#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f83 s ASP 24 N 0.00 6.48 -0.11 0.00 1.01 -1.26 -4.85 116.67 117.94 3f83 s ASP 24 Ca 0.00 1.84 -0.05 0.00 0.71 0.00 0.00 52.55 55.05 3f83 s ASP 24 Cb 0.00 -2.55 0.05 0.00 1.01 0.00 0.00 42.92 41.43 3f83 s ASP 24 CO 0.00 -0.68 0.25 -0.75 0.21 0.00 0.00 175.17 174.19 3f83 s LYS 25 N -3.30 0.18 -0.07 8.23 2.20 0.45 -4.91 119.74 122.52 3f83 s LYS 25 Ca 0.65 0.59 -0.18 0.00 -0.36 0.00 0.00 55.97 56.68 3f83 s LYS 25 Cb -0.14 -0.10 -0.05 0.00 -1.51 0.00 0.00 37.83 36.03 3f83 s LYS 25 CO 0.19 -0.20 0.47 -0.80 -0.36 0.00 0.00 175.35 174.65 3f83 s ASN 26 N 1.63 6.75 0.62 1.43 0.01 -1.26 -0.79 114.94 123.33 3f83 s ASN 26 Ca -0.06 0.89 -0.18 0.00 -0.71 0.00 0.00 52.86 52.80 3f83 s ASN 26 Cb -0.11 -2.29 -0.02 0.00 0.41 0.00 0.00 41.25 39.24 3f83 s ASN 26 CO -0.08 0.09 1.26 -2.16 -1.51 0.00 0.00 177.10 174.70 3f83 s PRO 27 N 0.10 2.74 0.09 -0.60 0.04 -1.23 -4.91 135.00 131.24 3f83 s PRO 27 Ca 0.26 1.97 -0.25 0.00 0.04 0.00 0.00 61.00 63.02 3f83 s PRO 27 Cb -0.16 -1.89 0.09 0.00 0.04 0.00 0.00 34.50 32.58 3f83 s PRO 27 CO 0.12 -1.42 1.15 0.20 0.04 0.00 0.00 177.00 177.08 3f83 s GLY 28 N -1.46 -0.03 0.28 0.56 0.00 -1.26 -4.89 107.32 100.53 3f83 s GLY 28 Ca 0.80 -0.11 -0.29 0.00 0.00 0.00 0.00 44.72 45.12 3f83 s GLY 28 CO 0.37 3.44 1.32 -0.56 0.00 0.00 0.00 173.10 177.68 3f83 s SER 29 N -3.52 6.80 0.03 1.64 0.01 -1.26 -4.47 113.70 112.93 3f83 s SER 29 Ca 0.24 2.60 0.03 0.00 1.31 0.00 0.00 55.95 60.14 3f83 s SER 29 Cb -0.01 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 3f83 s SER 29 CO 0.02 -0.55 -0.10 -1.61 0.41 0.00 0.00 173.24 171.41 3f83 s GLU 30 N -1.14 0.72 -0.18 12.44 2.02 -0.85 -4.91 118.70 126.80 3f83 s GLU 30 Ca 0.52 -0.63 -0.01 0.00 0.02 0.00 0.00 54.97 54.88 3f83 s GLU 30 Cb -0.39 -0.66 0.00 0.00 0.10 0.00 0.00 34.13 33.18 3f83 s GLU 30 CO 0.47 0.16 -0.13 -0.80 0.02 0.00 0.00 175.26 174.98 3f83 s ASN 31 N -1.01 3.73 0.26 -0.19 0.01 -1.26 -0.87 114.94 115.60 3f83 s ASN 31 Ca -0.01 -0.49 0.02 0.00 -0.71 0.00 0.00 52.86 51.67 3f83 s ASN 31 Cb -0.07 -1.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.94 3f83 s ASN 31 CO 0.01 0.03 0.07 -0.04 -1.51 0.00 0.00 177.10 175.66 3f83 s MET 32 N 1.13 1.43 -0.03 -0.60 -1.94 0.18 -5.00 119.30 114.47 3f83 s MET 32 Ca 0.01 -1.76 -0.02 0.00 -1.71 0.00 0.00 55.69 52.20 3f83 s MET 32 Cb -0.14 -0.44 0.02 0.00 2.01 0.00 0.00 34.83 36.28 3f83 s MET 32 CO -0.04 -0.23 0.08 0.99 -0.01 0.00 0.00 175.02 175.80 3f83 s THR 33 N -3.61 -0.02 0.01 2.05 2.01 -1.26 -0.63 115.64 114.19 3f83 s THR 33 Ca 0.35 0.09 0.04 0.00 0.31 0.00 0.00 61.69 62.48 3f83 s THR 33 Cb 0.08 -0.13 -0.01 0.00 0.01 0.00 0.00 72.50 72.44 3f83 s THR 33 CO 0.13 0.03 -0.13 0.20 -0.69 0.00 0.00 174.62 174.16 3f83 s ASN 34 N 0.51 1.55 -0.16 3.53 0.01 0.17 -4.91 114.94 115.63 3f83 s ASN 34 Ca -0.04 -0.32 -0.01 0.00 -0.71 0.00 0.00 52.86 51.78 3f83 s ASN 34 Cb -0.06 -0.14 0.04 0.00 0.41 0.00 0.00 41.25 41.51 3f83 s ASN 34 CO -0.02 0.10 -0.05 -0.89 -1.51 0.00 0.00 177.10 174.73 3f83 s THR 35 N -0.53 1.08 -0.15 1.60 2.01 -1.26 -1.41 115.64 116.98 