#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 0.01 0.02 2.28 2.07 -1.26 -3.09 121.20 121.23 3feq s ILE 3 Ca 0.00 -0.08 0.00 0.00 -1.41 0.00 0.00 60.65 59.16 3feq s ILE 3 Cb 0.00 -0.91 -0.02 0.00 0.13 0.00 0.00 42.46 41.66 3feq s ILE 3 CO 0.00 -0.05 -0.03 -0.89 -1.91 0.00 0.00 174.94 172.06 3feq s THR 4 N -0.96 0.14 -0.11 4.00 2.01 0.13 -2.27 115.64 118.57 3feq s THR 4 Ca -0.10 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.15 3feq s THR 4 Cb -0.02 -0.25 0.03 0.00 0.01 0.00 0.00 72.50 72.27 3feq s THR 4 CO 0.07 -0.38 -0.06 -0.69 -0.69 0.00 0.00 174.62 172.87 3feq s VAL 5 N -1.16 0.96 -0.28 3.82 1.01 -0.75 0.49 120.40 124.50 3feq s VAL 5 Ca -0.12 -0.27 -0.26 0.00 0.00 0.00 0.00 61.98 61.32 3feq s VAL 5 Cb -0.08 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.30 3feq s VAL 5 CO -0.01 0.33 0.92 -0.76 0.00 0.00 0.00 175.10 175.59 3feq s LEU 6 N 1.73 4.05 -0.14 3.92 2.01 -0.52 -1.15 118.68 128.59 3feq s LEU 6 Ca 0.05 1.01 -0.02 0.00 0.01 0.00 0.00 54.13 55.17 3feq s LEU 6 Cb -0.13 -3.32 -0.03 0.00 0.01 0.00 0.00 46.19 42.73 3feq s LEU 6 CO -0.08 -0.66 -0.06 0.00 1.01 0.00 0.00 176.35 176.56 3feq s GLN 7 N 3.14 3.47 -0.84 1.70 -2.07 -0.80 -0.70 119.66 123.57 3feq s GLN 7 Ca 0.39 -0.55 0.00 0.00 -1.82 0.00 0.00 55.36 53.38 3feq s GLN 7 Cb -0.14 -2.81 0.00 0.00 -1.09 0.00 0.00 33.01 28.96 3feq s GLN 7 CO 0.10 0.31 0.00 0.41 -1.32 0.00 0.00 175.29 174.79 3feq n GLY 8 N 3.30 0.37 3.83 2.60 0.00 -1.25 -1.60 105.19 112.44 3feq n GLY 8 Ca -0.18 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.70 1.82 -1.10 -0.02 0.00 -0.66 -3.81 107.32 100.86 3feq s GLY 9 Ca 0.00 0.15 -0.13 0.00 0.00 0.00 0.00 44.72 44.73 3feq s GLY 9 CO 0.00 0.45 1.23 -1.31 0.00 0.00 0.00 173.10 173.46 3feq s ASN 10 N -3.52 7.04 -0.16 1.64 0.02 -0.99 -0.84 114.94 118.13 3feq s ASN 10 Ca 0.59 -2.98 -0.29 0.00 -1.02 0.00 0.00 52.86 49.16 3feq s ASN 10 Cb -0.14 -2.33 -0.05 0.00 0.02 0.00 0.00 41.25 38.76 3feq s ASN 10 CO 0.48 -0.65 1.88 -0.69 0.02 0.00 0.00 177.10 178.14 3feq s VAL 11 N 0.82 3.32 -0.12 1.60 1.01 -0.70 -3.11 120.40 123.22 3feq s VAL 11 Ca 0.35 0.36 -0.29 0.00 0.00 0.00 0.00 61.98 62.40 3feq s VAL 11 Cb -0.06 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 3feq s VAL 11 CO -0.05 -0.14 1.43 -0.22 0.00 0.00 0.00 175.10 176.12 3feq s LEU 12 N 5.94 4.24 -0.21 3.92 0.20 -0.68 -1.49 118.68 130.61 3feq s LEU 12 Ca 0.84 1.93 -0.07 0.00 0.69 0.00 0.00 54.13 57.52 3feq s LEU 12 Cb -0.32 -3.54 -0.03 0.00 -0.43 0.00 0.00 46.19 41.88 3feq s LEU 12 CO 0.34 -0.83 0.05 -0.62 -0.29 0.00 0.00 176.35 175.00 3feq s ASP 13 N 2.57 5.23 -0.09 3.68 -1.08 -1.01 -4.76 116.67 121.21 3feq s ASP 13 Ca 0.63 -0.10 0.16 0.00 -0.52 0.00 0.00 52.55 52.72 3feq s ASP 13 Cb -0.27 -1.91 -0.23 0.00 -1.46 0.00 0.00 42.92 39.05 3feq s ASP 13 CO 0.21 0.06 0.44 0.18 0.52 0.00 0.00 175.17 176.58 3feq n LEU 14 N 4.27 0.44 0.24 -1.34 4.77 -1.26 -1.72 117.00 122.39 3feq n LEU 14 Ca -0.16 0.20 0.13 0.00 -0.03 0.00 0.00 56.01 56.15 3feq n LEU 14 Cb 0.52 0.27 0.39 0.00 -2.33 0.00 0.00 43.42 42.27 3feq n LEU 14 CO 0.33 0.35 0.85 1.05 -1.33 0.00 0.00 177.39 178.64 3feq h GLU 15 N 0.00 0.00 0.00 3.23 9.09 -1.98 -3.26 114.58 121.66 3feq h GLU 15 Ca -0.35 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 58.72 3feq h GLU 15 Cb 1.94 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 28.98 3feq h GLU 15 CO 0.05 0.08 -2.31 0.54 0.05 0.00 0.00 179.01 177.41 3feq n ARG 16 N -3.15 0.85 -0.83 1.06 1.74 -1.25 -5.03 116.66 110.05 3feq n ARG 16 Ca 0.02 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 3feq n ARG 16 Cb 0.45 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 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 1.80 1.07 2.96 -0.13 0.00 -0.70 -5.08 105.19 105.12 3feq n GLY 17 Ca -0.31 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.00 0.35 0.39 1.61 -7.23 -1.03 -5.03 120.40 107.46 3feq s VAL 18 Ca 0.00 -0.36 -0.27 0.00 -1.81 0.00 0.00 61.98 59.54 3feq s VAL 18 Cb 0.00 -0.33 -0.09 0.00 0.56 0.00 0.00 36.38 36.51 3feq s VAL 18 CO 0.00 -0.01 1.36 -0.76 -0.31 0.00 0.00 175.10 175.38 3feq s LEU 19 N -0.40 4.27 -0.49 1.32 1.43 -1.26 -2.41 118.68 121.14 3feq s LEU 19 Ca -0.01 2.78 0.01 0.00 -1.03 0.00 0.00 54.13 55.88 3feq s LEU 19 Cb -0.03 -3.80 0.13 0.00 0.03 0.00 0.00 46.19 42.52 3feq s LEU 19 CO -0.00 -0.82 0.25 -0.76 0.23 0.00 0.00 176.35 175.25 3feq s LEU 20 N -2.25 4.81 0.58 1.79 1.43 -0.55 -4.95 118.68 119.54 3feq s LEU 20 Ca 0.55 -2.63 -0.19 0.00 -1.03 0.00 0.00 54.13 50.83 3feq s LEU 20 Cb -0.41 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 3feq s LEU 20 CO 0.54 -0.35 1.19 -1.83 0.23 0.00 0.00 176.35 176.13 3feq s GLU 21 N 0.26 3.05 -1.07 1.70 1.03 -1.26 -1.72 118.70 120.69 3feq s GLU 21 Ca 0.14 1.78 -0.04 0.00 0.03 0.00 0.00 54.97 56.88 3feq s GLU 21 Cb -0.22 -1.95 0.03 0.00 -0.80 0.00 0.00 34.13 31.19 3feq s GLU 21 CO -0.03 -1.13 0.20 0.72 -1.33 0.00 0.00 175.26 173.69 3feq n HIS 22 N -1.54 -1.61 -3.20 4.83 8.25 -0.49 -4.89 115.22 116.57 3feq n HIS 22 Ca 0.13 0.19 -0.39 0.00 -0.26 0.00 0.00 57.72 57.39 3feq n HIS 22 Cb 0.50 -2.74 -0.06 0.00 1.12 0.00 0.00 29.99 28.81 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 -2.70 3.51 0.34 4.41 3.76 -0.02 -4.44 115.29 120.16 3feq s HIS 23 Ca 0.16 1.00 -0.19 0.00 -0.15 0.00 0.00 55.06 55.88 3feq s HIS 23 Cb -0.08 -2.66 -0.10 0.00 1.11 0.00 0.00 32.58 30.85 3feq s HIS 23 CO 0.19 0.10 0.83 -1.01 -0.85 0.00 0.00 174.74 174.00 3feq s HIS 24 N 0.86 3.43 -0.10 1.40 3.76 0.38 -1.65 115.29 123.36 3feq s HIS 24 Ca 0.30 1.45 0.01 0.00 -0.15 0.00 0.00 55.06 56.67 3feq s HIS 24 Cb -0.16 -2.70 0.02 0.00 1.11 0.00 0.00 32.58 30.84 3feq s HIS 24 CO 0.13 0.07 -0.11 0.54 -0.85 0.00 0.00 174.74 174.52 3feq s VAL 25 N -1.94 1.24 -0.26 -0.90 0.11 0.12 -1.36 120.40 117.41 3feq s VAL 25 Ca 0.55 -0.46 -0.07 0.00 -2.93 0.00 0.00 61.98 59.06 3feq s VAL 25 Cb -0.12 -1.18 -0.02 0.00 -1.53 0.00 0.00 36.38 33.54 3feq s VAL 25 CO 0.17 0.39 0.07 -0.69 -3.33 0.00 0.00 175.10 171.71 3feq s VAL 26 N 1.25 4.16 -0.20 2.04 1.01 0.58 -1.44 120.40 127.80 3feq s VAL 26 Ca -0.03 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 3feq s VAL 26 Cb -0.14 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 3feq s VAL 26 CO -0.04 0.28 0.07 -0.63 0.00 0.00 0.00 175.10 174.78 3feq s ILE 27 N 1.58 4.77 -0.09 2.22 -1.09 0.18 -0.46 121.20 128.31 3feq s ILE 27 Ca 0.05 -0.04 0.01 0.00 -2.23 0.00 0.00 60.65 58.45 3feq s ILE 27 Cb -0.16 -3.17 0.02 0.00 -1.58 0.00 0.00 42.46 37.58 3feq s ILE 27 CO 0.03 0.44 -0.10 -0.62 -1.23 0.00 0.00 174.94 173.45 3feq s ASP 28 N 0.58 1.97 1.74 3.58 -1.08 -0.61 0.17 116.67 123.03 3feq s ASP 28 Ca 0.04 -0.30 0.00 0.00 -0.52 0.00 0.00 52.55 51.76 3feq s ASP 28 Cb -0.13 -0.84 0.00 0.00 -1.46 0.00 0.00 42.92 40.49 3feq s ASP 28 CO 0.01 -0.04 0.00 0.61 0.52 0.00 0.00 175.17 176.27 3feq n GLY 29 N 4.36 3.07 0.52 2.66 0.00 -1.18 -2.41 105.19 112.21 3feq n GLY 29 Ca -0.18 0.07 0.05 0.00 0.00 0.00 0.00 46.02 45.96 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 9.18 1.87 -4.90 1.61 1.02 -1.26 -4.17 120.64 123.98 3feq n GLU 30 Ca 0.00 -1.64 -0.29 0.00 -0.02 0.00 0.00 57.16 55.22 3feq n GLU 30 Cb 0.00 -1.23 -0.15 0.00 -0.02 0.00 0.00 31.44 30.04 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 -0.94 1.72 -0.32 3.49 0.52 -1.01 0.11 118.95 122.52 3feq s ARG 31 Ca 0.18 -0.99 -0.29 0.00 -0.52 0.00 0.00 55.73 54.10 3feq s ARG 31 Cb 0.10 -1.81 0.01 0.00 0.52 0.00 0.00 34.95 33.76 3feq s ARG 31 CO 0.14 0.48 1.25 0.42 0.02 0.00 0.00 175.30 177.60 3feq s ILE 32 N -0.74 4.21 -0.11 1.52 1.01 -0.27 -1.57 121.20 125.25 3feq s ILE 32 Ca 0.10 1.37 0.09 0.00 0.00 0.00 0.00 60.65 62.21 3feq s ILE 32 Cb -0.09 -4.24 -0.24 0.00 0.01 0.00 0.00 42.46 37.90 3feq s ILE 32 CO 0.01 -0.52 0.39 0.52 0.00 0.00 0.00 174.94 175.34 3feq n VAL 33 N 6.20 1.58 -3.71 2.92 0.31 0.39 0.45 118.33 126.48 3feq n VAL 33 Ca 0.14 -0.76 -0.12 0.00 -0.01 0.00 0.00 64.34 63.59 3feq n VAL 33 Cb 0.47 -1.07 -0.10 0.00 -0.91 0.00 0.00 33.84 32.22 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 -2.56 0.45 -0.20 5.55 2.02 -1.19 -4.77 118.70 118.00 3feq s GLU 34 Ca -0.12 0.70 0.01 0.00 0.02 0.00 0.00 54.97 55.58 3feq s GLU 34 Cb 0.07 0.11 0.03 0.00 0.10 0.00 0.00 34.13 34.45 3feq s GLU 34 CO 0.79 -0.11 -0.16 0.08 0.02 0.00 0.00 175.26 175.89 3feq s VAL 35 N 0.82 1.96 -0.07 2.63 1.01 -1.26 -0.31 120.40 125.18 3feq s VAL 35 Ca -0.05 -1.05 -0.28 0.00 0.00 0.00 0.00 61.98 60.60 3feq s VAL 35 Cb -0.06 -1.87 0.06 0.00 0.00 0.00 0.00 36.38 34.51 3feq s VAL 35 CO -0.06 0.36 0.63 0.28 0.00 0.00 0.00 175.10 176.31 3feq s THR 36 N 1.29 0.01 -1.11 3.92 -1.32 -0.46 -4.98 115.64 112.99 3feq s THR 36 Ca 0.01 -0.06 0.13 0.00 -1.21 0.00 0.00 61.69 60.56 3feq s THR 36 Cb -0.15 -0.94 0.55 0.00 -1.51 0.00 0.00 72.50 70.45 3feq s THR 36 CO -0.10 -0.03 1.41 -0.90 -2.21 0.00 0.00 174.62 172.79 3feq n ASP 37 N 1.19 3.83 -4.65 8.08 5.75 -1.26 0.14 116.55 129.64 3feq n ASP 37 Ca -0.19 -2.39 -0.38 0.00 -0.01 0.00 0.00 54.79 51.82 3feq n ASP 37 Cb 0.57 -0.52 0.04 0.00 -1.03 0.00 0.00 41.12 40.18 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 0.73 1.14 -1.66 0.11 5.12 -1.26 -4.91 116.66 115.94 3feq n ARG 38 Ca 0.20 0.43 -0.42 0.00 -1.93 0.00 0.00 57.85 56.13 3feq n ARG 38 Cb 0.74 -2.25 -0.03 0.00 -1.16 0.00 0.00 32.46 29.76 3feq n ARG 38 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3feq s PRO 39 N -2.69 4.06 0.05 5.56 0.04 -1.26 -4.75 135.00 136.00 3feq s PRO 39 Ca 0.73 2.58 0.02 0.00 0.04 0.00 0.00 61.00 64.37 3feq s PRO 39 Cb -0.44 -4.19 -0.04 0.00 0.04 0.00 0.00 34.50 29.88 3feq s PRO 39 CO 0.49 -1.05 0.09 0.54 0.04 0.00 0.00 177.00 177.10 3feq s VAL 40 N 4.80 4.65 -1.23 -0.36 0.11 -1.26 -5.02 120.40 122.08 3feq s VAL 40 Ca 0.90 -0.61 -0.07 0.00 -2.93 0.00 0.00 61.98 59.27 3feq s VAL 40 Cb -0.42 -3.19 0.20 0.00 -1.53 0.00 0.00 36.38 31.43 3feq s VAL 40 CO 0.41 0.22 1.87 -0.67 -3.33 0.00 0.00 175.10 173.60 3feq n ASP 41 N 0.74 5.93 -4.50 3.54 4.64 -1.26 -4.97 116.55 120.67 3feq n ASP 41 Ca -0.10 -3.21 -0.43 0.00 -1.38 0.00 0.00 54.79 49.67 3feq n ASP 41 Cb 0.52 -1.40 -0.05 0.00 -1.04 0.00 0.00 41.12 39.15 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 -1.21 4.40 -0.07 -2.67 2.34 -1.26 -4.93 118.68 115.28 3feq s LEU 42 Ca 0.40 -0.53 -0.03 0.00 0.06 0.00 0.00 54.13 54.03 3feq s LEU 42 Cb 0.10 -2.71 -0.01 0.00 -0.56 0.00 0.00 46.19 43.02 3feq s LEU 42 CO 0.01 -1.10 -0.06 1.55 -1.06 0.00 0.00 176.35 175.69 3feq h PRO 43 N 9.19 0.00 -0.29 1.48 0.14 -2.02 -3.42 132.00 137.08 3feq h PRO 43 Ca -0.27 0.00 -0.11 0.00 0.14 0.00 0.00 66.00 65.76 3feq h PRO 43 Cb 1.08 0.00 -0.07 0.00 0.14 0.00 0.00 31.00 32.15 3feq h PRO 43 CO 1.04 0.00 -0.06 0.09 0.14 0.00 0.00 178.00 179.21 3feq n ASN 44 N -3.63 2.84 -4.73 1.44 4.13 -1.26 -5.03 115.26 109.01 3feq n ASN 44 Ca -0.02 -3.52 -0.40 0.00 1.68 0.00 0.00 54.58 52.31 3feq n ASN 44 Cb 0.09 -0.59 -0.05 0.00 -1.54 0.00 0.00 39.78 37.69 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 -3.11 3.32 -0.63 5.41 0.00 -1.26 -4.66 121.76 120.84 3feq s ALA 45 Ca 0.43 0.32 -0.26 0.00 0.00 0.00 0.00 51.96 52.45 3feq s ALA 45 Cb 0.38 -3.06 -0.07 0.00 0.00 0.00 0.00 23.12 20.37 3feq s ALA 45 CO 0.02 -0.01 2.20 -0.65 0.00 0.00 0.00 175.76 177.32 3feq s GLN 46 N 0.24 2.20 -0.12 0.00 1.11 -0.96 -4.83 119.66 117.32 3feq s GLN 46 Ca 0.41 0.81 -0.29 0.00 0.01 0.00 0.00 55.36 56.30 3feq s GLN 46 Cb -0.20 -4.62 -0.03 0.00 -1.01 0.00 0.00 33.01 27.15 3feq s GLN 46 CO 0.23 -3.36 1.31 0.00 0.01 0.00 0.00 175.29 173.48 3feq s ALA 47 N 11.57 3.62 -0.19 6.09 0.00 -1.26 -1.80 121.76 139.78 3feq s ALA 47 Ca 0.85 0.58 -0.02 0.00 0.00 0.00 0.00 51.96 53.37 3feq s ALA 47 Cb -0.14 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.36 3feq s ALA 47 CO 0.18 -1.10 -0.08 0.42 0.00 0.00 0.00 175.76 175.18 3feq s ILE 48 N 3.21 3.13 -0.38 0.00 1.01 -0.30 -4.98 121.20 122.89 3feq s ILE 48 Ca 0.58 -0.59 -0.27 0.00 0.00 0.00 0.00 60.65 60.37 3feq s ILE 48 Cb -0.24 -2.39 0.02 0.00 0.01 0.00 0.00 42.46 39.86 3feq s ILE 48 CO 0.19 0.46 1.01 -0.62 0.00 0.00 0.00 174.94 175.98 3feq s ASP 49 N 1.16 6.73 -0.47 3.58 -1.08 -1.26 -1.90 116.67 123.44 3feq s ASP 49 Ca 0.02 0.67 0.04 0.00 -0.52 0.00 0.00 52.55 52.76 3feq s ASP 49 Cb -0.14 -2.50 0.42 0.00 -1.46 0.00 0.00 42.92 39.23 3feq s ASP 49 CO -0.02 -0.95 1.22 0.52 0.52 0.00 0.00 175.17 176.46 3feq n VAL 50 N 6.14 2.53 -2.12 1.11 0.31 -0.63 -4.93 118.33 120.74 3feq n VAL 50 Ca 0.09 -4.76 -0.42 0.00 -0.01 0.00 0.00 64.34 59.25 3feq n VAL 50 Cb 0.48 -1.25 -0.03 0.00 -0.91 0.00 0.00 33.84 32.13 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 -3.61 4.30 -1.42 5.55 3.03 -1.24 -3.01 118.95 122.54 3feq s ARG 51 Ca 0.49 2.13 -0.07 0.00 2.03 0.00 0.00 55.73 60.31 3feq s ARG 51 Cb 0.41 -3.25 0.04 0.00 -1.03 0.00 0.00 34.95 31.12 3feq s ARG 51 CO -0.18 -0.48 0.59 0.41 -1.13 0.00 0.00 175.30 174.50 3feq n GLY 52 N 3.56 -0.51 2.94 3.88 0.00 -1.25 -4.97 105.19 108.84 3feq n GLY 52 Ca 0.12 0.12 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 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 -5.90 0.51 -0.07 1.61 1.02 -1.22 -4.71 119.74 110.99 3feq s LYS 53 Ca 0.37 -0.15 -0.30 0.00 0.02 0.00 0.00 55.97 55.91 3feq s LYS 53 Cb -0.18 -0.52 -0.04 0.00 -0.52 0.00 0.00 37.83 36.56 