.87 116.66 121.02 3feq n ARG 402 Ca -0.17 0.30 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 3feq n ARG 402 Cb 0.51 -2.19 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 3feq n ARG 402 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3feq n GLY 403 N -1.87 2.10 3.77 -0.13 0.00 -1.02 -4.51 105.19 103.53 3feq n GLY 403 Ca -0.19 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 3feq n GLY 403 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3feq s THR 404 N 0.00 3.06 -0.13 2.61 -1.32 -0.78 -4.92 115.64 114.16 3feq s THR 404 Ca 0.00 0.59 -0.23 0.00 -1.21 0.00 0.00 61.69 60.84 3feq s THR 404 Cb 0.00 -3.17 -0.03 0.00 -1.51 0.00 0.00 72.50 67.79 3feq s THR 404 CO 0.00 -0.21 0.72 -0.22 -2.21 0.00 0.00 174.62 172.70 3feq s LEU 405 N -4.29 4.23 -0.04 9.08 2.96 -1.26 -0.10 118.68 129.26 3feq s LEU 405 Ca 0.71 1.10 0.06 0.00 -0.22 0.00 0.00 54.13 55.78 3feq s LEU 405 Cb -0.24 -3.08 -0.09 0.00 0.50 0.00 0.00 46.19 43.28 3feq s LEU 405 CO 0.34 -0.24 0.07 0.52 -1.32 0.00 0.00 176.35 175.72 3feq n VAL 406 N 4.28 0.25 -4.39 1.68 0.31 -0.11 -4.95 118.33 115.40 3feq n VAL 406 Ca 0.00 -0.21 -0.23 0.00 -0.01 0.00 0.00 64.34 63.89 3feq n VAL 406 Cb 0.50 -0.35 -0.16 0.00 -0.91 0.00 0.00 33.84 32.92 3feq n VAL 406 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3feq s LYS 407 N -2.28 1.31 -0.22 5.55 -0.14 -1.13 -4.98 119.74 117.85 3feq s LYS 407 Ca -0.03 -0.27 0.01 0.00 -1.36 0.00 0.00 55.97 54.32 3feq s LYS 407 Cb 0.03 -1.15 0.05 0.00 -1.68 0.00 0.00 37.83 35.08 3feq s LYS 407 CO 0.26 -0.02 -0.09 0.50 -0.76 0.00 0.00 175.35 175.24 3feq s ARG 408 N 0.78 1.94 0.00 1.68 3.52 -1.26 -2.38 118.95 123.23 3feq s ARG 408 Ca -0.13 -0.98 0.00 0.00 -0.13 0.00 0.00 55.73 54.50 3feq s ARG 408 Cb -0.15 -2.55 0.00 0.00 -1.56 0.00 0.00 34.95 30.68 3feq s ARG 408 CO 0.02 -0.51 0.25 1.04 -0.81 0.00 0.00 175.30 175.29