3f83 s THR 35 Ca 0.03 -0.61 -0.07 0.00 0.31 0.00 0.00 61.69 61.36 3f83 s THR 35 Cb -0.06 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 3f83 s THR 35 CO 0.00 0.13 0.08 -0.63 -0.69 0.00 0.00 174.62 173.51 3f83 s ILE 36 N 1.65 4.97 0.00 1.82 -1.09 -0.01 -4.98 121.20 123.56 3f83 s ILE 36 Ca 0.01 0.02 0.00 0.00 -2.23 0.00 0.00 60.65 58.45 3f83 s ILE 36 Cb -0.15 -3.20 0.00 0.00 -1.58 0.00 0.00 42.46 37.53 3f83 s ILE 36 CO -0.08 0.53 0.00 0.61 -1.23 0.00 0.00 174.94 174.77 3f83 n GLY 37 N 2.83 -1.24 3.78 6.18 0.00 -1.26 -1.60 105.19 113.88 3f83 n GLY 37 Ca -0.18 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.53 3f83 n GLY 37 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3f83 s PRO 38 N 0.00 4.16 -0.01 1.61 0.04 -1.26 -4.96 135.00 134.58 3f83 s PRO 38 Ca 0.00 2.50 0.08 0.00 0.04 0.00 0.00 61.00 63.62 3f83 s PRO 38 Cb 0.00 -2.99 -0.02 0.00 0.04 0.00 0.00 34.50 31.53 3f83 s PRO 38 CO 0.00 -0.47 -0.24 -1.58 0.04 0.00 0.00 177.00 174.75 3f83 s HIS 39 N -1.08 2.17 -0.10 0.56 2.46 0.14 -4.96 115.29 114.48 3f83 s HIS 39 Ca 0.52 -0.41 -0.10 0.00 0.47 0.00 0.00 55.06 55.55 3f83 s HIS 39 Cb -0.45 -1.38 -0.05 0.00 -0.13 0.00 0.00 32.58 30.57 3f83 s HIS 39 CO 0.61 -0.01 0.22 0.34 -2.47 0.00 0.00 174.74 173.43 3f83 s ASP 40 N -0.69 6.48 0.52 9.88 -1.08 -1.26 -0.94 116.67 129.58 3f83 s ASP 40 Ca 0.10 0.57 0.35 0.00 -0.52 0.00 0.00 52.55 53.05 3f83 s ASP 40 Cb -0.09 -2.13 1.84 0.00 -1.46 0.00 0.00 42.92 41.08 3f83 s ASP 40 CO -0.00 0.34 2.06 0.03 0.52 0.00 0.00 175.17 178.12 3f83 h ARG 41 N 5.22 0.00 0.00 4.34 3.08 -1.47 -2.41 114.38 123.14 3f83 h ARG 41 Ca -0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.53 3f83 h ARG 41 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3f83 h ARG 41 CO 0.62 0.00 0.00 0.78 -1.07 0.00 0.00 179.97 180.30 3f83 h GLY 42 N 0.29 0.00 -3.44 0.04 0.00 -1.91 -3.44 103.07 94.61 3f83 h GLY 42 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 3f83 h GLY 42 CO 0.00 0.00 -0.78 -0.32 0.00 0.00 0.00 176.54 175.44 3f83 s GLY 43 N -3.79 1.34 0.20 4.60 0.00 -0.91 -4.93 107.32 103.83 3f83 s GLY 43 Ca -0.00 -1.44 -0.30 0.00 0.00 0.00 0.00 44.72 42.98 3f83 s GLY 43 CO 0.36 -1.48 1.28 -0.45 0.00 0.00 0.00 173.10 172.80 3f83 s SER 44 N -2.55 6.94 0.35 1.64 0.15 -1.26 -4.86 113.70 114.12 3f83 s SER 44 Ca 0.14 2.37 -0.26 0.00 0.70 0.00 0.00 55.95 58.89 3f83 s SER 44 Cb -0.06 -2.61 -0.09 0.00 -1.71 0.00 0.00 66.02 61.55 3f83 s SER 44 CO 0.06 -0.48 1.07 -0.94 1.20 0.00 0.00 173.24 174.15 3f83 s SER 45 N 0.23 6.96 0.70 5.45 1.04 -1.26 -4.86 113.70 121.95 3f83 s SER 45 Ca 0.55 2.15 -0.04 0.00 0.48 0.00 0.00 55.95 59.09 3f83 s SER 45 Cb -0.36 -2.60 0.09 0.00 0.10 0.00 0.00 66.02 63.25 3f83 s SER 45 CO 0.38 -0.35 0.98 -2.16 0.98 0.00 0.00 173.24 173.07 3f83 s PRO 46 N -2.04 1.98 0.30 4.02 0.04 -1.26 -0.21 135.00 137.83 3f83 s PRO 46 Ca 0.52 -0.64 -0.29 0.00 0.04 0.00 0.00 61.00 60.63 3f83 s PRO 46 Cb -0.27 -2.26 -0.11 0.00 0.04 0.00 0.00 34.50 31.91 3f83 s PRO 46 CO 0.34 -1.28 1.47 0.42 0.04 0.00 0.00 177.00 177.98 3f83 s ILE 47 N -3.16 2.39 -0.19 0.56 1.01 -1.26 -4.42 121.20 