3feq s LYS 53 CO 0.46 0.06 1.48 0.99 -0.92 0.00 0.00 175.35 177.42 3feq s THR 54 N 0.19 3.79 -0.26 2.17 2.01 0.33 -2.36 115.64 121.51 3feq s THR 54 Ca -0.02 1.03 -0.08 0.00 0.31 0.00 0.00 61.69 62.93 3feq s THR 54 Cb -0.06 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 3feq s THR 54 CO -0.00 -0.07 0.11 0.54 -0.69 0.00 0.00 174.62 174.51 3feq s VAL 55 N 3.42 4.58 0.32 3.82 0.11 -1.18 0.17 120.40 131.64 3feq s VAL 55 Ca 0.66 -0.11 0.03 0.00 -2.93 0.00 0.00 61.98 59.63 3feq s VAL 55 Cb -0.30 -3.17 -0.05 0.00 -1.53 0.00 0.00 36.38 31.33 3feq s VAL 55 CO 0.25 0.30 0.09 0.00 -3.33 0.00 0.00 175.10 172.40 3feq s MET 56 N 1.65 1.63 0.32 1.54 0.23 0.11 -1.69 119.30 123.10 3feq s MET 56 Ca 0.06 -1.92 -0.29 0.00 -1.03 0.00 0.00 55.69 52.51 3feq s MET 56 Cb -0.15 -0.60 -0.10 0.00 -1.53 0.00 0.00 34.83 32.44 3feq s MET 56 CO 0.06 -0.29 1.40 -2.14 -2.03 0.00 0.00 175.02 172.01 3feq s PRO 57 N -3.89 4.26 0.24 3.16 0.02 -1.26 -0.38 135.00 137.14 3feq s PRO 57 Ca 0.34 2.35 -0.31 0.00 0.02 0.00 0.00 61.00 63.40 3feq s PRO 57 Cb 0.07 -3.05 -0.13 0.00 0.02 0.00 0.00 34.50 31.41 3feq s PRO 57 CO 0.15 -0.35 1.42 0.41 -0.33 0.00 0.00 177.00 178.29 3feq n GLY 58 N 1.06 0.80 3.78 0.52 0.00 0.65 -4.52 105.19 107.47 3feq n GLY 58 Ca 0.02 0.50 -0.34 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.05 2.74 -0.15 1.61 0.08 -0.16 -4.64 117.98 117.41 3feq s PHE 59 Ca 0.68 1.55 0.02 0.00 0.12 0.00 0.00 56.93 59.30 3feq s PHE 59 Cb -0.64 -3.21 0.01 0.00 -0.57 0.00 0.00 43.02 38.60 3feq s PHE 59 CO 0.49 -1.42 -0.21 0.42 -0.10 0.00 0.00 175.22 174.41 3feq s ILE 60 N -1.92 2.04 -0.31 0.64 1.01 -0.68 -1.08 121.20 120.89 3feq s ILE 60 Ca 0.70 -0.95 -0.10 0.00 0.00 0.00 0.00 60.65 60.30 3feq s ILE 60 Cb -0.21 -1.82 -0.01 0.00 0.01 0.00 0.00 42.46 40.43 3feq s ILE 60 CO 0.28 0.54 0.16 -0.62 0.00 0.00 0.00 174.94 175.30 3feq s ASP 61 N 0.99 5.59 0.00 3.58 -1.08 -0.86 -4.58 116.67 120.30 3feq s ASP 61 Ca -0.03 -0.53 0.29 0.00 -0.52 0.00 0.00 52.55 51.76 3feq s ASP 61 Cb -0.15 -2.01 1.21 0.00 -1.46 0.00 0.00 42.92 40.51 3feq s ASP 61 CO -0.06 -0.20 1.87 0.00 0.52 0.00 0.00 175.17 177.30 3feq s HIS 63 N -2.73 -0.48 0.29 0.00 5.65 -1.24 -4.56 115.29 112.22 3feq s HIS 63 Ca 0.22 -0.83 0.11 0.00 0.25 0.00 0.00 55.06 54.81 3feq s HIS 63 Cb 0.19 -0.28 -0.05 0.00 -1.18 0.00 0.00 32.58 31.26 3feq s HIS 63 CO 0.52 -1.02 -0.17 0.14 -0.65 0.00 0.00 174.74 173.55 3feq s VAL 64 N 1.25 2.37 -0.55 0.89 -7.23 -0.95 -0.69 120.40 115.48 3feq s VAL 64 Ca 0.20 -2.35 0.04 0.00 -1.81 0.00 0.00 61.98 58.06 3feq s VAL 64 Cb -0.10 -2.35 0.15 0.00 0.56 0.00 0.00 36.38 34.64 3feq s VAL 64 CO -0.05 -0.38 0.35 -1.00 -0.31 0.00 0.00 175.10 173.71 3feq s HIS 65 N -2.57 2.80 0.37 2.82 3.76 -1.26 0.07 115.29 121.28 3feq s HIS 65 Ca 0.30 -2.96 0.13 0.00 -0.15 0.00 0.00 55.06 52.38 3feq s HIS 65 Cb -0.03 -2.34 0.93 0.00 1.11 0.00 0.00 32.58 32.24 3feq s HIS 65 CO 0.15 -0.69 1.83 0.28 -0.85 0.00 0.00 174.74 175.46 3feq h VAL 66 N 4.94 0.71 -0.11 -0.90 2.07 -1.93 -0.39 116.25 120.65 3feq h VAL 66 Ca 0.06 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3feq h VAL 66 Cb 0.85 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 3feq h VAL 66 CO 0.61 0.10 0.00 0.18 0.02 0.00 0.00 177.57 178.49 3feq n LEU 67 N -4.60 1.24 -4.41 2.57 4.77 -1.26 -4.63 117.00 110.69 3feq n LEU 67 Ca 0.20 -0.51 -0.43 0.00 -0.03 0.00 0.00 56.01 55.25 3feq n LEU 67 Cb 0.62 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 3feq n LEU 67 CO 0.28 0.25 1.98 0.00 -1.33 0.00 0.00 177.39 178.57 3feq n ALA 68 N 0.03 3.96 0.68 -1.18 0.00 -0.16 -4.71 120.51 119.13 3feq n ALA 68 Ca 0.16 -3.94 0.11 0.00 0.00 0.00 0.00 53.44 49.78 3feq n ALA 68 Cb 0.27 -3.48 0.27 0.00 0.00 0.00 0.00 19.45 16.50 3feq n ALA 68 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3feq n SER 69 N 7.44 2.78 -3.71 0.00 3.41 -1.26 -1.64 113.62 120.64 3feq n SER 69 Ca 0.47 -1.89 -0.10 0.00 -0.26 0.00 0.00 58.87 57.09 3feq n SER 69 Cb 0.44 -0.19 -0.04 0.00 -0.26 0.00 0.00 64.21 64.17 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 -1.53 -0.28 0.22 4.04 2.20 -1.26 -4.66 114.94 113.67 3feq s ASN 70 Ca 0.36 -0.43 0.25 0.00 -0.94 0.00 0.00 52.86 52.09 3feq s ASN 70 Cb 0.21 0.57 0.62 0.00 -2.00 0.00 0.00 41.25 40.65 3feq s ASN 70 CO 0.29 -1.04 1.64 0.00 -2.94 0.00 0.00 177.10 175.06 3feq h ALA 71 N 2.19 0.90 -2.02 3.54 0.00 -1.83 -3.37 119.26 118.67 3feq h ALA 71 Ca -0.29 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 53.96 3feq h ALA 71 Cb 1.26 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.90 3feq h ALA 71 CO 0.38 0.00 0.23 1.21 0.00 0.00 0.00 179.25 181.07 3feq s ASN 72 N -4.74 6.28 0.44 0.00 3.84 -1.26 -4.54 114.94 114.97 3feq s ASN 72 Ca 0.09 -0.61 0.25 0.00 0.21 0.00 0.00 52.86 52.80 3feq s ASN 72 Cb 0.11 -2.34 0.68 0.00 -0.55 0.00 0.00 41.25 39.15 3feq s ASN 72 CO 0.64 -0.98 1.72 -0.07 -2.79 0.00 0.00 177.10 175.63 3feq h LEU 73 N 10.11 0.00 -0.18 3.21 3.38 -1.86 0.56 115.31 130.53 3feq h LEU 73 Ca -0.27 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.71 3feq h LEU 73 Cb 1.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 3feq h LEU 73 CO 0.99 0.13 0.10 1.23 0.09 0.00 0.00 178.44 180.98 3feq h GLY 74 N 3.02 0.25 1.76 0.83 0.00 -1.90 -2.15 103.07 104.88 3feq h GLY 74 Ca -0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.20 3feq h GLY 74 CO 0.02 0.07 -0.42 -0.24 0.00 0.00 0.00 176.54 175.97 3feq h VAL 75 N 0.22 0.30 -0.53 4.60 3.04 -1.80 -3.02 116.25 119.06 3feq h VAL 75 Ca 0.07 -1.45 -0.04 0.00 -1.01 0.00 0.00 66.70 64.27 3feq h VAL 75 Cb -0.00 2.05 -0.02 0.00 -2.01 0.00 0.00 31.29 31.31 3feq h VAL 75 CO -0.03 0.17 0.16 -1.13 -1.01 0.00 0.00 177.57 175.73 3feq h ASN 76 N 0.00 0.78 0.16 3.17 -1.24 -0.82 -2.61 115.58 115.02 3feq h ASN 76 Ca -0.01 -0.21 -0.09 0.00 0.71 0.00 0.00 56.30 56.70 3feq h ASN 76 Cb 1.16 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 40.00 3feq h ASN 76 CO 0.02 0.78 -0.31 0.00 -1.29 0.00 0.00 177.43 176.64 3feq h ALA 77 N 1.03 1.25 -0.01 1.57 0.00 -1.28 -3.09 119.26 118.73 3feq h ALA 77 Ca 0.17 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3feq h ALA 77 Cb 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3feq h ALA 77 CO -0.00 0.51 -0.06 0.25 0.00 0.00 0.00 179.25 179.94 3feq n THR 78 N -4.11 0.00 -2.38 0.00 -2.24 -1.02 -4.38 114.28 100.14 3feq n THR 78 Ca -0.01 -0.17 -0.35 0.00 -2.27 0.00 0.00 64.05 61.25 3feq n THR 78 Cb 0.40 0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.89 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 -2.14 3.64 0.54 -0.78 -2.07 -1.01 -4.97 119.66 112.85 3feq s GLN 79 Ca 0.36 1.54 -0.21 0.00 -1.82 0.00 0.00 55.36 55.23 3feq s GLN 79 Cb 0.21 -2.14 -0.07 0.00 -1.09 0.00 0.00 33.01 29.92 3feq s GLN 79 CO 0.39 -0.60 1.00 -2.30 -1.32 0.00 0.00 175.29 172.46 3feq n PRO 80 N -0.96 1.13 0.02 9.60 -0.02 -1.26 -4.70 135.00 138.81 3feq n PRO 80 Ca 0.10 0.42 -0.10 0.00 -2.02 0.00 0.00 63.50 61.89 3feq n PRO 80 Cb 0.51 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.79 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 0.93 -0.20 -0.57 2.55 2.35 -1.95 -0.67 115.58 118.02 3feq h ASN 81 Ca -0.47 0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.26 3feq h ASN 81 Cb 1.35 0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.79 3feq h ASN 81 CO 0.53 -0.09 0.15 -0.29 -1.65 0.00 0.00 177.43 176.08 3feq h ILE 82 N -0.08 1.24 -0.47 2.81 -0.00 -2.00 -2.15 117.51 116.86 3feq h ILE 82 Ca 0.05 -0.88 -0.12 0.00 -0.00 0.00 0.00 64.86 63.91 3feq h ILE 82 Cb 0.15 0.61 -0.01 0.00 -0.00 0.00 0.00 36.82 37.57 3feq h ILE 82 CO -0.11 0.33 -0.19 -0.07 -0.00 0.00 0.00 178.15 178.11 3feq h LEU 83 N 0.91 0.94 -0.51 2.19 3.38 -1.85 -0.07 115.31 120.30 3feq h LEU 83 Ca 0.20 -0.34 0.07 0.00 0.09 0.00 0.00 57.88 57.89 3feq h LEU 83 Cb 0.32 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 3feq h LEU 83 CO -0.00 1.11 0.20 0.00 0.09 0.00 0.00 178.44 179.83 3feq h ALA 84 N 0.96 0.63 -0.28 1.53 0.00 -0.85 -2.17 119.26 119.08 3feq h ALA 84 Ca 0.11 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3feq h ALA 84 Cb 0.74 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3feq h ALA 84 CO 0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 179.25 179.09 3feq h ALA 85 N 1.33 0.38 -0.13 0.00 0.00 -0.87 -3.07 119.26 116.90 3feq h ALA 85 Ca 0.24 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3feq h ALA 85 Cb 0.24 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3feq h ALA 85 CO -0.23 0.16 -0.05 0.82 0.00 0.00 0.00 179.25 179.94 3feq h ILE 86 N 0.29 0.82 0.00 0.00 1.08 -0.91 -2.88 117.51 115.91 3feq h ILE 86 Ca 0.08 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.54 3feq h ILE 86 Cb 0.48 0.82 -0.00 0.00 -3.07 0.00 0.00 36.82 35.05 3feq h ILE 86 CO 0.02 0.00 -0.01 0.03 -0.69 0.00 0.00 178.15 177.50 3feq h ARG 87 N -0.03 0.00 0.00 2.37 3.08 -1.33 -1.43 114.38 117.03 3feq h ARG 87 Ca 0.07 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 3feq h ARG 87 Cb 0.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 3feq h ARG 87 CO -0.16 0.01 -0.26 0.66 -1.07 0.00 0.00 179.97 179.16 3feq h SER 88 N 0.00 0.00 -0.30 7.04 4.64 -1.42 -3.36 113.55 120.15 3feq h SER 88 Ca -0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 3feq h SER 88 Cb 0.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 3feq h SER 88 CO 0.00 0.26 0.18 -0.07 -0.87 0.00 0.00 176.83 176.33 3feq h LEU 89 N 0.00 0.30 -0.63 5.97 3.38 -1.35 0.03 115.31 123.02 3feq h LEU 89 Ca -0.00 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.06 3feq h LEU 89 Cb 0.90 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.51 3feq h LEU 89 CO 0.03 0.22 0.24 -0.65 0.09 0.00 0.00 178.44 178.37 3feq h PRO 90 N 0.37 0.40 -0.54 1.13 0.11 -1.76 -1.56 132.00 130.16 3feq h PRO 90 Ca 0.12 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 3feq h PRO 90 Cb -0.01 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 30.98 3feq h PRO 90 CO -0.05 0.27 0.32 0.82 -0.21 0.00 0.00 178.00 179.15 3feq h ILE 91 N 0.42 1.17 -0.63 4.15 2.04 -1.55 0.31 117.51 123.42 3feq h ILE 91 Ca 0.32 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 3feq h ILE 91 Cb 0.40 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3feq h ILE 91 CO -0.32 0.17 0.28 -0.07 0.00 0.00 0.00 178.15 178.22 3feq h LEU 92 N 0.72 0.84 -0.39 1.44 3.38 -0.81 -2.37 115.31 118.13 3feq h LEU 92 Ca 0.19 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3feq h LEU 92 Cb 0.00 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3feq h LEU 92 CO -0.03 0.75 0.14 -0.78 0.09 0.00 0.00 178.44 178.61 3feq h ASP 93 N 0.87 0.55 -0.60 -0.43 3.58 -0.67 -2.77 116.42 116.95 3feq h ASP 93 Ca 0.21 -0.19 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 3feq h ASP 93 Cb 0.15 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.03 3feq h ASP 93 CO -0.02 0.59 0.23 0.00 -2.88 0.00 0.00 179.24 177.16 3feq h ALA 94 N 0.98 0.78 -0.55 -0.78 0.00 -0.85 -1.72 119.26 117.13 3feq h ALA 94 Ca 0.13 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3feq h ALA 94 Cb 0.22 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3feq h ALA 94 CO -0.01 0.41 0.32 0.52 0.00 0.00 0.00 179.25 180.49 3feq h MET 95 N 0.84 0.61 -0.47 0.00 2.86 -1.40 -2.05 114.93 115.33 3feq h MET 95 Ca 0.20 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.76 3feq h MET 95 Cb 0.22 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 3feq h MET 95 CO -0.01 0.41 0.14 1.25 1.06 0.00 0.00 176.91 179.76 3feq h LEU 96 N 0.63 0.70 -0.52 1.22 5.85 -1.20 -2.21 115.31 119.78 3feq h LEU 96 Ca 0.23 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3feq h LEU 96 Cb 0.05 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.90 3feq h LEU 96 CO -0.11 0.72 0.00 -1.54 -0.34 0.00 0.00 178.44 177.17 3feq n SER 97 N -4.52 0.53 -1.04 1.25 3.41 -0.67 -1.28 113.62 111.30 3feq n SER 97 Ca 0.01 0.63 0.05 0.00 -0.26 0.00 0.00 58.87 59.30 3feq n SER 97 Cb 0.19 -0.74 0.21 0.00 -0.26 0.00 0.00 64.21 63.61 3feq n SER 97 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3feq n ARG 98 N -2.08 2.61 -0.81 4.33 1.74 -0.78 -4.84 116.66 116.83 3feq n ARG 98 Ca 0.03 -1.65 0.00 0.00 -0.77 0.00 0.00 57.85 55.45 3feq n ARG 98 Cb 0.23 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 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 0.75 0.72 3.59 -0.13 0.00 -0.41 -4.72 105.19 105.00 3feq n GLY 99 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.66 3.01 -0.64 1.61 0.08 -0.91 -0.99 117.98 117.49 3feq s PHE 100 Ca 0.00 0.61 0.20 0.00 0.12 0.00 0.00 56.93 57.86 3feq s PHE 100 Cb 0.00 -3.78 -0.25 0.00 -0.57 0.00 0.00 43.02 38.41 3feq s PHE 100 CO 0.00 -0.94 0.72 0.25 -0.10 0.00 0.00 175.22 175.15 3feq n THR 101 N 6.16 0.00 -3.73 0.64 -2.24 -0.24 -3.84 114.28 111.03 3feq n THR 101 Ca 0.07 -0.18 -0.12 0.00 -2.27 0.00 0.00 64.05 61.55 3feq n THR 101 Cb 0.48 0.67 -0.12 0.00 -2.10 0.00 0.00 70.33 69.26 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 -3.41 -0.31 0.01 3.42 0.01 -1.13 -1.03 113.70 111.27 3feq s SER 102 Ca 0.02 0.59 0.06 0.00 1.31 0.00 0.00 55.95 57.93 3feq s SER 102 Cb 0.15 0.51 -0.02 0.00 0.21 0.00 0.00 66.02 66.86 3feq s SER 102 CO 0.84 -0.15 -0.17 0.68 0.41 0.00 0.00 173.24 174.85 3feq s VAL 103 N 1.01 1.35 -0.39 3.43 -7.23 0.56 -2.03 120.40 117.10 