116.13 3f83 s ILE 47 Ca 0.63 0.35 -0.00 0.00 0.00 0.00 0.00 60.65 61.62 3f83 s ILE 47 Cb -0.08 -3.22 0.01 0.00 0.01 0.00 0.00 42.46 39.17 3f83 s ILE 47 CO 0.44 0.07 -0.15 -0.31 0.00 0.00 0.00 174.94 174.98 3f83 s TYR 48 N -0.43 2.83 0.16 3.97 1.51 -0.74 -4.97 117.35 119.68 3f83 s TYR 48 Ca 0.57 -1.40 -0.30 0.00 -1.01 0.00 0.00 57.07 54.93 3f83 s TYR 48 Cb -0.44 -1.97 -0.07 0.00 -0.11 0.00 0.00 41.96 39.37 3f83 s TYR 48 CO 0.50 -0.71 1.01 -0.80 -1.11 0.00 0.00 175.55 174.44 3f83 s ASN 49 N 1.30 7.44 -0.15 2.29 0.01 -1.26 -0.41 114.94 124.16 3f83 s ASN 49 Ca 0.04 1.93 0.02 0.00 -0.71 0.00 0.00 52.86 54.14 3f83 s ASN 49 Cb -0.14 -2.60 -0.10 0.00 0.41 0.00 0.00 41.25 38.82 3f83 s ASN 49 CO -0.09 -0.08 -0.12 -0.38 -1.51 0.00 0.00 177.10 174.91 3f83 n ILE 50 N 2.41 0.87 -3.78 0.60 5.41 -0.00 -4.93 119.36 119.94 3f83 n ILE 50 Ca 0.02 -0.34 -0.13 0.00 1.00 0.00 0.00 62.75 63.30 3f83 n ILE 50 Cb 0.48 -1.02 -0.13 0.00 -0.71 0.00 0.00 39.64 38.26 3f83 n ILE 50 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3f83 s LEU 51 N -5.83 0.97 -0.33 1.39 1.43 -0.79 -4.94 118.68 110.58 3f83 s LEU 51 Ca -0.20 0.40 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 3f83 s LEU 51 Cb 0.05 0.61 0.10 0.00 0.03 0.00 0.00 46.19 46.98 3f83 s LEU 51 CO 0.36 -0.10 0.09 0.21 0.23 0.00 0.00 176.35 177.14 3f83 s ASN 52 N 0.58 4.27 -1.28 2.29 2.47 -1.26 -1.57 114.94 120.44 3f83 s ASN 52 Ca -0.04 -1.89 -0.00 0.00 0.42 0.00 0.00 52.86 51.35 3f83 s ASN 52 Cb -0.05 -1.14 -0.00 0.00 -1.45 0.00 0.00 41.25 38.60 3f83 s ASN 52 CO -0.03 -0.39 0.76 -1.20 -3.72 0.00 0.00 177.10 172.52 3f83 n SER 53 N 4.55 -1.44 -4.71 -4.21 7.64 -1.11 -4.91 113.62 109.43 3f83 n SER 53 Ca 0.01 -0.78 -0.42 0.00 1.01 0.00 0.00 58.87 58.69 3f83 n SER 53 Cb 0.41 -4.29 -0.03 0.00 -1.01 0.00 0.00 64.21 59.30 3f83 n SER 53 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 3f83 s TYR 54 N -3.60 3.40 -0.10 1.43 5.04 0.29 -4.68 117.35 119.14 3f83 s TYR 54 Ca 0.01 1.32 -0.30 0.00 -2.44 0.00 0.00 57.07 55.67 3f83 s TYR 54 Cb -0.00 -3.39 -0.03 0.00 0.35 0.00 0.00 41.96 38.89 3f83 s TYR 54 CO 0.79 -1.15 1.41 -1.17 -1.34 0.00 0.00 175.55 174.10 3f83 s LEU 55 N 1.33 4.25 -0.17 6.97 2.96 -1.26 0.53 118.68 133.29 3f83 s LEU 55 Ca 0.57 1.94 0.16 0.00 -0.22 0.00 0.00 54.13 56.58 3f83 s LEU 55 Cb -0.27 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.65 3f83 s LEU 55 CO 0.27 -0.80 0.08 0.35 -1.32 0.00 0.00 176.35 174.94 3f83 n THR 56 N 5.25 1.15 -3.61 3.68 -2.24 -0.42 -4.94 114.28 113.15 3f83 n THR 56 Ca 0.15 -0.73 -0.11 0.00 -2.27 0.00 0.00 64.05 61.08 3f83 n THR 56 Cb 0.44 -0.49 -0.06 0.00 -2.10 0.00 0.00 70.33 68.11 3f83 n THR 56 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f83 s ALA 57 N -2.48 -1.90 -0.26 6.98 0.00 -1.18 -3.56 121.76 119.36 3f83 s ALA 57 Ca -0.09 1.77 -0.23 0.00 0.00 0.00 0.00 51.96 53.41 3f83 s ALA 57 Cb 0.06 -1.06 0.07 0.00 0.00 0.00 0.00 23.12 22.19 3f83 s ALA 57 CO 0.73 -0.29 0.69 -0.47 0.00 0.00 0.00 175.76 176.42 3f83 s TYR 58 N -0.22 -0.79 -0.12 0.00 5.04 0.03 -1.80 117.35 119.50 3f83 s TYR 58 Ca -0.00 1.88 -0.04 0.00 -2.44 0.00 0.00 57.07 56.47 3f83 s TYR 58 Cb -0.03 0.30 0.06 0.00 0.35 0.00 0.00 41.96 42.63 3f83 s TYR 58 CO -0.01 -0.38 0.23 1.21 -1.34 0.00 0.00 175.55 175.26 3f83 s ASN 59 N 0.49 0.50 0.26 4.32 2.47 -0.73 -0.41 114.94 121.84 3f83 s ASN 59 Ca -0.01 0.50 0.14 0.00 0.42 0.00 0.00 52.86 53.91 3f83 s ASN 59 Cb -0.05 0.57 0.07 0.00 -1.45 0.00 0.00 41.25 40.39 3f83 s ASN 59 CO -0.01 -0.24 1.44 1.23 -3.72 0.00 0.00 177.10 175.80 3f83 h GLY 60 N 8.31 0.00 0.45 1.21 0.00 -1.95 -3.36 103.07 107.73 3f83 h GLY 60 Ca -0.14 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 46.91 3f83 h GLY 60 CO 0.14 0.00 -1.99 -1.14 0.00 0.00 0.00 176.54 173.55 3f83 n SER 61 N -3.27 0.39 -4.29 0.19 3.41 -1.26 -4.97 113.62 103.83 3f83 n SER 61 Ca 0.02 0.18 -0.18 0.00 -0.26 0.00 0.00 58.87 58.62 3f83 n SER 61 Cb 0.75 0.65 -0.11 0.00 -0.26 0.00 0.00 64.21 65.24 3f83 n SER 61 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3f83 s HIS 62 N -2.69 1.55 -0.70 7.33 3.76 -1.26 -5.05 115.29 118.23 3f83 s HIS 62 Ca -0.07 -0.57 -0.02 0.00 -0.15 0.00 0.00 55.06 54.25 3f83 s HIS 62 Cb 0.08 -0.77 0.33 0.00 1.11 0.00 0.00 32.58 33.33 3f83 s HIS 62 CO 0.83 0.23 2.13 0.72 -0.85 0.00 0.00 174.74 177.80 3f83 n HIS 63 N 0.15 2.77 -0.27 1.40 8.25 -1.26 -4.58 115.22 121.68 3f83 n HIS 63 Ca -0.12 -2.47 -0.04 0.00 -0.26 0.00 0.00 57.72 54.82 3f83 n HIS 63 Cb 0.58 -1.28 0.10 0.00 1.12 0.00 0.00 29.99 30.51 3f83 n HIS 63 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3f83 h LEU 64 N 2.76 1.04 -4.73 2.41 3.38 -1.89 -3.25 115.31 115.04 3f83 h LEU 64 Ca 0.54 -0.14 -0.70 0.00 0.09 0.00 0.00 57.88 57.67 3f83 h LEU 64 Cb 0.44 -0.27 -0.32 0.00 0.09 0.00 0.00 40.66 40.60 3f83 h LEU 64 CO 1.36 0.90 0.44 -1.22 0.09 0.00 0.00 178.44 180.02 3f83 n TYR 65 N -4.30 3.12 0.75 1.13 0.53 -1.26 -4.53 117.16 112.60 3f83 n TYR 65 Ca 0.07 -2.61 0.12 0.00 -1.02 0.00 0.00 57.90 54.46 3f83 n TYR 65 Cb 0.16 -0.85 0.26 0.00 -1.03 0.00 0.00 39.34 37.89 3f83 n TYR 65 CO 0.00 0.00 0.00 -0.40 -1.02 0.00 0.00 176.86 175.44 3f83 n ASP 66 N -0.56 2.76 -2.64 7.72 5.75 -1.23 -3.24 116.55 125.11 3f83 n ASP 66 Ca 0.50 -1.89 -0.06 0.00 -0.01 0.00 0.00 54.79 53.33 3f83 n ASP 66 Cb 0.42 -0.16 0.04 0.00 -1.03 0.00 0.00 41.12 40.39 3f83 n ASP 66 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3f83 n ARG 67 N 1.05 2.13 -2.00 0.11 1.74 -1.26 -4.63 116.66 113.80 3f83 n ARG 67 Ca 0.18 -3.66 -0.41 0.00 -0.77 0.00 0.00 57.85 53.19 3f83 n ARG 67 Cb 0.51 -1.74 -0.02 0.00 -1.02 0.00 0.00 32.46 30.19 3f83 n ARG 67 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 3f83 s MET 68 N -3.71 4.27 0.06 5.56 -1.94 -1.26 -4.40 119.30 117.86 3f83 s MET 68 Ca 0.33 2.34 0.00 0.00 -1.71 0.00 0.00 55.69 56.65 3f83 s MET 68 Cb 0.35 -3.05 -0.03 0.00 2.01 0.00 0.00 34.83 34.10 3f83 s MET 68 CO -0.02 -0.35 -0.05 -1.12 -0.01 0.00 0.00 175.02 173.48 3f83 s SER 69 N -0.15 0.67 -0.13 3.03 0.01 0.13 -4.89 113.70 112.37 3f83 s SER 69 Ca 0.53 -0.83 -0.01 0.00 1.31 0.00 0.00 55.95 56.96 3f83 s SER 69 Cb -0.42 0.13 0.03 0.00 0.21 0.00 0.00 66.02 65.97 3f83 s SER 69 CO 0.53 -0.44 -0.06 -0.36 0.41 0.00 