3feq s VAL 103 Ca -0.07 -0.90 -0.17 0.00 -1.81 0.00 0.00 61.98 59.03 3feq s VAL 103 Cb -0.08 -1.16 0.01 0.00 0.56 0.00 0.00 36.38 35.71 3feq s VAL 103 CO -0.07 0.24 0.42 -0.60 -0.31 0.00 0.00 175.10 174.79 3feq s ARG 104 N -0.77 3.26 -0.09 4.82 3.52 -0.69 -0.21 118.95 128.79 3feq s ARG 104 Ca 0.06 -0.62 -0.27 0.00 -0.13 0.00 0.00 55.73 54.77 3feq s ARG 104 Cb -0.07 -3.91 -0.02 0.00 -1.56 0.00 0.00 34.95 29.38 3feq s ARG 104 CO 0.00 -0.75 0.87 0.34 -0.81 0.00 0.00 175.30 174.95 3feq s ASP 105 N 1.79 7.12 -0.29 -2.12 -1.08 0.03 -2.25 116.67 119.87 3feq s ASP 105 Ca 0.13 1.36 0.04 0.00 -0.52 0.00 0.00 52.55 53.56 3feq s ASP 105 Cb -0.17 -2.49 0.48 0.00 -1.46 0.00 0.00 42.92 39.28 3feq s ASP 105 CO 0.13 -0.31 1.60 0.00 0.52 0.00 0.00 175.17 177.11 3feq n ALA 106 N 4.52 4.48 0.00 3.66 0.00 0.11 -2.28 120.51 131.00 3feq n ALA 106 Ca 0.04 -1.91 0.00 0.00 0.00 0.00 0.00 53.44 51.57 3feq n ALA 106 Cb 0.50 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.48 3.68 0.00 0.00 0.00 -1.26 -4.60 105.19 102.53 3feq n GLY 107 Ca 0.38 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 0.00 2.44 3.77 -0.02 0.00 0.35 -4.71 105.19 107.02 3feq n GLY 108 Ca 0.00 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 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 0.00 2.83 0.17 4.61 0.00 -1.26 -4.86 121.76 123.25 3feq s ALA 109 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.82 3feq s ALA 109 Cb 0.00 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.76 3feq s ALA 109 CO 0.00 -0.69 0.01 -0.40 0.00 0.00 0.00 175.76 174.68 3feq n ASP 110 N -0.90 2.30 -0.31 0.00 5.75 -1.26 -3.00 116.55 119.14 3feq n ASP 110 Ca 0.09 -1.76 0.00 0.00 -0.01 0.00 0.00 54.79 53.12 3feq n ASP 110 Cb 0.50 0.15 0.13 0.00 -1.03 0.00 0.00 41.12 40.87 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 1.11 0.98 -0.61 2.11 7.01 -1.80 -2.65 115.95 122.08 3feq h TRP 111 Ca -0.14 0.03 0.08 0.00 2.11 0.00 0.00 58.89 60.97 3feq h TRP 111 Cb 0.43 -0.32 -0.06 0.00 -2.10 0.00 0.00 29.16 27.11 3feq h TRP 111 CO 0.00 0.51 0.27 0.77 -2.79 0.00 0.00 178.44 177.20 3feq h SER 112 N 0.97 0.33 -0.48 2.65 0.02 -1.96 0.15 113.55 115.23 3feq h SER 112 Ca 0.36 0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 61.34 3feq h SER 112 Cb 0.14 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3feq h SER 112 CO -0.16 0.21 0.16 0.25 -1.14 0.00 0.00 176.83 176.14 3feq h LEU 113 N 0.49 0.70 -1.07 5.07 6.46 -1.90 0.67 115.31 125.74 3feq h LEU 113 Ca 0.30 -0.20 0.04 0.00 -0.12 0.00 0.00 57.88 57.89 3feq h LEU 113 Cb 0.31 -0.18 -0.06 0.00 -0.73 0.00 0.00 40.66 40.00 3feq h LEU 113 CO -0.26 0.71 0.63 -0.03 -0.62 0.00 0.00 178.44 178.88 3feq h MET 114 N 0.65 1.17 -0.54 1.25 4.05 -1.05 -2.02 114.93 118.44 3feq h MET 114 Ca 0.16 -0.07 -0.06 0.00 -0.28 0.00 0.00 59.70 59.44 3feq h MET 114 Cb 0.26 -0.26 -0.02 0.00 -0.80 0.00 0.00 31.60 30.78 3feq h MET 114 CO -0.01 0.78 0.09 1.96 0.23 0.00 0.00 176.91 179.96 3feq h GLN 115 N 1.21 0.90 -0.85 0.39 1.08 -0.21 -2.44 115.11 115.18 3feq h GLN 115 Ca 0.38 -0.24 0.07 0.00 -1.45 0.00 0.00 58.65 57.41 3feq h GLN 115 Cb 0.01 -0.11 -0.06 0.00 -0.05 0.00 0.00 27.48 27.27 3feq h GLN 115 CO -0.12 0.87 0.52 0.00 -0.95 0.00 0.00 178.83 179.15 3feq h ALA 116 N 0.99 1.18 -0.04 3.87 0.00 -0.14 0.09 119.26 125.21 3feq h ALA 116 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.85 3feq h ALA 116 Cb 0.41 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3feq h ALA 116 CO 0.01 0.24 -0.88 -0.39 0.00 0.00 0.00 179.25 178.23 3feq h VAL 117 N 0.93 1.36 0.00 0.00 -1.51 -1.48 0.20 116.25 115.76 3feq h VAL 117 Ca 0.38 -2.28 -0.04 0.00 -1.23 0.00 0.00 66.70 63.53 3feq h VAL 117 Cb 0.22 2.28 -0.01 0.00 -2.13 0.00 0.00 31.29 31.65 3feq h VAL 117 CO -0.19 0.69 -0.18 -0.33 -1.23 0.00 0.00 177.57 176.33 3feq h GLU 118 N 0.31 0.00 -0.22 5.19 5.08 -0.83 -0.80 114.58 123.31 3feq h GLU 118 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3feq h GLU 118 Cb 1.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.76 3feq h GLU 118 CO 0.16 0.18 0.00 0.25 -1.00 0.00 0.00 179.01 178.60 3feq n THR 119 N -3.21 0.26 -1.09 1.13 -2.24 -0.06 -4.95 114.28 104.11 3feq n THR 119 Ca 0.02 -0.57 -0.03 0.00 -2.27 0.00 0.00 64.05 61.19 3feq n THR 119 Cb 0.51 1.02 -0.01 0.00 -2.10 0.00 0.00 70.33 69.74 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 1.38 0.53 0.30 3.38 0.00 -0.31 -4.84 105.19 105.63 3feq n GLY 120 Ca 0.17 -0.15 0.20 0.00 0.00 0.00 0.00 46.02 46.23 3feq n GLY 120 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3feq h LEU 121 N 0.00 0.00 -7.60 0.99 5.85 -0.86 -3.43 115.31 110.25 3feq h LEU 121 Ca -0.07 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.51 3feq h LEU 121 Cb 0.58 0.00 -0.22 0.00 0.37 0.00 0.00 40.66 41.39 3feq h LEU 121 CO 0.10 0.00 -0.42 -0.69 -0.34 0.00 0.00 178.44 177.09 3feq s VAL 122 N -3.88 0.05 -0.22 1.05 1.01 -0.81 -4.99 120.40 112.61 3feq s VAL 122 Ca -0.02 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.37 3feq s VAL 122 Cb 0.11 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 3feq s VAL 122 CO 0.46 -0.22 0.54 -0.55 0.00 0.00 0.00 175.10 175.32 3feq s SER 123 N -0.86 6.54 0.00 3.32 0.15 -1.26 -4.18 113.70 117.41 3feq s SER 123 Ca -0.09 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.21 3feq s SER 123 Cb -0.05 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 3feq s SER 123 CO 0.02 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.84 3feq n GLY 124 N 4.02 -1.29 3.65 9.45 0.00 -1.26 -3.34 105.19 116.43 3feq n GLY 124 Ca -0.04 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.53 0.81 0.21 1.61 0.02 -1.26 -4.97 135.00 130.89 3feq s PRO 125 Ca 0.00 1.23 -0.30 0.00 0.02 0.00 0.00 61.00 61.95 3feq s PRO 125 Cb 0.00 -1.73 -0.09 0.00 0.02 0.00 0.00 34.50 32.71 3feq s PRO 125 CO 0.00 -2.67 1.28 0.50 -0.33 0.00 0.00 177.00 175.78 3feq s ARG 126 N -4.69 4.42 -0.20 5.54 3.52 -0.19 -4.83 118.95 122.52 3feq s ARG 126 Ca 0.66 2.02 -0.08 0.00 -0.13 0.00 0.00 55.73 58.19 3feq s ARG 126 Cb -0.22 -3.19 -0.04 0.00 -1.56 0.00 0.00 34.95 29.94 3feq s ARG 126 CO 0.59 -0.19 0.09 0.42 -0.81 0.00 0.00 175.30 175.40 3feq s ILE 127 N -0.09 4.89 -0.70 4.11 1.01 -1.26 -0.32 121.20 128.85 3feq s ILE 127 Ca 0.55 0.01 -0.13 0.00 0.00 0.00 0.00 60.65 61.07 3feq s ILE 127 Cb -0.36 -3.23 0.18 0.00 0.01 0.00 0.00 42.46 39.06 3feq s ILE 127 CO 0.39 0.42 0.63 -0.36 0.00 0.00 0.00 174.94 176.03 3feq s PHE 128 N 0.63 3.56 0.27 3.97 0.40 0.70 -4.84 117.98 122.67 3feq s PHE 128 Ca 0.05 -1.85 -0.28 0.00 -0.60 0.00 0.00 56.93 54.25 3feq s PHE 128 Cb -0.13 -3.74 -0.09 0.00 0.51 0.00 0.00 43.02 39.57 3feq s PHE 128 CO 0.01 -0.99 0.92 -1.25 0.70 0.00 0.00 175.22 174.62 3feq s PRO 129 N 0.64 4.71 0.00 0.24 0.04 -1.26 -0.79 135.00 138.59 3feq s PRO 129 Ca 0.13 1.38 0.25 0.00 0.04 0.00 0.00 61.00 62.80 3feq s PRO 129 Cb -0.18 -3.08 0.47 0.00 0.04 0.00 0.00 34.50 31.75 3feq s PRO 129 CO -0.04 0.43 1.38 0.43 0.04 0.00 0.00 177.00 179.24 3feq n SER 130 N 1.11 1.05 0.00 6.66 7.64 -0.97 -1.26 113.62 127.85 3feq n SER 130 Ca -0.01 -0.84 0.00 0.00 1.01 0.00 0.00 58.87 59.04 3feq n SER 130 Cb 0.48 0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.99 3feq n SER 130 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3feq n GLY 131 N 1.41 1.49 3.31 0.23 0.00 -1.16 -4.49 105.19 105.98 3feq n GLY 131 Ca 0.09 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 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 2.10 0.32 1.61 1.02 -1.26 -0.50 119.74 123.03 3feq s LYS 132 Ca 0.00 -0.94 -0.29 0.00 0.02 0.00 0.00 55.97 54.76 3feq s LYS 132 Cb 0.00 -2.04 -0.11 0.00 -0.52 0.00 0.00 37.83 35.16 3feq s LYS 132 CO 0.00 0.56 1.50 0.00 -0.92 0.00 0.00 175.35 176.48 3feq s ALA 133 N -0.62 3.64 -0.01 5.17 0.00 -0.66 -4.60 121.76 124.67 3feq s ALA 133 Ca 0.10 1.49 -0.26 0.00 0.00 0.00 0.00 51.96 53.29 3feq s ALA 133 Cb -0.10 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 3feq s ALA 133 CO -0.01 -0.93 0.82 -0.51 0.00 0.00 0.00 175.76 175.14 3feq s LEU 134 N -1.18 4.37 -0.01 0.00 1.43 0.28 -0.09 118.68 123.48 3feq s LEU 134 Ca 0.57 1.43 0.02 0.00 -1.03 0.00 0.00 54.13 55.13 3feq s LEU 134 Cb -0.45 -3.31 -0.00 0.00 0.03 0.00 0.00 46.19 42.46 3feq s LEU 134 CO 0.53 -0.14 -0.08 -0.55 0.23 0.00 0.00 176.35 176.35 3feq s SER 135 N 0.66 0.94 0.87 2.29 0.15 -0.52 -0.88 113.70 117.21 3feq s SER 135 Ca 0.43 -0.14 -0.11 0.00 0.70 0.00 0.00 55.95 56.83 3feq s SER 135 Cb -0.20 -0.14 0.11 0.00 -1.71 0.00 0.00 66.02 64.08 3feq s SER 135 CO 0.23 0.08 1.09 0.00 1.20 0.00 0.00 173.24 175.85 3feq s GLN 136 N -0.08 1.47 0.24 5.44 -2.07 -1.26 -1.16 119.66 122.24 3feq s GLN 136 Ca 0.01 1.00 -0.31 0.00 -1.82 0.00 0.00 55.36 54.24 3feq s GLN 136 Cb -0.04 -1.82 -0.12 0.00 -1.09 0.00 0.00 33.01 29.94 3feq s GLN 136 CO -0.00 -2.15 1.65 2.41 -1.32 0.00 0.00 175.29 175.88 3feq n THR 137 N -3.84 0.44 -0.92 3.63 -1.04 -1.26 -1.16 114.28 110.12 3feq n THR 137 Ca 0.08 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 3feq n THR 137 Cb 0.54 -1.92 0.00 0.00 -1.82 0.00 0.00 70.33 67.13 3feq n THR 137 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3feq n GLY 138 N 3.15 0.46 2.08 3.41 0.00 -1.26 -5.00 105.19 108.03 3feq n GLY 138 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.76 -1.26 0.29 -0.02 0.00 -0.31 -4.36 105.19 97.77 3feq n GLY 139 Ca 0.00 -1.70 0.20 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.39 0.00 -0.01 1.61 2.76 -1.82 -0.23 115.15 116.07 3feq h HIS 140 Ca -0.23 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.94 3feq h HIS 140 Cb 0.64 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.60 3feq h HIS 140 CO 0.00 0.00 -0.74 0.41 -1.30 0.00 0.00 177.93 176.30 3feq n GLY 141 N -1.03 -0.67 3.55 5.26 0.00 -1.26 -4.54 105.19 106.50 3feq n GLY 141 Ca -0.02 -0.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.80 6.46 -0.22 1.61 -1.08 -0.10 -4.77 116.67 115.76 3feq s ASP 142 Ca 0.13 0.03 0.14 0.00 -0.52 0.00 0.00 52.55 52.32 3feq s ASP 142 Cb 0.17 -2.41 0.80 0.00 -1.46 0.00 0.00 42.92 40.02 3feq s ASP 142 CO 0.74 -0.93 1.71 0.49 0.52 0.00 0.00 175.17 177.70 3feq n PHE 143 N 6.80 2.00 -2.68 -5.34 3.72 -1.26 -4.44 117.46 116.26 3feq n PHE 143 Ca 0.03 -0.70 -0.41 0.00 -0.05 0.00 0.00 57.45 56.33 3feq n PHE 143 Cb 0.48 -0.49 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 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 -2.66 4.71 0.76 -1.08 0.52 -1.26 -4.88 118.95 115.05 3feq s ARG 144 Ca 0.53 1.53 -0.11 0.00 -0.52 0.00 0.00 55.73 57.17 3feq s ARG 144 Cb 0.40 -3.33 0.05 0.00 0.52 0.00 0.00 34.95 32.59 3feq s ARG 144 CO 0.16 0.25 1.09 -1.25 0.02 0.00 0.00 175.30 175.57 3feq s PRO 145 N -0.38 2.37 -0.15 3.54 0.04 -1.26 -4.75 135.00 134.40 3feq s PRO 145 Ca 0.46 1.15 -0.01 0.00 0.04 0.00 0.00 61.00 62.64 3feq s PRO 145 Cb -0.26 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.36 3feq s PRO 145 CO 0.32 -1.55 1.16 -2.13 0.04 0.00 0.00 177.00 174.84 3feq n ARG 146 N -3.41 0.37 0.05 4.56 0.63 -1.26 -5.11 116.66 112.49 3feq n ARG 146 Ca 0.09 -0.61 0.00 0.00 -0.92 0.00 0.00 57.85 56.41 3feq n ARG 146 Cb 0.53 -2.02 0.00 0.00 0.45 0.00 0.00 32.46 31.42 3feq n ARG 146 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 3feq n GLU 151 N 4.62 0.00 0.00 -0.14 4.07 -1.26 -5.23 120.64 122.70 3feq n GLU 151 Ca 0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.18 3feq n GLU 151 Cb 0.03 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.41 3feq n GLU 151 CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77 3feq n PRO 152 N -2.79 0.00 0.00 5.31 -0.02 -1.26 -4.90 135.00 131.35 3feq n PRO 152 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3feq n PRO 152 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3feq n PRO 152 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3feq n SER 154 N 0.00 -1.20 0.00 0.00 2.88 -1.26 -5.08 113.62 108.96 3feq n SER 154 Ca 0.00 0.58 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 3feq n SER 154 Cb 0.00 1.44 0.00 0.00 -0.75 0.00 0.00 64.21 64.90 3feq n SER 154 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3feq s PHE 157 N -0.92 2.98 0.11 0.00 2.99 -1.26 -5.01 117.98 116.87 3feq s PHE 157 Ca 0.05 0.25 -0.31 0.00 0.00 0.00 0.00 56.93 56.93 3feq s PHE 157 Cb -0.09 -3.72 -0.07 0.00 0.00 0.00 0.00 43.02 39.14 3feq s PHE 157 CO 0.02 -1.00 1.30 1.03 -0.00 0.00 0.00 175.22 176.58 3feq s ARG 158 N 3.39 4.38 0.00 0.44 1.81 -1.26 -4.91 118.95 122.80 3feq s ARG 158 Ca 0.32 1.94 0.21 0.00 -1.72 0.00 0.00 55.73 56.48 3feq s ARG 158 Cb -0.12 -3.28 1.17 0.00 -0.45 0.00 0.00 34.95 32.27 3feq s ARG 158 CO 0.23 -0.33 1.67 0.25 -0.68 0.00 0.00 175.30 176.44 3feq n THR 159 N 3.74 0.19 1.23 0.02 -2.24 -1.26 -1.43 114.28 114.53 3feq n THR 159 Ca 0.10 0.05 0.13 0.00 -2.27 0.00 0.00 64.05 62.05 3feq n THR 159 Cb 0.44 -0.71 0.30 0.00 -2.10 0.00 0.00 70.33 68.26 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 0.42 0.05 3.74 3.38 0.00 -1.26 -4.85 105.19 106.68 3feq n GLY 160 Ca 0.13 -0.52 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.22 3.44 0.03 4.61 0.00 -0.51 -3.04 121.76 124.07 3feq s ALA 161 Ca 0.29 0.04 -0.17 0.00 0.00 0.00 0.00 51.96 52.11 3feq s ALA 161 Cb 0.20 -2.79 -0.27 0.00 0.00 0.00 0.00 23.12 20.25 3feq s ALA 161 CO 0.42 0.07 1.08 0.82 0.00 0.00 0.00 