0.00 173.24 173.32 3f83 s PHE 70 N -2.93 1.48 -0.04 2.43 0.40 -0.64 -0.62 117.98 118.05 3f83 s PHE 70 Ca 0.01 -0.82 0.06 0.00 -0.60 0.00 0.00 56.93 55.58 3f83 s PHE 70 Cb 0.01 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.30 3f83 s PHE 70 CO -0.05 -0.54 -0.22 -0.51 0.70 0.00 0.00 175.22 174.60 3f83 s LEU 71 N 1.71 2.28 0.92 -0.37 1.43 -0.50 -4.09 118.68 120.06 3f83 s LEU 71 Ca 0.03 -0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 52.62 3f83 s LEU 71 Cb -0.14 -1.42 0.14 0.00 0.03 0.00 0.00 46.19 44.81 3f83 s LEU 71 CO -0.08 0.31 1.09 0.00 0.23 0.00 0.00 176.35 177.90 3f83 n LEU 73 N -3.96 0.27 -3.54 0.00 4.77 -1.26 -4.41 117.00 108.88 3f83 n LEU 73 Ca 0.07 0.09 -0.14 0.00 -0.03 0.00 0.00 56.01 56.00 3f83 n LEU 73 Cb 0.56 -0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 3f83 n LEU 73 CO 0.56 0.05 0.60 -0.55 -1.33 0.00 0.00 177.39 176.72 3f83 s SER 74 N -2.43 -0.51 0.18 -1.43 0.15 -1.26 -5.02 113.70 103.37 3f83 s SER 74 Ca 0.32 0.48 0.24 0.00 0.70 0.00 0.00 55.95 57.68 3f83 s SER 74 Cb 0.20 0.43 0.24 0.00 -1.71 0.00 0.00 66.02 65.19 3f83 s SER 74 CO 0.45 -0.52 1.26 0.28 1.20 0.00 0.00 173.24 175.91 3f83 h SER 75 N 2.67 0.00 0.00 5.45 0.02 -1.88 -2.75 113.55 117.06 3f83 h SER 75 Ca -0.23 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 3f83 h SER 75 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3f83 h SER 75 CO 0.35 0.06 -0.56 0.00 -1.14 0.00 0.00 176.83 175.54 3f83 n GLN 76 N -2.38 2.32 -2.59 3.45 10.64 -1.26 -4.09 117.38 123.46 3f83 n GLN 76 Ca 0.02 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.77 3f83 n GLN 76 Cb 0.48 -0.78 -0.03 0.00 -0.86 0.00 0.00 30.24 29.06 3f83 n GLN 76 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 3f83 s ASN 77 N -1.90 7.25 0.00 2.61 2.47 -1.26 -4.88 114.94 119.22 3f83 s ASN 77 Ca 0.00 1.82 0.24 0.00 0.42 0.00 0.00 52.86 55.34 3f83 s ASN 77 Cb 0.00 -2.57 0.29 0.00 -1.45 0.00 0.00 41.25 37.52 3f83 s ASN 77 CO 0.00 -0.35 1.27 0.41 -3.72 0.00 0.00 177.10 174.71 3f83 n THR 78 N 3.90 0.00 -0.25 -5.21 -1.04 -1.26 -3.70 114.28 106.71 3f83 n THR 78 Ca 0.07 -0.12 -0.01 0.00 -2.04 0.00 0.00 64.05 61.95 3f83 n THR 78 Cb 0.49 0.75 0.06 0.00 -1.82 0.00 0.00 70.33 69.81 3f83 n THR 78 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3f83 h LEU 79 N 1.15 -0.90 -2.91 -4.42 5.85 -1.92 -1.75 115.31 110.41 3f83 h LEU 79 Ca 0.00 0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 3f83 h LEU 79 Cb 0.58 0.52 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 3f83 h LEU 79 CO 0.00 -0.27 -0.11 0.59 -0.34 0.00 0.00 178.44 178.31 3f83 n ASN 80 N -5.47 2.07 0.00 1.25 3.02 -1.26 -4.47 115.26 110.40 3f83 n ASN 80 Ca 0.08 -3.07 0.00 0.00 -0.03 0.00 0.00 54.58 51.56 3f83 n ASN 80 Cb 0.37 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 3f83 n ASN 80 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f83 n GLY 81 N -1.26 2.32 3.55 7.41 0.00 -0.81 -1.02 105.19 115.38 3f83 n GLY 81 Ca 0.15 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.61 3f83 n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f83 s ALA 82 N 0.00 3.13 0.09 