175.76 178.15 3feq h ILE 162 N 4.37 1.36 -2.67 0.00 1.08 -1.88 -3.36 117.51 116.40 3feq h ILE 162 Ca -0.44 -2.34 -0.49 0.00 -0.39 0.00 0.00 64.86 61.21 3feq h ILE 162 Cb 1.20 2.71 -0.14 0.00 -3.07 0.00 0.00 36.82 37.52 3feq h ILE 162 CO 0.72 0.70 -0.62 0.00 -0.69 0.00 0.00 178.15 178.25 3feq s ALA 163 N -3.00 2.43 0.11 1.87 0.00 -1.26 -1.65 121.76 120.25 3feq s ALA 163 Ca -0.11 -2.04 0.08 0.00 0.00 0.00 0.00 51.96 49.88 3feq s ALA 163 Cb 0.04 0.48 -0.03 0.00 0.00 0.00 0.00 23.12 23.61 3feq s ALA 163 CO 0.89 -0.23 -0.19 -0.98 0.00 0.00 0.00 175.76 175.25 3feq s ARG 164 N -3.83 1.09 -0.32 0.00 1.70 0.87 -4.81 118.95 113.64 3feq s ARG 164 Ca 0.34 -1.16 -0.19 0.00 -0.47 0.00 0.00 55.73 54.25 3feq s ARG 164 Cb 0.08 -1.26 -0.01 0.00 -0.57 0.00 0.00 34.95 33.19 3feq s ARG 164 CO 0.15 0.29 0.58 0.08 -1.08 0.00 0.00 175.30 175.31 3feq s VAL 165 N -1.34 4.97 -0.01 4.99 1.01 -1.26 -1.44 120.40 127.31 3feq s VAL 165 Ca 0.06 0.64 0.02 0.00 0.00 0.00 0.00 61.98 62.70 3feq s VAL 165 Cb -0.09 -3.98 -0.00 0.00 0.00 0.00 0.00 36.38 32.30 3feq s VAL 165 CO 0.04 -0.17 -0.07 0.68 0.00 0.00 0.00 175.10 175.58 3feq s VAL 166 N 2.53 0.55 0.18 2.92 -7.23 -0.31 -4.96 120.40 114.07 3feq s VAL 166 Ca 0.22 -0.28 0.08 0.00 -1.81 0.00 0.00 61.98 60.20 3feq s VAL 166 Cb -0.15 -0.47 -0.04 0.00 0.56 0.00 0.00 36.38 36.27 3feq s VAL 166 CO 0.13 0.16 -0.17 -1.81 -0.31 0.00 0.00 175.10 173.10 3feq s ASP 167 N -0.03 2.61 0.00 4.85 1.01 -1.26 -4.01 116.67 119.84 3feq s ASP 167 Ca 0.01 -0.91 0.00 0.00 0.71 0.00 0.00 52.55 52.36 3feq s ASP 167 Cb -0.04 -0.15 0.00 0.00 1.01 0.00 0.00 42.92 43.74 3feq s ASP 167 CO -0.00 -0.08 0.00 0.61 0.21 0.00 0.00 175.17 175.91 3feq n GLY 168 N 0.10 -0.13 0.11 0.21 0.00 -1.26 -3.72 105.19 100.49 3feq n GLY 168 Ca -0.12 -1.68 -0.13 0.00 0.00 0.00 0.00 46.02 44.10 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 1.35 -0.39 1.61 2.07 -1.94 -0.56 116.25 118.39 3feq h VAL 169 Ca 0.00 -1.21 -0.14 0.00 0.82 0.00 0.00 66.70 66.17 3feq h VAL 169 Cb 0.00 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3feq h VAL 169 CO 0.00 0.34 -0.30 -0.33 0.02 0.00 0.00 177.57 177.31 3feq h GLU 170 N -0.17 0.90 -0.50 1.57 4.39 -1.99 -1.15 114.58 117.63 3feq h GLU 170 Ca 0.02 -0.44 0.09 0.00 0.34 0.00 0.00 59.36 59.37 3feq h GLU 170 Cb 0.59 -0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.13 3feq h GLU 170 CO 0.02 1.09 -0.32 0.78 -1.16 0.00 0.00 179.01 179.42 3feq h GLY 171 N 0.71 -0.14 1.53 -3.84 0.00 -1.61 -0.13 103.07 99.59 3feq h GLY 171 Ca 0.07 0.41 -0.19 0.00 0.00 0.00 0.00 47.33 47.62 3feq h GLY 171 CO 0.08 -0.21 -0.76 -0.39 0.00 0.00 0.00 176.54 175.26 3feq h VAL 172 N -0.20 1.37 -0.44 4.60 -1.51 -1.04 -1.83 116.25 117.21 3feq h VAL 172 Ca 0.21 -2.16 0.08 0.00 -1.23 0.00 0.00 66.70 63.60 3feq h VAL 172 Cb 0.54 2.14 -0.07 0.00 -2.13 0.00 0.00 31.29 31.77 3feq h VAL 172 CO -0.61 0.65 0.03 0.03 -1.23 0.00 0.00 177.57 176.44 3feq h ARG 173 N 0.30 0.14 0.08 5.19 3.08 -0.75 -1.18 114.38 121.24 3feq h ARG 173 Ca -0.04 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 3feq h ARG 173 Cb 1.35 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.37 3feq h ARG 173 CO 0.13 0.09 -0.04 1.25 -1.07 0.00 0.00 179.97 180.34 3feq h LEU 174 N 0.14 -0.10 -0.86 3.04 5.85 -0.86 -2.33 115.31 120.20 3feq h LEU 174 Ca 0.22 -0.21 0.22 0.00 0.84 0.00 0.00 57.88 58.95 3feq h LEU 174 Cb 0.31 0.02 -0.15 0.00 0.37 0.00 0.00 40.66 41.22 3feq h LEU 174 CO -0.34 0.16 0.11 0.00 -0.34 0.00 0.00 178.44 178.03 3feq h ALA 175 N 0.54 1.08 -0.05 1.25 0.00 -1.06 0.20 119.26 121.22 3feq h ALA 175 Ca -0.01 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3feq h ALA 175 Cb 0.30 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3feq h ALA 175 CO 0.02 -0.48 -0.04 0.28 0.00 0.00 0.00 179.25 179.04 3feq h VAL 176 N 0.12 1.36 -0.66 0.00 2.07 -0.99 -0.43 116.25 117.73 3feq h VAL 176 Ca 0.51 -1.13 0.07 0.00 0.82 0.00 0.00 66.70 66.98 3feq h VAL 176 Cb 1.01 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 32.76 3feq h VAL 176 CO -0.72 0.31 0.43 0.03 0.02 0.00 0.00 177.57 177.64 3feq h ARG 177 N -0.33 0.61 0.17 1.57 3.08 -0.73 0.12 114.38 118.88 3feq h ARG 177 Ca 0.01 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3feq h ARG 177 Cb 0.51 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.42 3feq h ARG 177 CO 0.01 0.40 -0.08 0.93 -1.07 0.00 0.00 179.97 180.16 3feq h GLU 178 N 0.63 -0.22 -0.53 0.04 5.08 -0.33 -1.45 114.58 117.80 3feq h GLU 178 Ca 0.29 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.59 3feq h GLU 178 Cb 0.32 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 3feq h GLU 178 CO -0.09 0.02 0.03 0.93 -1.00 0.00 0.00 179.01 178.90 3feq h GLU 179 N -0.44 0.88 -0.61 2.33 4.39 -0.09 -1.12 114.58 119.92 3feq h GLU 179 Ca -0.02 -0.24 -0.10 0.00 0.34 0.00 0.00 59.36 59.35 3feq h GLU 179 Cb 0.35 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 3feq h GLU 179 CO 0.04 0.86 0.01 0.82 -1.16 0.00 0.00 179.01 179.57 3feq h ILE 180 N 0.82 1.27 -0.49 3.13 2.04 -1.03 -0.03 117.51 123.21 3feq h ILE 180 Ca 0.16 -1.15 -0.00 0.00 1.00 0.00 0.00 64.86 64.87 3feq h ILE 180 Cb 0.45 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 3feq h ILE 180 CO 0.02 0.42 0.30 -0.61 0.00 0.00 0.00 178.15 178.27 3feq h GLN 181 N 0.98 0.67 0.00 2.37 -0.00 -0.96 -1.22 115.11 116.94 3feq h GLN 181 Ca 0.17 -0.06 -0.01 0.00 -0.00 0.00 0.00 58.65 58.76 3feq h GLN 181 Cb 0.55 -0.14 -0.00 0.00 0.00 0.00 0.00 27.48 27.89 3feq h GLN 181 CO 0.03 0.48 -0.04 0.87 0.00 0.00 0.00 178.83 180.18 3feq h LYS 182 N 0.65 0.00 0.00 1.69 1.57 -0.95 -3.46 116.57 116.08 3feq h LYS 182 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3feq h LYS 182 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3feq h LYS 182 CO -0.03 0.04 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 3feq n GLY 183 N -0.94 1.51 3.75 3.86 0.00 -0.14 -4.45 105.19 108.77 3feq n GLY 183 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 3feq n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq s ALA 184 N -2.00 2.29 -0.13 4.61 0.00 -0.51 -4.55 121.76 121.46 3feq s ALA 184 Ca 0.00 0.67 0.19 0.00 0.00 0.00 0.00 51.96 52.82 3feq s ALA 184 Cb 0.00 -3.38 -0.27 0.00 0.00 0.00 0.00 23.12 19.47 3feq s ALA 184 CO 0.00 -1.58 0.28 0.25 0.00 0.00 0.00 175.76 174.71 3feq n THR 185 N -2.64 0.89 -4.15 0.00 -2.24 -0.39 -4.78 114.28 100.96 3feq n THR 185 Ca 0.12 -0.72 -0.16 0.00 -2.27 0.00 0.00 64.05 61.02 3feq n THR 185 Cb 0.51 -0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.36 3feq n THR 185 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3feq s GLN 186 N -2.89 1.81 -0.11 -0.78 0.00 -1.20 -4.60 119.66 111.89 3feq s GLN 186 Ca -0.09 -1.82 0.03 0.00 -0.00 0.00 0.00 55.36 53.48 3feq s GLN 186 Cb 0.09 0.40 0.01 0.00 0.00 0.00 0.00 33.01 33.50 3feq s GLN 186 CO 0.86 -0.72 -0.22 0.42 0.00 0.00 0.00 175.29 175.63 3feq s ILE 187 N -3.27 1.95 -0.11 3.63 -1.09 -1.01 -4.27 121.20 117.04 3feq s ILE 187 Ca 0.34 -0.94 -0.02 0.00 -2.23 0.00 0.00 60.65 57.80 3feq s ILE 187 Cb 0.01 -1.71 -0.03 0.00 -1.58 0.00 0.00 42.46 39.14 3feq s ILE 187 CO 0.22 0.53 -0.01 -0.75 -1.23 0.00 0.00 174.94 173.70 3feq s LYS 188 N 0.61 3.23 0.14 2.79 2.47 -1.26 -0.14 119.74 127.58 3feq s LYS 188 Ca -0.13 -0.45 0.05 0.00 -1.56 0.00 0.00 55.97 53.88 3feq s LYS 188 Cb -0.17 -2.84 -0.04 0.00 -1.46 0.00 0.00 37.83 33.33 3feq s LYS 188 CO 0.03 0.54 -0.11 0.96 0.16 0.00 0.00 175.35 176.93 3feq s ILE 189 N -0.43 1.22 -0.37 5.43 -4.36 -0.14 -0.55 121.20 122.00 3feq s ILE 189 Ca 0.07 -1.97 -0.15 0.00 -0.26 0.00 0.00 60.65 58.35 3feq s ILE 189 Cb -0.12 -1.76 -0.00 0.00 1.25 0.00 0.00 42.46 41.83 3feq s ILE 189 CO 0.02 -0.66 0.33 -0.04 0.24 0.00 0.00 174.94 174.84 3feq s MET 190 N -3.45 3.35 0.00 0.37 -1.94 -0.06 -1.25 119.30 116.31 3feq s MET 190 Ca 0.15 -0.65 0.20 0.00 -1.71 0.00 0.00 55.69 53.67 3feq s MET 190 Cb 0.00 -3.87 -0.16 0.00 2.01 0.00 0.00 34.83 32.81 3feq s MET 190 CO 0.01 -0.61 0.88 0.00 -0.01 0.00 0.00 175.02 175.30 3feq n ALA 191 N 5.31 4.30 -3.53 3.03 0.00 -0.24 -4.60 120.51 124.78 3feq n ALA 191 Ca -0.10 -0.57 -0.08 0.00 0.00 0.00 0.00 53.44 52.68 3feq n ALA 191 Cb 0.49 -0.72 -0.03 0.00 0.00 0.00 0.00 19.45 19.19 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 -2.73 -0.11 1.03 0.00 1.04 -1.04 -1.07 113.70 110.82 3feq s SER 192 Ca 0.10 -0.84 -0.15 0.00 0.48 0.00 0.00 55.95 55.55 3feq s SER 192 Cb 0.15 0.68 0.09 0.00 0.10 0.00 0.00 66.02 67.05 3feq s SER 192 CO 0.74 -1.30 0.38 0.61 0.98 0.00 0.00 173.24 174.65 3feq n GLY 193 N -0.44 -2.05 0.00 7.32 0.00 -0.10 -4.56 105.19 105.36 3feq n GLY 193 Ca -0.03 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.19 3feq n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3feq n GLY 194 N 1.54 4.49 0.28 -0.02 0.00 -1.25 -4.68 105.19 105.55 3feq n GLY 194 Ca 0.05 -1.19 -0.21 0.00 0.00 0.00 0.00 46.02 44.67 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 1.16 1.76 1.61 0.31 -1.26 -4.37 118.33 117.54 3feq n VAL 195 Ca 0.00 -0.33 0.06 0.00 -0.01 0.00 0.00 64.34 64.05 3feq n VAL 195 Cb 0.00 -1.64 0.28 0.00 -0.91 0.00 0.00 33.84 31.56 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 -3.73 2.54 -2.63 3.52 0.00 -1.26 -4.60 120.51 114.34 3feq n ALA 196 Ca -0.40 -0.19 -0.28 0.00 0.00 0.00 0.00 53.44 52.57 3feq n ALA 196 Cb 0.82 -1.12 -0.09 0.00 0.00 0.00 0.00 19.45 19.06 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 -1.29 4.63 0.09 0.00 1.04 -1.26 -4.75 113.70 112.15 3feq s SER 197 Ca 0.18 -0.39 -0.16 0.00 0.48 0.00 0.00 55.95 56.06 3feq s SER 197 Cb 0.09 -0.95 -0.10 0.00 0.10 0.00 0.00 66.02 65.16 3feq s SER 197 CO 0.14 0.13 1.40 1.55 0.98 0.00 0.00 173.24 177.44 3feq h PRO 198 N 3.08 0.65 0.00 4.02 0.13 -1.88 -3.40 132.00 134.60 3feq h PRO 198 Ca -0.48 -0.35 0.00 0.00 -0.87 0.00 0.00 66.00 64.30 3feq h PRO 198 Cb 1.19 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3feq h PRO 198 CO 0.56 0.96 -1.55 0.25 -0.23 0.00 0.00 178.00 177.99 3feq n THR 199 N -4.30 0.00 -3.48 1.56 -2.24 -1.26 -4.91 114.28 99.65 3feq n THR 199 Ca -0.04 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 60.99 3feq n THR 199 Cb 0.46 0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 68.90 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 -3.64 6.08 0.55 3.42 1.47 -1.26 -5.07 116.67 118.22 3feq s ASP 200 Ca -0.03 -0.82 -0.20 0.00 1.18 0.00 0.00 52.55 52.67 3feq s ASP 200 Cb 0.11 -2.15 -0.06 0.00 -0.34 0.00 0.00 42.92 40.48 3feq s ASP 200 CO 0.70 -0.41 1.09 -0.81 0.68 0.00 0.00 175.17 176.42 3feq n PRO 201 N 5.14 1.21 0.19 2.11 -0.04 -1.26 -3.91 135.00 138.45 3feq n PRO 201 Ca -0.11 0.45 0.05 0.00 -0.04 0.00 0.00 63.50 63.85 3feq n PRO 201 Cb 0.47 -2.27 0.35 0.00 -0.04 0.00 0.00 33.50 32.02 3feq n PRO 201 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 3feq h ILE 202 N 0.95 0.99 -0.61 0.52 2.10 -1.84 -3.22 117.51 116.41 3feq h ILE 202 Ca -0.48 -1.47 0.01 0.00 1.08 0.00 0.00 64.86 63.99 3feq h ILE 202 Cb 1.34 1.87 -0.03 0.00 -1.09 0.00 0.00 36.82 38.91 3feq h ILE 202 CO 0.54 0.38 0.40 0.00 -1.08 0.00 0.00 178.15 178.39 3feq h ALA 203 N 1.62 1.59 -2.29 0.18 0.00 -1.91 -3.32 119.26 115.12 3feq h ALA 203 Ca -0.00 -0.04 -0.49 0.00 0.00 0.00 0.00 54.91 54.38 3feq h ALA 203 Cb 0.84 -0.24 0.03 0.00 0.00 0.00 0.00 17.79 18.41 3feq h ALA 203 CO 0.05 0.38 0.02 0.54 0.00 0.00 0.00 179.25 180.24 3feq s ASN 204 N -6.48 6.29 0.45 0.00 6.03 -1.21 -4.89 114.94 115.11 3feq s ASN 204 Ca -0.10 0.80 0.02 0.00 -1.03 0.00 0.00 52.86 52.55 3feq s ASN 204 Cb 0.18 -2.19 0.00 0.00 -3.03 0.00 0.00 41.25 36.21 3feq s ASN 204 CO 0.76 -0.49 0.66 0.42 -2.03 0.00 0.00 177.10 176.42 3feq s THR 205 N -2.60 3.76 -0.00 0.54 -4.23 -1.26 -0.92 115.64 110.93 3feq s THR 205 Ca 0.45 -0.61 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 3feq s THR 205 Cb -0.10 -3.38 -0.00 0.00 1.34 0.00 0.00 72.50 70.36 3feq s THR 205 CO 0.42 -0.24 -0.01 -1.10 -0.54 0.00 0.00 174.62 173.14 3feq s GLN 206 N -4.53 0.10 0.12 3.99 -0.21 -0.24 -4.73 119.66 114.16 3feq s GLN 206 Ca 0.50 -0.04 0.00 0.00 0.02 0.00 0.00 55.36 55.84 3feq s GLN 206 Cb -0.10 -0.11 0.00 0.00 1.00 0.00 0.00 33.01 33.80 3feq s GLN 206 CO 0.37 0.02 0.00 0.66 -2.12 0.00 0.00 175.29 174.22 3feq n TYR 207 N 3.09 -1.62 -0.62 0.91 0.53 -1.26 -4.51 117.16 113.67 3feq n TYR 207 Ca -0.13 0.87 -0.30 0.00 -1.02 0.00 0.00 57.90 57.32 3feq n TYR 207 Cb 0.59 -2.30 0.20 0.00 -1.03 0.00 0.00 39.34 36.80 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 -1.11 2.19 0.19 7.72 1.04 -1.26 -4.83 113.70 117.64 3feq s SER 208 Ca 0.00 1.98 -0.08 0.00 0.48 0.00 0.00 55.95 58.33 3feq s SER 208 Cb 0.00 -2.49 0.10 0.00 0.10 0.00 0.00 66.02 63.73 3feq s SER 208 CO 0.00 -3.52 1.66 -0.33 0.98 0.00 0.00 173.24 172.02 3feq h GLU 209 N -2.16 1.06 -0.35 4.02 5.08 -1.97 -2.09 114.58 118.16 3feq h GLU 209 Ca -0.49 -0.33 0.07 0.00 -1.00 0.00 0.00 59.36 57.61 3feq h GLU 209 Cb 1.29 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 30.37 3feq h GLU 209 CO 0.44 1.03 -0.11 -0.44 -1.00 0.00 0.00 179.01 178.92 3feq h ASP 210 N 0.97 -0.40 0.03 1.42 3.32 -1.99 0.14 116.42 119.90 3feq h ASP 210 Ca 0.17 0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.35 3feq h ASP 210 Cb 0.54 0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 3feq h ASP 210 CO 