4.61 0.00 0.32 -4.21 121.76 125.69 3f83 s ALA 82 Ca 0.00 -0.80 -0.26 0.00 0.00 0.00 0.00 51.96 50.91 3f83 s ALA 82 Cb 0.00 -1.64 0.09 0.00 0.00 0.00 0.00 23.12 21.57 3f83 s ALA 82 CO 0.00 0.24 1.15 0.00 0.00 0.00 0.00 175.76 177.15 3f83 n PRO 84 N -0.72 1.28 -0.16 0.00 -0.02 -1.26 -3.73 135.00 130.38 3f83 n PRO 84 Ca -0.02 0.46 0.07 0.00 -2.02 0.00 0.00 63.50 61.99 3f83 n PRO 84 Cb 0.60 -2.12 0.10 0.00 -0.02 0.00 0.00 33.50 32.06 3f83 n PRO 84 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3f83 n SER 85 N 2.63 1.77 -4.00 2.55 3.41 -1.26 -2.66 113.62 116.07 3f83 n SER 85 Ca 0.18 -2.76 -0.09 0.00 -0.26 0.00 0.00 58.87 55.94 3f83 n SER 85 Cb 0.20 -0.35 -0.08 0.00 -0.26 0.00 0.00 64.21 63.72 3f83 n SER 85 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3f83 s SER 86 N -2.32 0.13 0.60 4.04 1.04 -1.26 -4.86 113.70 111.07 3f83 s SER 86 Ca 0.23 -0.93 -0.18 0.00 0.48 0.00 0.00 55.95 55.54 3f83 s SER 86 Cb 0.20 0.38 -0.06 0.00 0.10 0.00 0.00 66.02 66.64 3f83 s SER 86 CO 0.02 -0.82 0.84 0.47 0.98 0.00 0.00 173.24 174.73 3f83 n ASP 87 N -0.15 0.26 -4.77 7.02 8.00 -1.26 -4.96 116.55 120.70 3f83 n ASP 87 Ca -0.08 0.78 -0.35 0.00 0.71 0.00 0.00 54.79 55.85 3f83 n ASP 87 Cb 0.63 -1.33 0.01 0.00 -0.02 0.00 0.00 41.12 40.41 3f83 n ASP 87 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3f83 s ALA 88 N -1.57 2.64 0.00 2.24 0.00 -1.24 -5.01 121.76 118.81 3f83 s ALA 88 Ca 0.74 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.56 3f83 s ALA 88 Cb -0.42 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.32 3f83 s ALA 88 CO 0.49 -0.91 0.60 -2.30 0.00 0.00 0.00 175.76 173.63 3f83 n PRO 89 N -1.46 0.00 -0.23 0.00 -0.02 -1.26 -4.93 135.00 127.10 3f83 n PRO 89 Ca 0.12 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3f83 n PRO 89 Cb 0.51 -1.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.89 3f83 n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f83 n GLY 90 N -0.75 2.03 0.10 -1.23 0.00 -1.26 -5.01 105.19 99.08 3f83 n GLY 90 Ca 0.00 -2.06 0.13 0.00 0.00 0.00 0.00 46.02 44.09 3f83 n GLY 90 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3f83 h THR 91 N 0.01 0.00 -2.93 2.61 1.35 -1.98 -3.45 112.91 108.52 3f83 h THR 91 Ca 0.00 -0.53 -0.53 0.00 -0.55 0.00 0.00 66.41 64.79 3f83 h THR 91 Cb 0.00 1.42 0.02 0.00 -1.73 0.00 0.00 68.15 67.85 3f83 h THR 91 CO 0.00 0.00 0.80 0.00 -0.25 0.00 0.00 175.52 176.07 3f83 s ALA 92 N -3.13 3.61 0.53 6.62 0.00 -1.26 -4.74 121.76 123.38 3f83 s ALA 92 Ca 0.09 1.06 -0.20 0.00 0.00 0.00 0.00 51.96 52.92 3f83 s ALA 92 Cb 0.12 -3.58 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 3f83 s ALA 92 CO 0.64 -0.77 1.13 0.95 0.00 0.00 0.00 175.76 177.71 3f83 s THR 93 N 1.70 3.16 -0.48 0.00 -4.23 -1.26 -4.64 115.64 109.90 3f83 s THR 93 Ca 0.66 0.74 -0.15 0.00 -1.18 0.00 0.00 61.69 61.76 3f83 s THR 93 Cb -0.36 -3.31 0.09 0.00 1.34 0.00 0.00 72.50 70.26 3f83 s THR 93 CO 0.29 -0.14 0.40 -0.63 -0.54 0.00 0.00 174.62 174.00 3f83 s ILE 94 N -1.75 5.07 0.33 2.99 1.01 -1.26 -5.00 121.20 122.60 3f83 s ILE 94 Ca 0.72 -1.20 -0.26 0.00 0.00 0.00 0.00 60.65 59.90 3f83 s