0.03 -0.15 -0.11 -0.33 -1.72 0.00 0.00 179.24 176.96 3feq h GLU 211 N -0.04 -0.19 -0.60 3.56 5.08 -1.84 -0.90 114.58 119.65 3feq h GLU 211 Ca 0.17 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3feq h GLU 211 Cb 0.30 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 3feq h GLU 211 CO -0.38 -0.13 0.38 0.82 -1.00 0.00 0.00 179.01 178.70 3feq h ILE 212 N -0.20 1.11 -0.11 3.13 2.04 -1.03 -0.52 117.51 121.94 3feq h ILE 212 Ca 0.03 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.65 3feq h ILE 212 Cb 0.23 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 3feq h ILE 212 CO -0.09 0.14 -0.06 0.03 0.00 0.00 0.00 178.15 178.17 3feq h ARG 213 N 0.77 -0.06 -0.42 2.37 3.08 -0.54 -0.07 114.38 119.51 3feq h ARG 213 Ca 0.23 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.34 3feq h ARG 213 Cb -0.03 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 3feq h ARG 213 CO -0.08 -0.04 0.16 0.00 -1.07 0.00 0.00 179.97 178.94 3feq h ALA 214 N 1.03 0.50 -0.51 0.04 0.00 -0.72 0.02 119.26 119.62 3feq h ALA 214 Ca 0.06 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.07 3feq h ALA 214 Cb 0.16 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 3feq h ALA 214 CO -0.15 -0.22 0.24 0.82 0.00 0.00 0.00 179.25 179.95 3feq h ILE 215 N 0.33 0.93 -0.28 0.00 2.04 -0.73 -0.36 117.51 119.44 3feq h ILE 215 Ca 0.19 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.89 3feq h ILE 215 Cb 0.16 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 3feq h ILE 215 CO -0.18 0.09 0.17 0.58 0.00 0.00 0.00 178.15 178.80 3feq h VAL 216 N 0.48 1.11 -0.31 1.67 2.07 -0.42 -1.45 116.25 119.40 3feq h VAL 216 Ca 0.23 -0.27 0.02 0.00 0.82 0.00 0.00 66.70 67.50 3feq h VAL 216 Cb 0.17 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3feq h VAL 216 CO -0.18 0.11 0.16 0.44 0.02 0.00 0.00 177.57 178.12 3feq h ASP 217 N 0.35 0.25 -0.69 0.57 3.32 -0.47 -0.36 116.42 119.40 3feq h ASP 217 Ca 0.10 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 3feq h ASP 217 Cb 0.03 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 3feq h ASP 217 CO -0.02 0.19 0.38 -0.33 -1.72 0.00 0.00 179.24 177.74 3feq h GLU 218 N 0.34 0.96 0.14 3.56 4.39 -0.78 0.22 114.58 123.41 3feq h GLU 218 Ca 0.13 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.73 3feq h GLU 218 Cb 0.03 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.47 3feq h GLU 218 CO -0.08 0.71 -0.21 0.00 -1.16 0.00 0.00 179.01 178.28 3feq h ALA 219 N 1.19 -0.38 -0.52 3.43 0.00 -0.82 -2.78 119.26 119.38 3feq h ALA 219 Ca 0.24 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 3feq h ALA 219 Cb 0.03 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3feq h ALA 219 CO -0.04 -0.75 0.07 0.93 0.00 0.00 0.00 179.25 179.46 3feq h GLU 220 N -0.41 0.83 -0.64 0.00 5.08 -0.50 -0.06 114.58 118.89 3feq h GLU 220 Ca 0.02 -0.20 0.19 0.00 -1.00 0.00 0.00 59.36 58.37 3feq h GLU 220 Cb 0.41 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 3feq h GLU 220 CO -0.09 0.79 0.53 0.00 -1.00 0.00 0.00 179.01 179.23 3feq h ALA 221 N 1.28 2.50 -0.49 3.43 0.00 -0.40 0.22 119.26 125.81 3feq h ALA 221 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3feq h ALA 221 Cb 0.38 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3feq h ALA 221 CO 0.01 -0.86 0.00 0.00 0.00 0.00 0.00 179.25 178.40 3feq n ALA 222 N -2.55 3.50 -3.85 0.00 0.00 -0.08 -4.97 120.51 112.56 3feq n ALA 222 Ca 0.13 -1.99 -0.25 0.00 0.00 0.00 0.00 53.44 51.33 3feq n ALA 222 Cb 0.77 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 19.26 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 0.35 -1.61 0.00 0.00 3.02 0.76 -5.00 115.26 112.78 3feq n ASN 223 Ca 0.25 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 3feq n ASN 223 Cb 1.06 -3.63 0.00 0.00 -0.61 0.00 0.00 39.78 36.60 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 -4.39 0.00 -4.31 3.41 5.66 -0.90 -5.01 114.28 108.74 3feq n THR 224 Ca -0.22 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.59 3feq n THR 224 Cb 0.64 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.34 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 -0.85 1.62 -0.16 1.09 -0.85 -1.26 -3.45 117.35 113.48 3feq s TYR 225 Ca 0.00 -1.50 -0.03 0.00 -0.52 0.00 0.00 57.07 55.02 3feq s TYR 225 Cb 0.00 -0.77 -0.02 0.00 0.38 0.00 0.00 41.96 41.54 3feq s TYR 225 CO 0.00 -0.68 -0.05 0.08 -1.52 0.00 0.00 175.55 173.38 3feq s VAL 226 N -3.59 3.68 -0.05 -3.49 1.01 -1.26 -2.39 120.40 114.30 3feq s VAL 226 Ca 0.37 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.86 3feq s VAL 226 Cb 0.04 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 3feq s VAL 226 CO 0.21 0.49 0.20 0.00 0.00 0.00 0.00 175.10 176.00 3feq s MET 227 N 0.50 3.50 -0.03 2.72 0.23 0.81 -1.56 119.30 125.46 3feq s MET 227 Ca -0.04 -0.13 0.01 0.00 -1.03 0.00 0.00 55.69 54.49 3feq s MET 227 Cb -0.15 -3.14 0.03 0.00 -1.53 0.00 0.00 34.83 30.04 3feq s MET 227 CO 0.03 0.71 -0.01 0.00 -2.03 0.00 0.00 175.02 173.72 3feq s ALA 228 N -1.18 0.40 -0.33 3.16 0.00 -0.65 -0.97 121.76 122.19 3feq s ALA 228 Ca 0.22 0.11 -0.28 0.00 0.00 0.00 0.00 51.96 52.02 3feq s ALA 228 Cb -0.13 -0.33 0.01 0.00 0.00 0.00 0.00 23.12 22.67 3feq s ALA 228 CO 0.12 -0.05 1.01 -1.58 0.00 0.00 0.00 175.76 175.26 3feq s HIS 229 N 0.96 3.14 -0.16 0.00 2.46 -0.38 0.37 115.29 121.67 3feq s HIS 229 Ca -0.10 1.06 -0.07 0.00 0.47 0.00 0.00 55.06 56.42 3feq s HIS 229 Cb -0.14 -3.64 0.07 0.00 -0.13 0.00 0.00 32.58 28.74 3feq s HIS 229 CO -0.01 -0.76 0.35 0.00 -2.47 0.00 0.00 174.74 171.85 3feq s ALA 230 N 3.55 -0.88 0.00 1.58 0.00 -1.11 -1.08 121.76 123.82 3feq s ALA 230 Ca 0.42 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.68 3feq s ALA 230 Cb -0.12 -1.03 0.00 0.00 0.00 0.00 0.00 23.12 21.97 3feq s ALA 230 CO 0.16 -0.50 0.00 0.66 0.00 0.00 0.00 175.76 176.08 3feq n TYR 231 N 4.88 0.00 -1.28 0.00 4.01 -1.26 -1.58 117.16 121.93 3feq n TYR 231 Ca -0.15 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.29 3feq n TYR 231 Cb 0.52 -0.08 0.10 0.00 -0.31 0.00 0.00 39.34 39.57 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 -0.84 3.15 0.27 -0.72 -4.23 -1.26 -2.48 115.64 109.52 3feq s THR 232 Ca 0.00 0.37 0.08 0.00 -1.18 0.00 0.00 61.69 60.96 3feq s THR 232 Cb 0.00 -2.89 -0.01 0.00 1.34 0.00 0.00 72.50 70.94 3feq s THR 232 CO 0.00 -0.49 1.63 1.23 -0.54 0.00 0.00 174.62 176.45 3feq h GLY 233 N -1.23 0.13 0.59 3.99 0.00 -1.84 -0.96 103.07 103.75 3feq h GLY 233 Ca -0.46 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.73 3feq h GLY 233 CO 0.53 0.14 -0.33 -0.09 0.00 0.00 0.00 176.54 176.79 3feq h ARG 234 N 0.09 -0.64 -0.98 4.80 2.43 -1.92 -0.54 114.38 117.63 3feq h ARG 234 Ca -0.00 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3feq h ARG 234 Cb 1.01 0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.66 3feq h ARG 234 CO 0.08 -0.42 0.65 0.00 -1.51 0.00 0.00 179.97 178.77 3feq h ALA 235 N -0.12 1.30 -0.33 2.80 0.00 -1.84 -2.86 119.26 118.21 3feq h ALA 235 Ca -0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3feq h ALA 235 Cb 0.62 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3feq h ALA 235 CO -0.09 0.65 -0.02 0.82 0.00 0.00 0.00 179.25 180.60 3feq h ILE 236 N 1.33 1.26 0.41 0.00 2.04 -0.95 -2.76 117.51 118.85 3feq h ILE 236 Ca 0.36 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 3feq h ILE 236 Cb -0.15 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 3feq h ILE 236 CO -0.08 0.33 -0.52 0.00 0.00 0.00 0.00 178.15 177.88 3feq h ALA 237 N 0.84 -1.12 -0.72 1.87 0.00 -0.87 -0.62 119.26 118.63 3feq h ALA 237 Ca 0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3feq h ALA 237 Cb 0.48 0.78 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 3feq h ALA 237 CO 0.02 -1.18 0.44 0.07 0.00 0.00 0.00 179.25 178.60 3feq h ARG 238 N -0.96 0.96 -0.52 0.00 0.11 -1.59 0.46 114.38 112.86 3feq h ARG 238 Ca -0.05 -0.08 0.02 0.00 0.10 0.00 0.00 59.98 59.97 3feq h ARG 238 Cb 0.86 -0.21 -0.03 0.00 1.11 0.00 0.00 29.97 31.70 3feq h ARG 238 CO -0.12 0.67 0.31 0.00 0.10 0.00 0.00 179.97 180.93 3feq h ALA 239 N 1.51 0.66 -0.26 0.08 0.00 -1.29 -1.28 119.26 118.68 3feq h ALA 239 Ca 0.26 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.97 3feq h ALA 239 Cb -0.06 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3feq h ALA 239 CO -0.05 0.03 -0.57 0.28 0.00 0.00 0.00 179.25 178.94 3feq h VAL 240 N 0.63 1.28 -0.25 0.00 2.07 0.20 -2.40 116.25 117.77 3feq h VAL 240 Ca 0.20 -1.76 0.06 0.00 0.82 0.00 0.00 66.70 66.02 3feq h VAL 240 Cb 0.00 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 3feq h VAL 240 CO -0.08 0.57 0.18 -0.09 0.02 0.00 0.00 177.57 178.16 3feq h ARG 241 N 0.62 0.06 0.00 1.57 2.43 -0.00 -2.06 114.38 117.00 3feq h ARG 241 Ca 0.01 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3feq h ARG 241 Cb 1.17 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3feq h ARG 241 CO 0.12 0.04 -0.50 0.00 -1.51 0.00 0.00 179.97 178.12 3feq n GLY 243 N 1.31 1.62 3.77 0.00 0.00 -0.77 -4.56 105.19 106.56 3feq n GLY 243 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 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 3.19 -0.19 1.61 -7.23 -0.93 -4.78 120.40 110.08 3feq s VAL 244 Ca 0.00 1.01 -0.02 0.00 -1.81 0.00 0.00 61.98 61.16 3feq s VAL 244 Cb 0.00 -3.57 -0.22 0.00 0.56 0.00 0.00 36.38 33.15 3feq s VAL 244 CO 0.00 0.10 0.08 -1.14 -0.31 0.00 0.00 175.10 173.83 3feq n ARG 245 N 0.15 0.71 -5.06 4.82 0.63 -0.60 -4.71 116.66 112.60 3feq n ARG 245 Ca 0.04 0.21 -0.29 0.00 -0.92 0.00 0.00 57.85 56.89 3feq n ARG 245 Cb 0.46 -1.62 -0.16 0.00 0.45 0.00 0.00 32.46 31.59 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 -2.54 1.74 -0.08 5.15 -4.23 -1.14 -1.71 115.64 112.83 3feq s THR 246 Ca -0.28 -0.90 -0.07 0.00 -1.18 0.00 0.00 61.69 59.26 3feq s THR 246 Cb 0.08 -1.48 -0.04 0.00 1.34 0.00 0.00 72.50 72.39 3feq s THR 246 CO 0.69 0.49 0.18 -0.63 -0.54 0.00 0.00 174.62 174.82 3feq s ILE 247 N -0.10 5.43 0.05 2.99 -1.09 -1.07 -1.64 121.20 125.77 3feq s ILE 247 Ca -0.03 0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.63 3feq s ILE 247 Cb -0.12 -3.46 -0.04 0.00 -1.58 0.00 0.00 42.46 37.25 3feq s ILE 247 CO 0.03 0.56 0.15 -1.61 -1.23 0.00 0.00 174.94 172.84 3feq s GLU 248 N -1.21 3.22 3.94 2.79 0.41 0.16 -0.42 118.70 127.60 3feq s GLU 248 Ca 0.18 -0.51 0.00 0.00 -0.41 0.00 0.00 54.97 54.23 3feq s GLU 248 Cb -0.13 -2.93 0.00 0.00 -1.78 0.00 0.00 34.13 29.30 3feq s GLU 248 CO 0.08 0.61 0.00 0.72 -0.49 0.00 0.00 175.26 176.17 3feq n HIS 249 N 0.51 0.00 -1.15 1.61 8.25 0.14 -2.76 115.22 121.83 3feq n HIS 249 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 3feq n HIS 249 Cb 0.52 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.63 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 0.55 0.33 -1.41 0.00 -0.61 -3.72 105.19 100.33 3feq n GLY 250 Ca 0.00 -0.84 0.10 0.00 0.00 0.00 0.00 46.02 45.28 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 0.33 -1.03 1.61 4.21 -1.77 -3.01 115.58 115.93 3feq h ASN 251 Ca 0.00 0.00 -0.63 0.00 1.21 0.00 0.00 56.30 56.88 3feq h ASN 251 Cb 0.32 -0.07 -0.35 0.00 -1.12 0.00 0.00 38.32 37.10 3feq h ASN 251 CO 0.00 0.22 0.12 0.18 -1.29 0.00 0.00 177.43 176.66 3feq n LEU 252 N -4.47 6.41 -4.74 1.61 4.77 -1.04 -4.41 117.00 115.13 3feq n LEU 252 Ca 0.06 -4.58 -0.36 0.00 -0.03 0.00 0.00 56.01 51.10 3feq n LEU 252 Cb 0.26 -0.70 0.05 0.00 -2.33 0.00 0.00 43.42 40.70 3feq n LEU 252 CO 0.35 1.80 0.87 0.68 -1.33 0.00 0.00 177.39 179.76 3feq s VAL 253 N -4.82 2.33 0.50 4.08 -7.23 -1.14 -2.61 120.40 111.52 3feq s VAL 253 Ca 0.57 0.21 0.09 0.00 -1.81 0.00 0.00 61.98 61.04 3feq s VAL 253 Cb 0.46 -3.08 0.05 0.00 0.56 0.00 0.00 36.38 34.37 3feq s VAL 253 CO -0.04 -0.05 0.67 1.51 -0.31 0.00 0.00 175.10 176.88 3feq s ASP 254 N -1.50 5.34 0.40 4.85 1.47 -1.26 -4.87 116.67 121.10 3feq s ASP 254 Ca 0.80 -0.66 0.21 0.00 1.18 0.00 0.00 52.55 54.08 3feq s ASP 254 Cb -0.34 -0.16 0.47 0.00 -0.34 0.00 0.00 42.92 42.55 3feq s ASP 254 CO 0.36 -1.05 1.63 1.05 0.68 0.00 0.00 175.17 177.85 3feq h GLU 255 N 0.43 0.00 -0.00 2.11 9.09 -1.98 -2.22 114.58 122.01 3feq h GLU 255 Ca -0.35 0.00 0.01 0.00 0.05 0.00 0.00 59.36 59.07 3feq h GLU 255 Cb 1.28 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.37 3feq h GLU 255 CO 0.44 0.22 -0.08 0.00 0.05 0.00 0.00 179.01 179.64 3feq h ALA 256 N 1.78 -0.08 -0.11 1.06 0.00 -1.99 0.50 119.26 120.42 3feq h ALA 256 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3feq h ALA 256 Cb 1.03 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 3feq h ALA 256 CO 0.03 -0.57 0.03 0.00 0.00 0.00 0.00 179.25 178.74 3feq h ALA 257 N 0.85 0.14 -0.76 0.00 0.00 -1.87 -2.50 119.26 115.12 3feq h ALA 257 Ca 0.03 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 54.97 3feq h ALA 257 Cb 0.17 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 17.82 3feq h ALA 257 CO -0.08 -0.24 0.28 0.00 0.00 0.00 0.00 179.25 179.21 3feq h ALA 258 N 0.84 1.06 -0.15 0.00 0.00 -1.27 0.25 119.26 119.99 3feq h ALA 258 Ca 0.03 0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.11 3feq h ALA 258 Cb 0.23 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3feq h ALA 258 CO -0.00 -0.25 -0.06 -0.22 0.00 0.00 0.00 179.25 178.72 3feq h LYS 259 N 0.40 -0.04 -0.56 0.00 3.64 0.12 -1.70 116.57 118.44 3feq h LYS 259 Ca 0.43 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.79 3feq h LYS 259 Cb 0.68 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 3feq h LYS 259 CO -0.44 -0.02 0.28 1.25 -2.27 0.00 0.00 179.45 178.25 3feq h LEU 260 N -0.04 0.69 0.19 5.20 5.85 -0.74 -0.90 115.31 125.56 3feq h LEU 260 Ca 0.08 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3feq h LEU 260 Cb 0.15 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.01 3feq h LEU 260 CO -0.17 0.57 -0.09 -0.03 -0.34 0.00 0.00 178.44 178.38 3feq h MET 261 N 0.78 -0.25 -0.38 1.25 4.05 -0.57 -1.64 114.93 118.17 3feq h MET 261 Ca 0.20 0.02 0.07 0.00 -0.28 0.00 0.00 59.70 59.70 3feq h MET 261 Cb 0.05 0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.85 3feq h MET 261 CO -0.03 -0.01 -0.02 1.25 0.23 0.00 0.00 176.91 178.33 3feq h HIS 262 N -0.46 -0.07 -0.65 1.39 -0.00 -0.95 -1.55 115.15 112.87 3feq h HIS 262 Ca -0.03 0.03 0.11 0.00 -0.00 0.00 0.00 60.37 60.49 3feq h HIS 262 Cb 0.35 0.09 -0.08 0.00 -0.00 0.00 0.00 27.41 27.77 3feq h HIS 262 CO -0.01 -0.10 0.21 1.49 -0.00 0.00 0.00 177.93 179.53 3feq h GLU 263 N 0.07 0.35 0.00 5.26 4.81 -1.04 -2.84 114.58 121.20 3feq h GLU 263 Ca 0.18 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.33 3feq h GLU 263 Cb 0.26 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 3feq h GLU 263 CO -0.33 0.23 -0.31 0.45 -0.73 0.00 0.00 179.01 178.32 3feq h HIS 264 N 0.36 0.00 0.00 0.92 3.86 -0.50 -3.47 115.15 116.32 3feq h HIS 264 Ca 0.34 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.55 3feq h HIS 264 Cb 0.48 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.95 3feq h HIS 264 CO -0.20 0.31 0.00 0.41 0.86 0.00 0.00 177.93 179.31 3feq n GLY 265 N 1.07 1.13 3.64 2.45 0.00 -0.67 -5.07 105.19 107.74 3feq n GLY 265 Ca 0.02 -0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.00 3.57 1.09 4.61 0.00 -0.69 -5.00 121.76 123.33 3feq s ALA 266 Ca 0.00 -0.69 -0.15 0.00 0.00 0.00 0.00 51.96 51.12 3feq s ALA 266 Cb 0.00 -2.65 0.23 0.00 0.00 0.00 0.00 23.12 20.70 3feq s ALA 266 CO 0.00 -0.47 1.10 -0.06 0.00 0.00 0.00 175.76 176.33 3feq s PHE 267 N 1.66 1.47 0.02 0.00 0.08 -0.69 -4.53 117.98 115.99 3feq s PHE 267 Ca 0.16 0.79 0.03 0.00 0.12 0.00 0.00 56.93 58.04 3feq s PHE 267 Cb -0.15 -3.34 -0.02 0.00 -0.57 0.00 0.00 43.02 38.95 3feq s PHE 267 CO 0.09 -3.32 -0.11 0.08 -0.10 0.00 0.00 175.22 171.86 3feq s VAL 268 N -2.97 0.84 -0.43 -0.44 1.01 -0.07 -2.61 120.40 115.72 3feq s VAL 268 Ca 0.68 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.94 3feq s VAL 268 Cb -0.15 -0.76 0.12 0.00 0.00 0.00 0.00 36.38 35.58 3feq s VAL 268 CO 0.57 0.02 0.18 -0.69 0.00 0.00 0.00 175.10 175.18 3feq s VAL 269 N -0.67 2.19 0.62 2.92 1.01 0.45 -0.09 120.40 126.83 3feq s VAL 269 Ca 0.00 -2.75 -0.17 0.00 0.00 0.00 0.00 61.98 59.06 3feq s VAL 269 Cb -0.06 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 3feq s VAL 269 CO 0.00 -0.74 1.13 -2.84 0.00 0.00 0.00 175.10 172.66 3feq s PRO 270 N 0.33 2.95 -0.44 2.72 0.02 -1.24 0.26 135.00 139.60 3feq s PRO 270 Ca 0.15 1.52 0.10 0.00 0.02 0.00 0.00 61.00 62.79 3feq s PRO 270 Cb -0.23 -1.96 0.33 0.00 0.02 0.00 0.00 34.50 32.67 3feq s PRO 270 CO -0.04 -1.15 0.76 0.25 -0.33 0.00 0.00 177.00 176.48 3feq n THR 271 N -2.00 0.69 -0.06 0.99 -2.24 -1.26 -3.16 114.28 107.24 3feq n THR 271 Ca 0.11 -4.80 -0.08 0.00 -2.27 0.00 0.00 64.05 57.01 3feq n THR 271 Cb 0.51 -0.81 0.08 0.00 -2.10 0.00 0.00 70.33 68.01 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 3.16 0.74 -1.46 3.22 3.38 -1.83 -2.99 115.31 119.53 3feq h LEU 272 Ca 0.11 -0.30 0.16 0.00 0.09 0.00 0.00 57.88 57.94 3feq h LEU 272 Cb 0.83 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.31 3feq h LEU 272 CO 0.59 1.00 0.55 1.62 0.09 0.00 0.00 178.44 182.29 3feq h VAL 273 N 0.60 0.78 0.00 1.22 3.04 -1.84 -1.82 116.25 118.24 3feq h VAL 273 Ca 0.07 -0.18 -0.06 0.00 -1.01 0.00 0.00 66.70 65.53 3feq h VAL 273 Cb 0.83 0.22 -0.01 0.00 -2.01 0.00 0.00 31.29 30.33 3feq h VAL 273 CO 0.07 0.09 -0.27 0.00 -1.01 0.00 0.00 177.57 176.46 3feq h THR 274 N 0.51 0.99 0.02 3.17 1.03 -1.59 -2.77 112.91 114.27 3feq h THR 274 Ca 0.42 -0.98 -0.24 0.00 -0.01 0.00 0.00 66.41 65.60 3feq h THR 274 Cb 0.88 1.56 -0.03 0.00 -1.07 0.00 0.00 68.15 69.49 3feq h THR 274 CO -0.17 0.26 -1.23 1.88 -0.01 0.00 0.00 175.52 176.25 3feq h TYR 275 N 0.00 0.07 -0.43 0.00 0.05 -1.49 -1.31 116.97 113.86 3feq h TYR 275 Ca -0.00 -0.05 -0.10 0.00 0.05 0.00 0.00 58.73 58.63 3feq h TYR 275 Cb 0.54 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.26 3feq h TYR 275 CO 0.00 1.05 -0.11 -0.44 -1.05 0.00 0.00 178.16 177.61 3feq h ASP 276 N 0.01 0.83 -0.39 3.88 3.45 -1.54 -0.13 116.42 122.53 3feq h ASP 276 Ca -0.10 -0.36 -0.02 0.00 0.43 0.00 0.00 57.03 56.97 3feq h ASP 276 Cb 1.86 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 40.39 3feq h ASP 276 CO 0.12 1.01 0.16 0.00 -1.57 0.00 0.00 179.24 178.96 3feq h ALA 277 N 0.86 0.50 0.00 3.45 0.00 -1.42 -2.17 119.26 120.48 3feq h ALA 277 Ca 0.11 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3feq h ALA 277 Cb 0.64 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3feq h ALA 277 CO 0.04 0.09 0.00 -0.07 0.00 0.00 0.00 179.25 179.32 3feq h LEU 278 N 0.48 0.00 0.31 0.00 3.38 -1.19 0.58 115.31 118.88 3feq h LEU 278 Ca 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 3feq h LEU 278 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3feq h LEU 278 CO -0.01 0.00 -0.15 0.00 0.09 0.00 0.00 178.44 178.37 3feq h ALA 279 N 2.21 -0.42 0.45 1.53 0.00 -0.42 -3.11 119.26 119.50 3feq h ALA 279 Ca 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3feq h ALA 279 Cb 0.58 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3feq h ALA 279 CO 0.00 -0.55 -0.22 0.87 0.00 0.00 0.00 179.25 179.35 3feq h LYS 280 N -0.80 -0.59 -1.43 0.00 6.56 -1.10 -3.38 116.57 115.83 3feq h LYS 280 Ca -0.04 0.04 -0.64 0.00 -1.06 0.00 0.00 60.65 58.95 3feq h LYS 280 Cb 0.51 0.13 -0.37 0.00 -0.57 0.00 0.00 32.23 31.94 3feq h LYS 280 CO 0.07 -0.39 -0.06 0.72 -2.06 0.00 0.00 179.45 177.72 3feq n HIS 281 N -4.87 3.15 0.00 -1.35 8.25 0.17 -4.82 115.22 115.76 3feq n HIS 281 Ca -0.08 -2.72 0.00 0.00 -0.26 0.00 0.00 57.72 54.66 3feq n HIS 281 Cb 0.24 -0.60 0.00 0.00 1.12 0.00 0.00 29.99 30.75 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 -0.60 1.47 0.09 -1.41 0.00 -1.17 -2.85 105.19 100.72 3feq n GLY 282 Ca 0.47 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.57 3feq n GLY 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3feq n ALA 283 N -0.75 1.30 -0.07 4.61 0.00 -1.26 -2.49 120.51 121.85 3feq n ALA 283 Ca 0.00 0.08 -0.15 0.00 0.00 0.00 0.00 53.44 53.38 3feq n ALA 283 Cb 0.00 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.15 3feq n ALA 283 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3feq h GLU 284 N 0.00 0.67 -0.69 0.00 4.81 -1.88 -3.27 114.58 114.23 3feq h GLU 284 Ca 0.00 -0.43 -0.04 0.00 -0.13 0.00 0.00 59.36 58.76 3feq h GLU 284 Cb 0.14 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 3feq h GLU 284 CO 0.00 1.05 0.05 1.19 -0.73 0.00 0.00 179.01 180.57 3feq n PHE 285 N -4.20 1.78 -0.48 0.92 3.72 -1.04 -4.91 117.46 113.26 3feq n PHE 285 Ca -0.05 -0.68 0.00 0.00 -0.05 0.00 0.00 57.45 56.67 3feq n PHE 285 Cb 0.55 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 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 0.40 0.73 3.68 1.37 0.00 -1.23 -4.23 105.19 105.91 3feq n GLY 286 Ca 0.25 -0.30 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.77 4.32 0.20 1.61 0.00 -1.21 -4.11 119.30 119.34 3feq s MET 287 Ca 0.00 0.84 -0.28 0.00 0.00 0.00 0.00 55.69 56.24 3feq s MET 287 Cb 0.00 -3.53 -0.17 0.00 0.00 0.00 0.00 34.83 31.13 3feq s MET 287 CO 0.00 -0.16 0.55 -0.35 0.00 0.00 0.00 175.02 175.06 3feq n PRO 288 N 4.66 0.06 -0.05 4.11 -0.04 -1.26 -4.22 135.00 138.26 3feq n PRO 288 Ca 0.01 0.02 0.16 0.00 -0.04 0.00 0.00 63.50 63.65 3feq n PRO 288 Cb 0.50 -1.05 0.59 0.00 -0.04 0.00 0.00 33.50 33.50 3feq n PRO 288 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 3feq h PRO 289 N 1.09 0.21 -0.00 0.54 0.11 -1.96 -0.72 132.00 131.27 3feq h PRO 289 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3feq h PRO 289 Cb 1.44 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.50 3feq h PRO 289 CO 0.57 0.14 -0.27 -0.85 -0.21 0.00 0.00 178.00 177.38 3feq n GLU 290 N -4.44 0.44 0.06 1.05 0.00 -1.26 -2.94 120.64 113.56 3feq n GLU 290 Ca 0.10 -0.22 -0.14 0.00 0.00 0.00 0.00 57.16 56.91 3feq n GLU 290 Cb 0.50 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.31 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 0.53 0.28 1.10 -1.84 0.02 -1.38 -3.28 113.55 108.98 3feq h SER 291 Ca 0.00 -0.37 -0.06 0.00 -0.84 0.00 0.00 61.79 60.52 3feq h SER 291 Cb 0.46 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3feq h SER 291 CO 0.00 1.31 -0.28 0.58 -1.14 0.00 0.00 176.83 177.30 3feq h VAL 292 N 0.05 0.61 -0.81 2.27 2.07 -1.57 -2.60 116.25 116.27 3feq h VAL 292 Ca -0.19 -1.37 0.03 0.00 0.82 0.00 0.00 66.70 65.98 3feq h VAL 292 Cb 1.96 1.93 -0.04 0.00 -1.52 0.00 0.00 31.29 33.62 3feq h VAL 292 CO 0.15 0.28 0.54 0.00 0.02 0.00 0.00 177.57 178.56 3feq h ALA 293 N 1.72 1.47 0.00 1.67 0.00 -1.59 -2.94 119.26 119.59 3feq h ALA 293 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3feq h ALA 293 Cb 0.91 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3feq h ALA 293 CO 0.04 0.46 -0.19 0.87 0.00 0.00 0.00 179.25 180.43 3feq h LYS 294 N 1.04 0.00 0.00 0.00 1.57 -1.52 -3.32 116.57 114.34 3feq h LYS 294 Ca 0.31 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.05 3feq h LYS 294 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 3feq h LYS 294 CO -0.08 0.00 -0.20 -0.24 -0.57 0.00 0.00 179.45 178.36 3feq h VAL 295 N 0.00 0.34 -0.86 0.50 3.04 -1.42 -3.29 116.25 114.56 3feq h VAL 295 Ca 0.00 -1.46 0.05 0.00 -1.01 0.00 0.00 66.70 64.29 3feq h VAL 295 Cb 0.75 2.15 -0.06 0.00 -2.01 0.00 0.00 31.29 32.12 3feq h VAL 295 CO 0.00 0.19 0.54 0.00 -1.01 0.00 0.00 177.57 177.29 3feq h ALA 296 N 1.80 1.17 0.06 3.17 0.00 -1.68 -3.24 119.26 120.55 3feq h ALA 296 Ca -0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.65 3feq h ALA 296 Cb 1.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3feq h ALA 296 CO 0.03 0.31 -1.07 0.66 0.00 0.00 0.00 179.25 179.17 3feq h SER 297 N 1.00 0.48 1.50 0.00 4.64 -1.82 -3.35 113.55 115.99 3feq h SER 297 Ca 0.37 -0.44 -0.08 0.00 -0.47 0.00 0.00 61.79 61.17 3feq h SER 297 Cb 0.13 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3feq h SER 297 CO -0.16 1.28 -0.39 -0.37 -0.87 0.00 0.00 176.83 176.31 3feq h VAL 298 N 0.16 0.70 0.00 0.95 -1.51 -1.72 -3.24 116.25 111.59 3feq h VAL 298 Ca -0.10 -1.90 -0.14 0.00 -1.23 0.00 0.00 66.70 63.32 3feq h VAL 298 Cb 1.75 2.28 -0.02 0.00 -2.13 0.00 0.00 31.29 33.17 3feq h VAL 298 CO 0.18 0.39 -0.68 0.06 -1.23 0.00 0.00 177.57 176.29 3feq h GLN 299 N 0.00 0.00 0.00 5.19 3.07 -1.70 -3.22 115.11 118.45 3feq h GLN 299 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3feq h GLN 299 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.81 3feq h GLN 299 CO 0.05 0.68 0.00 1.04 0.09 0.00 0.00 178.83 180.69 3feq n GLN 300 N -3.46 0.00 0.00 0.06 1.13 -1.22 -1.70 117.38 112.19 3feq n GLN 300 Ca 0.00 0.64 0.06 0.00 -1.94 0.00 0.00 57.00 55.77 3feq n GLN 300 Cb 0.74 -1.37 0.37 0.00 0.11 0.00 0.00 30.24 30.08 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 -2.09 0.35 -0.05 -1.09 4.01 -1.26 -3.72 118.16 114.32 3feq n LYS 301 Ca 0.00 0.04 -0.13 0.00 -0.51 0.00 0.00 58.31 57.71 3feq n LYS 301 Cb 0.00 -1.50 -0.07 0.00 -0.51 0.00 0.00 35.03 32.95 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 2.01 0.28 0.86 0.72 0.00 -1.33 0.17 103.07 105.77 3feq h GLY 302 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 3feq h GLY 302 CO 0.00 0.23 -0.24 -0.09 0.00 0.00 0.00 176.54 176.44 3feq h ARG 303 N -0.09 -0.57 -0.67 4.80 2.43 -1.64 -3.25 114.38 115.39 3feq h ARG 303 Ca 0.03 0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.37 3feq h ARG 303 Cb 0.53 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 30.12 3feq h ARG 303 CO 0.02 -0.38 0.16 1.49 -1.51 0.00 0.00 179.97 179.75 3feq h GLU 304 N -0.60 0.28 -0.76 0.20 4.81 -1.69 -2.75 114.58 114.07 3feq h GLU 304 Ca -0.04 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 3feq h GLU 304 Cb 0.50 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.78 3feq h GLU 304 CO 0.03 0.18 0.50 0.66 -0.73 0.00 0.00 179.01 179.65 3feq h SER 305 N 0.28 0.78 -0.99 1.04 4.64 -0.70 -1.38 113.55 117.22 3feq h SER 305 Ca 0.36 -0.01 0.16 0.00 -0.47 0.00 0.00 61.79 61.84 3feq h SER 305 Cb 0.57 -0.18 -0.09 0.00 -0.31 0.00 0.00 62.40 62.39 3feq h SER 305 CO -0.44 0.53 0.62 -0.07 -0.87 0.00 0.00 176.83 176.60 3feq h LEU 306 N 0.90 0.81 -0.17 5.97 4.07 -1.58 0.19 115.31 125.51 3feq h LEU 306 Ca 0.31 0.07 -0.02 0.00 0.08 0.00 0.00 57.88 58.32 3feq h LEU 306 Cb 0.09 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.74 3feq h LEU 306 CO -0.09 0.36 0.01 -0.33 -1.08 0.00 0.00 178.44 177.31 3feq h GLU 307 N 0.83 0.29 -0.85 1.13 5.08 -1.39 -1.04 114.58 118.62 3feq h GLU 307 Ca 0.54 -0.08 0.08 0.00 -1.00 0.00 0.00 59.36 58.89 3feq h GLU 307 Cb 0.75 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.90 3feq h GLU 307 CO -0.32 0.48 0.51 0.82 -1.00 0.00 0.00 179.01 179.51 3feq h ILE 308 N 0.05 0.98 -0.23 3.13 2.04 -1.05 0.35 117.51 122.78 3feq h ILE 308 Ca 0.05 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 3feq h ILE 308 Cb 0.35 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 3feq h ILE 308 CO 0.01 0.16 0.03 1.88 0.00 0.00 0.00 178.15 180.23 3feq h TYR 309 N 0.89 0.41 -0.53 1.37 0.05 -0.92 -0.75 116.97 117.50 3feq h TYR 309 Ca 0.39 -0.06 0.08 0.00 0.05 0.00 0.00 58.73 59.19 3feq h TYR 309 Cb 0.28 -0.11 -0.06 0.00 1.01 0.00 0.00 36.73 37.84 3feq h TYR 309 CO -0.04 0.52 0.17 0.00 -1.05 0.00 0.00 178.16 177.76 3feq h ALA 310 N 0.84 0.64 -0.18 3.88 0.00 -0.70 -0.68 119.26 123.06 3feq h ALA 310 Ca 0.07 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3feq h ALA 310 Cb 0.33 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3feq h ALA 310 CO 0.01 -0.23 0.11 -0.91 0.00 0.00 0.00 179.25 178.23 3feq h ASN 311 N 0.34 0.21 0.92 0.00 2.35 0.04 -2.51 115.58 116.92 3feq h ASN 311 Ca 0.26 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3feq h ASN 311 Cb 0.30 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.62 3feq h ASN 311 CO -0.28 0.17 0.00 0.00 -1.65 0.00 0.00 177.43 175.67 3feq n ALA 312 N -2.15 2.05 -2.44 -0.83 0.00 -0.32 -4.93 120.51 111.90 3feq n ALA 312 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3feq n ALA 312 Cb 0.04 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.09 3feq n ALA 312 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3feq n GLY 313 N 0.87 0.94 3.53 0.00 0.00 -0.61 -4.76 105.19 105.15 3feq n GLY 313 Ca 0.05 -0.66 -0.40 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.98 5.24 0.19 1.61 1.01 -0.36 -4.83 120.40 120.28 3feq s VAL 314 Ca 0.00 -0.18 -0.32 0.00 0.00 0.00 0.00 61.98 61.47 3feq s VAL 314 Cb 0.00 -3.67 -0.15 0.00 0.00 0.00 0.00 36.38 32.57 3feq s VAL 314 CO 0.00 0.03 1.29 0.29 0.00 0.00 0.00 175.10 176.71 3feq n LYS 315 N 5.09 1.55 -4.69 2.72 4.01 -1.26 -4.62 118.16 120.96 3feq n LYS 315 Ca -0.13 0.55 -0.33 0.00 -0.51 0.00 0.00 58.31 57.90 3feq n LYS 315 Cb 0.50 -2.14 -0.16 0.00 -0.51 0.00 0.00 35.03 32.72 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 -0.26 3.13 0.23 1.97 -1.94 -1.26 -0.90 119.30 120.28 3feq s MET 316 Ca 0.72 -0.80 0.07 0.00 -1.71 0.00 0.00 55.69 53.97 3feq s MET 316 Cb -0.77 -2.51 -0.04 0.00 2.01 0.00 0.00 34.83 33.52 3feq s MET 316 CO 0.50 0.04 0.19 0.20 -0.01 0.00 0.00 175.02 175.94 3feq s GLY 317 N 0.72 1.46 0.02 -0.03 0.00 0.87 -4.38 107.32 105.97 3feq s GLY 317 Ca -0.08 -1.37 -0.30 0.00 0.00 0.00 0.00 44.72 42.97 3feq s GLY 317 CO 0.01 -1.40 1.11 -0.12 0.00 0.00 0.00 173.10 172.69 3feq s PHE 318 N -2.05 3.51 -0.06 1.90 5.36 -0.21 -3.99 117.98 122.43 3feq s PHE 318 Ca 0.33 1.46 -0.04 0.00 -0.96 0.00 0.00 56.93 57.71 3feq s PHE 318 Cb -0.08 -3.29 0.03 0.00 -0.34 0.00 0.00 43.02 39.33 3feq s PHE 318 CO 0.25 -0.74 0.15 0.20 -1.46 0.00 0.00 175.22 173.62 3feq s GLY 319 N 1.08 -0.08 -0.13 13.12 0.00 -1.19 0.10 107.32 120.22 3feq s GLY 319 Ca 0.55 0.55 -0.11 0.00 0.00 0.00 0.00 44.72 45.71 3feq s GLY 319 CO 0.28 0.65 -0.22 -1.14 0.00 0.00 0.00 173.10 172.66 3feq n SER 320 N 3.53 1.53 -3.05 1.64 3.41 -1.18 -4.15 113.62 115.34 3feq n SER 320 Ca -0.18 0.40 -0.18 0.00 -0.26 0.00 0.00 58.87 58.65 3feq n SER 320 Cb 0.56 -0.74 0.07 0.00 -0.26 0.00 0.00 64.21 63.83 3feq n SER 320 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3feq n ASP 321 N -4.13 -4.61 -4.79 4.04 2.03 0.13 -3.67 116.55 105.55 3feq n ASP 321 Ca -0.09 -0.47 -0.38 0.00 0.52 0.00 0.00 54.79 54.37 3feq n ASP 321 Cb 0.33 -4.28 -0.06 0.00 -0.72 0.00 0.00 41.12 36.38 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 -6.06 4.42 0.11 -2.67 1.43 -1.26 -4.78 118.68 109.88 3feq s LEU 322 Ca 0.35 0.97 0.07 0.00 -1.03 0.00 0.00 54.13 54.49 3feq s LEU 322 Cb -0.15 -2.68 -0.04 0.00 0.03 0.00 0.00 46.19 43.35 3feq s LEU 322 CO 0.61 0.21 -0.07 -0.76 0.23 0.00 0.00 176.35 176.57 3feq s LEU 323 N -0.55 3.15 0.00 1.79 1.43 -1.26 -4.60 118.68 118.64 3feq s LEU 323 Ca 0.25 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 3feq s LEU 323 Cb -0.17 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.14 3feq s LEU 323 CO 0.13 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.49 3feq n GLY 324 N 0.56 1.08 0.31 -3.19 0.00 -0.65 -2.79 105.19 100.51 3feq n GLY 324 Ca -0.12 -0.63 0.21 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.21 114.58 121.19 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 0.02 -1.33 0.05 0.00 0.00 179.01 177.75 3feq n MET 326 N -3.03 0.00 0.31 1.06 2.81 -1.12 -2.63 117.12 114.52 3feq n MET 326 Ca -0.02 0.14 0.21 0.00 -1.81 0.00 0.00 57.70 56.22 3feq n MET 326 Cb 0.13 -1.52 1.04 0.00 -0.71 0.00 0.00 33.22 32.17 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 -0.64 2.03 3.86 -1.55 -2.67 115.15 116.18 3feq h HIS 327 Ca 0.00 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.22 3feq h HIS 327 Cb 0.03 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 3feq h HIS 327 CO 0.00 0.00 0.42 0.00 0.86 0.00 0.00 177.93 179.21 3feq h ALA 328 N 2.00 0.81 0.00 2.45 0.00 -1.79 -3.20 119.26 119.54 3feq h ALA 328 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3feq h ALA 328 Cb 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3feq h ALA 328 CO 0.00 0.24 0.00 1.19 0.00 0.00 0.00 179.25 180.68 3feq n PHE 329 N -4.64 0.00 -0.30 0.00 3.01 -1.01 -4.32 117.46 110.20 3feq n PHE 329 Ca 0.05 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.50 3feq n PHE 329 Cb 0.02 -0.06 0.12 0.00 -0.01 0.00 0.00 39.48 39.55 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 0.23 0.95 0.00 -1.08 4.15 -1.78 -2.34 115.11 115.25 3feq h GLN 330 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.36 3feq h GLN 330 Cb 0.29 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.76 3feq h GLN 330 CO 0.00 0.63 0.00 0.77 -1.93 0.00 0.00 178.83 178.30 3feq h SER 331 N 0.98 0.00 -0.01 -0.69 0.02 -1.89 -3.22 113.55 108.73 3feq h SER 331 Ca 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 3feq h SER 331 Cb 0.09 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.63 3feq h SER 331 CO -0.14 0.00 0.07 1.23 -1.14 0.00 0.00 176.83 176.84 3feq h GLY 332 N 2.87 0.00 1.28 -3.77 0.00 -1.63 -1.46 103.07 100.37 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 0.16 -2.09 0.00 0.00 0.00 176.54 174.61 3feq h GLU 333 N 0.00 0.91 -0.50 4.80 4.57 -1.73 -2.55 114.58 120.08 3feq h GLU 333 Ca 0.01 -0.19 0.10 0.00 -1.18 0.00 0.00 59.36 58.10 3feq h GLU 333 Cb 0.14 -0.14 -0.10 0.00 -0.16 0.00 0.00 28.75 28.49 3feq h GLU 333 CO -0.00 0.80 -0.20 0.74 -1.18 0.00 0.00 179.01 179.17 3feq h PHE 334 N 0.87 -0.50 -0.52 0.92 0.04 -1.52 -1.03 116.94 115.20 3feq h PHE 334 Ca 0.19 0.05 -0.05 0.00 2.80 0.00 0.00 57.97 60.96 3feq h PHE 334 Cb 0.29 0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.72 3feq h PHE 334 CO 0.02 -0.29 0.11 0.00 -0.60 0.00 0.00 178.31 177.55 3feq h ARG 335 N -0.09 0.84 -0.41 1.51 3.08 -1.67 0.44 114.38 118.08 3feq h ARG 335 Ca 0.24 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 3feq h ARG 335 Cb 0.46 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 3feq h ARG 335 CO -0.56 0.81 0.13 0.82 -1.07 0.00 0.00 179.97 180.10 3feq h ILE 336 N 0.73 1.17 0.11 2.04 2.04 -1.01 -1.57 117.51 121.02 3feq h ILE 336 Ca 0.16 -0.57 -0.27 0.00 1.00 0.00 0.00 64.86 65.18 3feq h ILE 336 Cb 0.36 0.72 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 3feq h ILE 336 CO 0.00 0.21 -1.28 0.03 0.00 0.00 0.00 178.15 177.12 3feq h ARG 337 N 0.58 0.23 -0.71 2.37 3.08 -1.00 -3.25 114.38 115.68 3feq h ARG 337 Ca 0.14 -0.39 -0.00 0.00 0.07 0.00 0.00 59.98 59.79 3feq h ARG 337 Cb 0.17 0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 3feq h ARG 337 CO -0.01 1.16 0.44 0.00 -1.07 0.00 0.00 179.97 180.49 3feq h ALA 338 N 0.62 1.43 -0.13 0.04 0.00 -0.69 0.10 119.26 120.62 3feq h ALA 338 Ca -0.14 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 3feq h ALA 338 Cb 1.96 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 3feq h ALA 338 CO 0.18 0.50 -0.15 0.93 0.00 0.00 0.00 179.25 180.72 3feq h GLU 339 N 0.98 0.21 0.06 0.00 5.08 -1.32 -0.92 114.58 118.67 3feq h GLU 339 Ca 0.26 -0.05 -0.37 0.00 -1.00 0.00 0.00 59.36 58.20 3feq h GLU 339 Cb -0.05 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 3feq h GLU 339 CO -0.05 0.37 -2.15 0.28 -1.00 0.00 0.00 179.01 176.46 3feq n VAL 340 N -4.26 1.63 -1.60 3.13 0.31 -1.14 -4.73 118.33 111.67 3feq n VAL 340 Ca -0.01 -0.54 0.06 0.00 -0.01 0.00 0.00 64.34 63.84 3feq n VAL 340 Cb 0.28 -1.66 0.17 0.00 -0.91 0.00 0.00 33.84 31.71 3feq n VAL 340 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3feq n LEU 341 N -3.56 2.35 -1.11 7.52 4.77 0.01 -5.01 117.00 121.97 3feq n LEU 341 Ca -0.39 -3.42 0.00 0.00 -0.03 0.00 0.00 56.01 52.17 3feq n LEU 341 Cb 0.98 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 3feq n LEU 341 CO 0.31 1.12 -0.34 0.61 -1.33 0.00 0.00 177.39 177.77 3feq n GLY 342 N -0.97 -3.79 0.20 -0.72 0.00 -0.35 -4.14 105.19 95.43 3feq n GLY 342 Ca 0.16 -0.96 0.15 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.02 0.64 -0.04 1.61 6.94 -1.26 -2.34 115.26 118.78 3feq n ASN 343 Ca 0.00 -1.18 -0.14 0.00 -0.02 0.00 0.00 54.58 53.24 3feq n ASN 343 Cb 0.28 -0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.61 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 1.00 0.40 0.19 -4.53 6.46 -1.86 -2.94 115.31 114.02 3feq h LEU 344 Ca 0.00 -0.56 -0.01 0.00 -0.12 0.00 0.00 57.88 57.19 3feq h LEU 344 Cb 0.22 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.04 3feq h LEU 344 CO 0.00 0.88 -0.09 -0.33 -0.62 0.00 0.00 178.44 178.28 3feq h GLU 345 N -0.07 -0.25 -0.81 1.25 3.07 -1.66 -1.04 114.58 115.08 3feq h GLU 345 Ca 0.00 0.02 0.19 0.00 -0.50 0.00 0.00 59.36 59.07 3feq h GLU 345 Cb 0.81 0.06 -0.14 0.00 -0.84 0.00 0.00 28.75 28.64 3feq h GLU 345 CO 0.05 -0.08 0.00 0.00 -1.40 0.00 0.00 179.01 177.58 3feq h ALA 346 N 0.43 0.85 -0.09 3.43 0.00 -1.59 0.31 119.26 122.61 3feq h ALA 346 Ca -0.03 0.26 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 3feq h ALA 346 Cb 0.28 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 3feq h ALA 346 CO 0.04 -0.44 -0.52 -0.07 0.00 0.00 0.00 179.25 178.26 3feq h LEU 347 N 0.09 0.27 -0.91 0.00 3.38 -1.31 -3.00 115.31 113.83 3feq h LEU 347 Ca 0.45 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.23 3feq h LEU 347 Cb 0.81 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 3feq h LEU 347 CO -0.72 0.74 0.22 0.03 0.09 0.00 0.00 178.44 178.80 3feq h ARG 348 N 0.20 1.02 0.00 1.13 3.08 0.37 -2.99 114.38 117.19 3feq h ARG 348 Ca 0.01 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 3feq h ARG 348 Cb 0.98 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.87 3feq h ARG 348 CO 0.08 0.87 -0.05 0.66 -1.07 0.00 0.00 179.97 180.46 3feq h SER 349 N 0.99 0.00 -0.41 7.04 4.64 -1.05 -0.61 113.55 124.15 3feq h SER 349 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3feq h SER 349 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3feq h SER 349 CO -0.01 0.05 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 3feq n ALA 350 N -2.43 3.04 -1.01 5.18 0.00 -1.14 -1.04 120.51 123.11 3feq n ALA 350 Ca -0.03 -1.92 0.00 0.00 0.00 0.00 0.00 53.44 51.49 3feq n ALA 350 Cb 0.13 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 0.17 0.00 -0.03 0.00 -2.24 -0.30 -1.69 114.28 110.19 3feq n THR 351 Ca 0.22 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.85 3feq n THR 351 Cb 0.87 -0.02 -0.10 0.00 -2.10 0.00 0.00 70.33 68.98 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 1.48 -0.25 4.28 1.35 -1.42 -0.85 112.91 117.49 3feq h THR 352 Ca 0.00 -1.74 -0.03 0.00 -0.55 0.00 0.00 66.41 64.09 3feq h THR 352 Cb 0.00 2.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.90 3feq h THR 352 CO 0.00 0.48 0.04 0.58 -0.25 0.00 0.00 175.52 176.38 3feq h VAL 353 N -0.36 1.23 -0.12 6.82 2.07 -1.65 -2.87 116.25 121.37 3feq h VAL 353 Ca -0.02 -0.76 0.04 0.00 0.82 0.00 0.00 66.70 66.78 3feq h VAL 353 Cb 0.91 1.