ILE 94 Cb -0.24 -4.09 -0.10 0.00 0.01 0.00 0.00 42.46 38.04 3f83 s ILE 94 CO 0.28 -0.63 0.98 -1.81 0.00 0.00 0.00 174.94 173.76 3f83 s ASP 95 N 2.72 7.20 0.00 3.58 1.01 -1.26 -1.40 116.67 128.52 3f83 s ASP 95 Ca 0.04 1.93 0.00 0.00 0.71 0.00 0.00 52.55 55.23 3f83 s ASP 95 Cb -0.25 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.09 3f83 s ASP 95 CO 0.05 -0.17 0.00 0.61 0.21 0.00 0.00 175.17 175.87 3f83 n GLY 96 N 0.60 0.29 3.45 0.21 0.00 -0.77 -4.75 105.19 104.22 3f83 n GLY 96 Ca 0.02 -2.14 -0.22 0.00 0.00 0.00 0.00 46.02 43.68 3f83 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3f83 s GLU 97 N 0.00 1.60 -0.16 1.61 2.02 -1.26 -2.70 118.70 119.81 3f83 s GLU 97 Ca 0.00 -1.80 -0.07 0.00 0.02 0.00 0.00 54.97 53.12 3f83 s GLU 97 Cb 0.00 -1.35 -0.04 0.00 0.10 0.00 0.00 34.13 32.84 3f83 s GLU 97 CO 0.00 0.11 0.09 0.99 0.02 0.00 0.00 175.26 176.47 3f83 s THR 98 N -2.86 5.04 -0.16 3.63 2.01 0.18 -4.80 115.64 118.68 3f83 s THR 98 Ca 0.29 0.05 -0.23 0.00 0.31 0.00 0.00 61.69 62.12 3f83 s THR 98 Cb 0.02 -3.25 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 3f83 s THR 98 CO 0.13 0.51 0.70 0.20 -0.69 0.00 0.00 174.62 175.47 3f83 s ASN 99 N -0.08 6.84 -0.12 3.53 0.01 -1.26 -1.49 114.94 122.37 3f83 s ASN 99 Ca 0.08 1.02 0.01 0.00 -0.71 0.00 0.00 52.86 53.26 3f83 s ASN 99 Cb -0.12 -2.39 -0.01 0.00 0.41 0.00 0.00 41.25 39.14 3f83 s ASN 99 CO 0.01 -0.27 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.53 3f83 s ILE 100 N 1.70 2.76 -0.29 0.60 1.01 0.47 -4.59 121.20 122.86 3f83 s ILE 100 Ca 0.34 -0.77 -0.10 0.00 0.00 0.00 0.00 60.65 60.12 3f83 s ILE 100 Cb -0.16 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.15 3f83 s ILE 100 CO 0.13 0.54 0.15 -0.89 0.00 0.00 0.00 174.94 174.86 3f83 s THR 101 N 0.33 4.80 -0.07 2.92 2.01 -0.48 -0.22 115.64 124.92 3f83 s THR 101 Ca -0.13 -0.18 0.03 0.00 0.31 0.00 0.00 61.69 61.72 3f83 s THR 101 Cb -0.16 -3.36 0.01 0.00 0.01 0.00 0.00 72.50 69.00 3f83 s THR 101 CO 0.07 0.18 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.81 3f83 s LEU 102 N 1.67 1.74 -0.08 4.42 2.96 0.20 -0.52 118.68 129.06 3f83 s LEU 102 Ca 0.06 -0.35 -0.30 0.00 -0.22 0.00 0.00 54.13 53.33 3f83 s LEU 102 Cb -0.16 -0.93 -0.02 0.00 0.50 0.00 0.00 46.19 45.57 3f83 s LEU 102 CO 0.07 0.06 1.15 -1.58 -1.32 0.00 0.00 176.35 174.73 3f83 s GLN 103 N 0.56 4.36 -0.10 1.98 0.74 -0.72 -1.24 119.66 125.24 3f83 s GLN 103 Ca -0.14 1.59 -0.02 0.00 0.05 0.00 0.00 55.36 56.83 3f83 s GLN 103 Cb -0.16 -3.56 -0.03 0.00 1.10 0.00 0.00 33.01 30.36 3f83 s GLN 103 CO 0.05 -0.43 -0.01 -0.06 -0.55 0.00 0.00 175.29 174.29 3f83 s PHE 104 N 2.24 3.13 -0.15 1.67 0.40 0.39 -4.46 117.98 121.20 3f83 s PHE 104 Ca 0.53 0.12 0.01 0.00 -0.60 0.00 0.00 56.93 56.99 3f83 s PHE 104 Cb -0.22 -1.81 0.00 0.00 0.51 0.00 0.00 43.02 41.49 3f83 s PHE 104 CO 0.20 0.39 -0.18 0.99 0.70 0.00 0.00 175.22 177.32 3f83 s THR 105 N -0.68 2.43 0.08 0.64 2.01 0.78 -0.83 115.64 120.06 3f83 s THR 105 Ca 0.11 -0.85 -0.31 0.00 0.31 0.00 0.00 61.69 60.95 3f83 s THR 105 Cb -0.12 -2.01 -0.06 0.00 0.01 0.00 0.00 72.50 70.32 3f83 s THR 105 CO 0.02 