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 3feq h VAL 353 CO 0.05 0.24 -0.39 0.00 0.02 0.00 0.00 177.57 177.49 3feq h ALA 354 N 0.86 -0.52 0.00 1.67 0.00 -1.59 -2.33 119.26 117.35 3feq h ALA 354 Ca 0.08 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3feq h ALA 354 Cb 0.32 0.72 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 3feq h ALA 354 CO 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 179.25 178.36 3feq h ALA 355 N 0.21 1.69 -0.15 0.00 0.00 -1.01 0.26 119.26 120.25 3feq h ALA 355 Ca 0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3feq h ALA 355 Cb 0.60 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3feq h ALA 355 CO -0.38 0.02 -0.17 1.49 0.00 0.00 0.00 179.25 180.21 3feq h GLU 356 N 0.00 0.38 -0.28 0.00 4.81 -1.25 1.43 114.58 119.67 3feq h GLU 356 Ca -0.00 -0.21 0.05 0.00 -0.13 0.00 0.00 59.36 59.07 3feq h GLU 356 Cb 0.03 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 3feq h GLU 356 CO 0.00 0.77 -0.04 0.82 -0.73 0.00 0.00 179.01 179.83 3feq h ILE 357 N 0.01 0.75 -0.09 2.32 2.04 -0.44 0.59 117.51 122.70 3feq h ILE 357 Ca 0.02 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3feq h ILE 357 Cb 0.71 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 3feq h ILE 357 CO 0.04 0.01 0.01 1.33 0.00 0.00 0.00 178.15 179.54 3feq n VAL 358 N -5.21 0.52 -4.08 1.67 0.24 -0.85 -4.87 118.33 105.75 3feq n VAL 358 Ca -0.01 -0.21 -0.30 0.00 -2.04 0.00 0.00 64.34 61.79 3feq n VAL 358 Cb 0.15 -0.53 -0.03 0.00 -1.47 0.00 0.00 33.84 31.96 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 0.11 -1.17 -0.79 -1.34 3.02 0.20 -4.87 115.26 110.42 3feq n ASN 359 Ca 0.05 -1.04 0.04 0.00 -0.03 0.00 0.00 54.58 53.60 3feq n ASN 359 Cb 0.42 -2.79 0.07 0.00 -0.61 0.00 0.00 39.78 36.87 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 -4.42 0.53 -1.72 3.52 2.81 0.48 -5.00 117.12 113.32 3feq n MET 360 Ca -0.18 -2.06 -0.42 0.00 -1.81 0.00 0.00 57.70 53.23 3feq n MET 360 Cb 0.62 -0.72 -0.03 0.00 -0.71 0.00 0.00 33.22 32.39 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 -1.12 4.13 0.00 0.03 0.00 -0.57 -0.77 119.66 121.35 3feq s GLN 361 Ca 0.24 2.61 0.00 0.00 -0.00 0.00 0.00 55.36 58.21 3feq s GLN 361 Cb 0.25 -3.35 0.00 0.00 0.00 0.00 0.00 33.01 29.91 3feq s GLN 361 CO -0.07 -0.80 0.00 0.41 0.00 0.00 0.00 175.29 174.83 3feq n GLY 362 N 4.12 2.90 0.09 2.60 0.00 -1.26 -4.81 105.19 108.83 3feq n GLY 362 Ca 0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 3feq n GLY 362 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3feq h GLN 363 N 0.35 0.00 -5.43 1.61 5.75 -1.38 -3.38 115.11 112.63 3feq h GLN 363 Ca 0.00 0.00 -0.65 0.00 -0.15 0.00 0.00 58.65 57.85 3feq h GLN 363 Cb 0.00 0.00 -0.12 0.00 1.07 0.00 0.00 27.48 28.43 3feq h GLN 363 CO 0.00 0.71 -0.53 -0.51 -2.65 0.00 0.00 178.83 175.85 3feq s LEU 364 N -8.02 2.54 0.00 -2.39 1.43 0.05 -0.53 118.68 111.76 3feq s LEU 364 Ca -0.23 -1.51 0.00 0.00 -1.03 0.00 0.00 54.13 51.36 3feq s LEU 364 Cb 0.04 -0.86 0.00 0.00 0.03 0.00 0.00 46.19 45.40 3feq s LEU 364 CO 0.48 -0.73 0.00 0.61 0.23 0.00 0.00 176.35 176.94 3feq n GLY 365 N -1.21 0.61 3.33 -3.19 0.00 -1.26 -4.65 105.19 98.82 3feq n GLY 365 Ca -0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.60 -0.02 -0.47 1.61 0.11 -1.26 -3.49 120.40 114.28 3feq s VAL 366 Ca 0.00 0.06 -0.24 0.00 -2.93 0.00 0.00 61.98 58.86 3feq s VAL 366 Cb 0.00 -0.65 0.03 0.00 -1.53 0.00 0.00 36.38 34.23 3feq s VAL 366 CO 0.00 0.02 0.88 -0.63 -3.33 0.00 0.00 175.10 172.04 3feq s ILE 367 N 1.06 4.52 0.21 7.04 1.01 -1.26 -4.77 121.20 129.02 3feq s ILE 367 Ca -0.07 0.54 -0.21 0.00 0.00 0.00 0.00 60.65 60.91 3feq s ILE 367 Cb -0.06 -4.41 0.04 0.00 0.01 0.00 0.00 42.46 38.04 3feq s ILE 367 CO -0.09 -0.84 0.64 0.00 0.00 0.00 0.00 174.94 174.64 3feq s ALA 368 N 3.62 -1.35 0.15 9.38 0.00 -1.26 -5.02 121.76 127.27 3feq s ALA 368 Ca 0.33 0.07 -0.31 0.00 0.00 0.00 0.00 51.96 52.05 3feq s ALA 368 Cb -0.11 0.87 -0.09 0.00 0.00 0.00 0.00 23.12 23.79 3feq s ALA 368 CO 0.24 -0.88 1.45 0.08 0.00 0.00 0.00 175.76 176.65 3feq s VAL 369 N -3.83 3.00 0.00 0.00 1.01 -1.26 -2.62 120.40 116.69 3feq s VAL 369 Ca 0.06 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.78 3feq s VAL 369 Cb -0.03 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.88 3feq s VAL 369 CO -0.04 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.74 3feq n GLY 370 N 3.36 3.19 3.80 4.51 0.00 0.17 -5.01 105.19 115.22 3feq n GLY 370 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.21 2.52 0.03 4.61 0.00 -1.08 -4.73 121.76 120.90 3feq s ALA 371 Ca 0.00 0.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.78 3feq s ALA 371 Cb 0.00 -3.20 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 3feq s ALA 371 CO 0.00 -1.42 1.18 0.42 0.00 0.00 0.00 175.76 175.94 3feq s ILE 372 N -3.01 4.17 -0.31 0.00 1.01 0.31 -1.11 121.20 122.26 3feq s ILE 372 Ca 0.59 1.55 -0.26 0.00 0.00 0.00 0.00 60.65 62.53 3feq s ILE 372 Cb -0.15 -3.99 -0.28 0.00 0.01 0.00 0.00 42.46 38.05 3feq s ILE 372 CO 0.55 0.09 1.71 0.00 0.00 0.00 0.00 174.94 177.30 3feq n ALA 373 N 4.19 1.85 -3.68 9.38 0.00 0.12 -4.81 120.51 127.57 3feq n ALA 373 Ca 0.09 -2.86 -0.37 0.00 0.00 0.00 0.00 53.44 50.30 3feq n ALA 373 Cb 0.47 -3.67 -0.09 0.00 0.00 0.00 0.00 19.45 16.17 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 6.13 5.45 -0.01 0.00 1.11 -1.26 -2.39 116.67 125.69 3feq s ASP 374 Ca 0.62 -2.99 0.07 0.00 0.18 0.00 0.00 52.55 50.43 3feq s ASP 374 Cb 0.14 -1.89 -0.02 0.00 1.07 0.00 0.00 42.92 42.22 3feq s ASP 374 CO 0.25 -0.35 -0.21 -0.76 1.18 0.00 0.00 175.17 175.27 3feq s LEU 375 N -0.26 2.36 -0.18 1.23 2.01 -0.51 0.24 118.68 123.56 3feq s LEU 375 Ca 0.19 -0.39 0.00 0.00 0.01 0.00 0.00 54.13 53.94 3feq s LEU 375 Cb -0.18 -1.43 0.01 0.00 0.01 0.00 0.00 46.19 44.61 3feq s LEU 375 CO -0.05 0.31 -0.16 -0.69 1.01 0.00 0.00 176.35 176.77 3feq s VAL 376 N -0.71 2.43 -0.28 -1.59 1.01 0.49 -0.65 120.40 121.09 3feq s VAL 376 Ca 0.11 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.12 3feq s VAL 376 Cb -0.10 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 3feq s VAL 376 CO 0.01 0.52 0.33 -0.69 0.00 0.00 0.00 175.10 175.26 3feq s VAL 377 N 1.15 5.20 -0.13 2.92 1.01 -0.63 -0.71 120.40 129.20 3feq s VAL 377 Ca 0.01 0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.40 3feq s VAL 377 Cb -0.14 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.56 3feq s VAL 377 CO -0.07 0.13 -0.20 -0.22 0.00 0.00 0.00 175.10 174.75 3feq s LEU 378 N 1.99 2.27 -1.21 3.92 2.96 0.44 -2.27 118.68 126.78 3feq s LEU 378 Ca 0.13 -0.53 -0.19 0.00 -0.22 0.00 0.00 54.13 53.31 3feq s LEU 378 Cb -0.16 -1.49 0.07 0.00 0.50 0.00 0.00 46.19 45.11 3feq s LEU 378 CO 0.10 0.11 1.63 -0.62 -1.32 0.00 0.00 176.35 176.25 3feq s ASP 379 N 0.66 6.75 0.00 3.68 2.15 -0.59 -0.51 116.67 128.81 3feq s ASP 379 Ca -0.10 -2.18 0.00 0.00 0.43 0.00 0.00 52.55 50.70 3feq s ASP 379 Cb -0.16 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.89 3feq s ASP 379 CO 0.02 -1.25 0.00 0.61 -0.17 0.00 0.00 175.17 174.38 3feq n GLY 380 N 5.77 2.09 3.22 2.66 0.00 -1.26 -4.95 105.19 112.71 3feq n GLY 380 Ca 0.43 -1.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.18 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 0.00 4.90 0.50 1.61 2.47 -1.26 -3.80 114.94 119.37 3feq s ASN 381 Ca 0.00 -1.11 0.26 0.00 0.42 0.00 0.00 52.86 52.43 3feq s ASN 381 Cb 0.00 -1.75 1.33 0.00 -1.45 0.00 0.00 41.25 39.38 3feq s ASN 381 CO 0.00 -0.24 2.02 1.55 -3.72 0.00 0.00 177.10 176.70 3feq h PRO 382 N 8.07 0.00 0.00 0.43 0.13 -1.93 -0.68 132.00 138.01 3feq h PRO 382 Ca -0.25 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 3feq h PRO 382 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3feq h PRO 382 CO 0.56 0.15 -0.14 1.25 -0.23 0.00 0.00 178.00 179.58 3feq h LEU 383 N 0.00 0.00 0.00 1.56 5.85 -1.93 -3.14 115.31 117.65 3feq h LEU 383 Ca -0.00 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.56 3feq h LEU 383 Cb 0.42 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 3feq h LEU 383 CO 0.02 0.14 -1.56 -0.62 -0.34 0.00 0.00 178.44 176.08 3feq n GLU 384 N -3.57 0.23 -3.60 1.25 1.02 -1.14 -4.78 120.64 110.04 3feq n GLU 384 Ca -0.01 0.08 -0.40 0.00 -0.02 0.00 0.00 57.16 56.80 3feq n GLU 384 Cb 0.28 -1.04 -0.10 0.00 -0.02 0.00 0.00 31.44 30.56 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 -5.41 5.68 0.44 1.62 2.15 -0.28 -4.95 116.67 115.92 3feq s ASP 385 Ca -0.14 -1.28 0.18 0.00 0.43 0.00 0.00 52.55 51.75 3feq s ASP 385 Cb 0.04 -2.00 1.01 0.00 -0.30 0.00 0.00 42.92 41.67 3feq s ASP 385 CO 0.20 -0.47 1.93 -0.29 -0.17 0.00 0.00 175.17 176.37 3feq h ILE 386 N 5.99 0.97 -0.04 4.11 6.09 -1.80 -3.10 117.51 129.72 3feq h ILE 386 Ca -0.24 -0.93 0.01 0.00 -1.37 0.00 0.00 64.86 62.33 3feq h ILE 386 Cb 1.09 1.53 -0.00 0.00 0.47 0.00 0.00 36.82 39.91 3feq h ILE 386 CO 0.72 0.25 0.26 1.23 -3.07 0.00 0.00 178.15 177.54 3feq h GLY 387 N 1.03 0.00 2.00 8.18 0.00 -1.90 -2.05 103.07 110.33 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 0.03 0.00 0.00 -0.39 0.00 0.00 0.00 176.54 176.18 3feq h VAL 388 N 0.00 0.00 0.00 4.60 -1.51 -1.89 -2.94 116.25 114.52 3feq h VAL 388 Ca 0.02 -0.34 -0.17 0.00 -1.23 0.00 0.00 66.70 64.99 3feq h VAL 388 Cb 0.55 1.16 -0.03 0.00 -2.13 0.00 0.00 31.29 30.84 3feq h VAL 388 CO -0.00 0.00 -1.64 0.52 -1.23 0.00 0.00 177.57 175.22 3feq n VAL 389 N -2.42 0.64 -0.79 7.19 0.31 -0.82 -4.30 118.33 118.13 3feq n VAL 389 Ca 0.02 -0.30 -0.20 0.00 -0.01 0.00 0.00 64.34 63.86 3feq n VAL 389 Cb 0.28 -0.85 0.13 0.00 -0.91 0.00 0.00 33.84 32.48 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 -2.66 5.05 -1.69 3.52 0.00 -0.90 -4.00 120.51 119.83 3feq n ALA 390 Ca -0.18 -2.32 -0.24 0.00 0.00 0.00 0.00 53.44 50.70 3feq n ALA 390 Cb 0.74 -1.39 0.07 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.73 5.32 -2.83 0.00 4.64 -1.11 -4.41 116.55 117.42 3feq n ASP 391 Ca 0.47 -3.77 -0.16 0.00 -1.38 0.00 0.00 54.79 49.95 3feq n ASP 391 Cb 1.30 -0.60 0.06 0.00 -1.04 0.00 0.00 41.12 40.84 3feq n ASP 391 CO 0.00 0.00 0.00 1.21 -0.82 0.00 0.00 177.20 177.59 3feq n GLU 392 N -0.86 -5.70 0.00 -0.67 0.00 -1.26 -3.55 120.64 108.60 3feq n GLU 392 Ca 0.48 0.63 0.00 0.00 0.00 0.00 0.00 57.16 58.27 3feq n GLU 392 Cb 0.89 -5.04 0.00 0.00 0.00 0.00 0.00 31.44 27.29 3feq n GLU 392 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3feq n GLY 393 N -1.47 2.01 4.97 8.31 0.00 -1.26 -4.93 105.19 112.82 3feq n GLY 393 Ca -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 4.40 0.00 -1.19 4.61 0.00 -1.23 -4.06 120.51 123.04 3feq n ALA 394 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 3feq n ALA 394 Cb 0.00 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.69 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 2.66 -3.94 0.00 0.63 -1.26 -4.86 116.66 109.89 3feq n ARG 395 Ca 0.00 -3.04 -0.35 0.00 -0.92 0.00 0.00 57.85 53.54 3feq n ARG 395 Cb 0.00 -1.96 -0.14 0.00 0.45 0.00 0.00 32.46 30.81 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 -3.07 3.10 -0.23 5.15 0.11 -1.26 -1.54 120.40 122.67 3feq s VAL 396 Ca 0.48 -0.71 0.10 0.00 -2.93 0.00 0.00 61.98 58.92 3feq s VAL 396 Cb 0.40 -2.46 -0.13 0.00 -1.53 0.00 0.00 36.38 32.66 3feq s VAL 396 CO 0.07 0.36 0.31 -1.84 -3.33 0.00 0.00 175.10 170.67 3feq n GLU 397 N 4.74 2.02 -4.34 1.54 0.00 -0.96 -4.62 120.64 119.03 3feq n GLU 397 Ca -0.18 -0.05 -0.18 0.00 0.00 0.00 0.00 57.16 56.75 3feq n GLU 397 Cb 0.49 -1.10 -0.15 0.00 0.00 0.00 0.00 31.44 30.69 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 -2.31 0.78 -0.12 -1.84 2.02 -1.21 -1.09 117.35 113.58 3feq s TYR 398 Ca -0.00 -0.16 -0.00 0.00 -0.37 0.00 0.00 57.07 56.54 3feq s TYR 398 Cb 0.07 -0.50 0.03 0.00 -0.40 0.00 0.00 41.96 41.16 3feq s TYR 398 CO 0.40 -0.01 -0.08 0.08 -1.57 0.00 0.00 175.55 174.37 3feq s VAL 399 N -0.24 1.10 -0.14 0.71 1.01 -1.09 -1.60 120.40 120.14 3feq s VAL 399 Ca 0.03 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 61.58 3feq s VAL 399 Cb -0.04 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 3feq s VAL 399 CO -0.00 0.35 0.09 -0.76 0.00 0.00 0.00 175.10 174.78 3feq s LEU 400 N 1.67 4.07 -0.08 3.92 1.02 0.18 -0.71 118.68 128.76 3feq s LEU 400 Ca 0.04 0.28 0.00 0.00 0.02 0.00 0.00 54.13 54.48 3feq s LEU 400 Cb -0.13 -2.00 0.02 0.00 0.02 0.00 0.00 46.19 44.11 3feq s LEU 400 CO -0.08 0.32 -0.06 -1.58 0.02 0.00 0.00 176.35 174.96 3feq s GLN 401 N -0.49 1.23 -1.01 1.70 0.74 0.15 -1.43 119.66 120.55 3feq s GLN 401 Ca 0.11 -0.17 -0.24 0.00 0.05 0.00 0.00 55.36 55.11 3feq s GLN 401 Cb -0.12 -1.29 0.03 0.00 1.10 0.00 0.00 33.01 32.74 3feq s GLN 401 CO 0.02 -0.19 0.45 0.54 -0.55 0.00 0.00 175.29 175.56 3feq n ARG 402 N 4.64 -0.46 0.00 1.67 1.74 -1.01 -1.72 116.66 121.53 3feq n ARG 402 Ca -0.15 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 3feq n ARG 402 Cb 0.50 -1.92 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 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 -1.94 2.29 3.82 -0.13 0.00 -1.04 -4.39 105.19 103.79 3feq n GLY 403 Ca -0.12 -0.42 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 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 4.09 -0.07 2.61 -1.32 -0.70 -4.96 115.64 115.30 3feq s THR 404 Ca 0.00 1.07 -0.23 0.00 -1.21 0.00 0.00 61.69 61.33 3feq s THR 404 Cb 0.00 -3.52 -0.04 0.00 -1.51 0.00 0.00 72.50 67.43 3feq s THR 404 CO 0.00 -0.51 0.66 -0.22 -2.21 0.00 0.00 174.62 172.35 3feq s LEU 405 N -4.08 4.31 0.00 9.08 2.96 -1.26 0.33 118.68 130.02 3feq s LEU 405 Ca 0.62 1.13 0.00 0.00 -0.22 0.00 0.00 54.13 55.67 3feq s LEU 405 Cb -0.13 -3.02 0.00 0.00 0.50 0.00 0.00 46.19 43.53 3feq s LEU 405 CO 0.30 -0.09 0.00 0.52 -1.32 0.00 0.00 176.35 175.76 3feq n VAL 406 N 3.73 0.00 -4.18 1.68 0.31 0.11 -4.94 118.33 115.05 3feq n VAL 406 Ca -0.02 -0.06 -0.18 0.00 -0.01 0.00 0.00 64.34 64.06 3feq n VAL 406 Cb 0.51 0.55 -0.16 0.00 -0.91 0.00 0.00 33.84 33.84 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 -1.83 0.67 -0.23 5.55 -0.14 -1.16 -4.98 119.74 117.62 3feq s LYS 407 Ca 0.00 -0.14 -0.00 0.00 -1.36 0.00 0.00 55.97 54.47 3feq s LYS 407 Cb 0.00 -0.67 0.06 0.00 -1.68 0.00 0.00 37.83 35.54 3feq s LYS 407 CO 0.00 0.01 -0.03 0.50 -0.76 0.00 0.00 175.35 175.06 3feq s ARG 408 N 0.48 1.40 0.00 1.68 3.52 -1.26 -2.68 118.95 122.09 3feq s ARG 408 Ca -0.06 -0.88 0.00 0.00 -0.13 0.00 0.00 55.73 54.66 3feq s ARG 408 Cb -0.10 -2.48 0.00 0.00 -1.56 0.00 0.00 34.95 30.81 3feq s ARG 408 CO -0.00 -0.62 0.25 1.04 -0.81 0.00 0.00 175.30 175.16