0.53 1.25 -0.70 -0.69 0.00 0.00 174.62 175.03 3f83 s GLU 106 N 0.85 4.40 0.19 4.92 -6.30 0.67 -1.06 118.70 122.37 3f83 s GLU 106 Ca -0.05 1.86 -0.13 0.00 -2.50 0.00 0.00 54.97 54.14 3f83 s GLU 106 Cb -0.15 -3.32 0.20 0.00 0.00 0.00 0.00 34.13 30.86 3f83 s GLU 106 CO -0.01 -0.31 1.69 -0.22 0.02 0.00 0.00 175.26 176.43 3f83 h LYS 107 N 6.79 0.13 0.12 4.30 3.64 -0.72 0.58 116.57 131.40 3f83 h LYS 107 Ca -0.42 -0.01 -0.35 0.00 -1.27 0.00 0.00 60.65 58.61 3f83 h LYS 107 Cb 1.21 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 3f83 h LYS 107 CO 0.83 0.09 -1.85 0.00 -2.27 0.00 0.00 179.45 176.24 3f83 h ARG 108 N 0.13 0.26 0.00 1.90 2.47 -1.84 -3.38 114.38 113.91 3f83 h ARG 108 Ca 0.26 -0.44 0.00 0.00 -1.26 0.00 0.00 59.98 58.54 3f83 h ARG 108 Cb 0.39 0.16 0.00 0.00 -1.65 0.00 0.00 29.97 28.88 3f83 h ARG 108 CO -0.42 1.13 -0.89 0.66 0.56 0.00 0.00 179.97 181.01 3f83 h SER 109 N 0.07 0.00 0.00 7.04 4.64 -1.84 -3.48 113.55 119.99 3f83 h SER 109 Ca -0.37 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3f83 h SER 109 Cb 2.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.13 3f83 h SER 109 CO 0.12 0.01 0.00 0.18 -0.87 0.00 0.00 176.83 176.26 3f83 n LEU 110 N -2.68 0.57 -4.77 5.97 4.77 0.19 -4.99 117.00 116.07 3f83 n LEU 110 Ca 0.01 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.60 3f83 n LEU 110 Cb 0.54 -1.58 -0.01 0.00 -2.33 0.00 0.00 43.42 40.04 3f83 n LEU 110 CO 0.39 -0.55 0.87 -0.63 -1.33 0.00 0.00 177.39 176.14 3f83 s ILE 111 N -1.49 2.98 0.05 -0.08 -1.09 -1.26 -4.67 121.20 115.64 3f83 s ILE 111 Ca 0.00 0.82 0.08 0.00 -2.23 0.00 0.00 60.65 59.32 3f83 s ILE 111 Cb 0.00 -3.46 -0.03 0.00 -1.58 0.00 0.00 42.46 37.39 3f83 s ILE 111 CO 0.00 0.07 -0.21 -0.54 -1.23 0.00 0.00 174.94 173.03 3f83 s LYS 112 N -2.37 1.94 0.01 2.79 1.02 -1.26 -0.23 119.74 121.63 3f83 s LYS 112 Ca 0.59 -1.05 -0.11 0.00 0.02 0.00 0.00 55.97 55.42 3f83 s LYS 112 Cb -0.32 -2.11 0.01 0.00 -0.52 0.00 0.00 37.83 34.89 3f83 s LYS 112 CO 0.41 0.52 0.22 1.03 -0.92 0.00 0.00 175.35 176.60 3f83 s ARG 113 N -1.47 0.62 -0.24 1.68 1.81 -0.01 -4.97 118.95 116.37 3f83 s ARG 113 Ca 0.14 -0.42 -0.09 0.00 -1.72 0.00 0.00 55.73 53.64 3f83 s ARG 113 Cb -0.10 0.26 -0.04 0.00 -0.45 0.00 0.00 34.95 34.62 3f83 s ARG 113 CO 0.05 -0.17 0.12 -1.21 -0.68 0.00 0.00 175.30 173.41 3f83 s GLU 114 N -1.82 3.90 0.28 3.54 2.02 -1.26 0.15 118.70 125.51 3f83 s GLU 114 Ca -0.11 -0.36 0.10 0.00 0.02 0.00 0.00 54.97 54.62 3f83 s GLU 114 Cb -0.04 -3.43 -0.05 0.00 0.10 0.00 0.00 34.13 30.71 3f83 s GLU 114 CO 0.00 -0.02 -0.04 -0.51 0.02 0.00 0.00 175.26 174.71 3f83 s LEU 115 N 1.23 3.03 -0.05 1.80 1.43 -0.38 -4.90 118.68 120.84 3f83 s LEU 115 Ca 0.06 -0.80 -0.19 0.00 -1.03 0.00 0.00 54.13 52.18 3f83 s LEU 115 Cb -0.14 -1.52 -0.05 0.00 0.03 0.00 0.00 46.19 44.51 3f83 s LEU 115 CO 0.05 -0.04 0.52 -1.10 0.23 0.00 0.00 176.35 176.01 3f83 s GLN 116 N -3.65 4.27 -0.01 1.70 -1.52 -1.26 -0.63 119.66 118.55 3f83 s GLN 116 Ca 0.32 0.58 0.08 0.00 -1.95 0.00 0.00 55.36 54.38 3f83 s GLN 116 Cb -0.05 -3.36 -0.02 0.00 -0.22 0.00 0.00 33.01 29.36 3f83 s GLN 116 CO 0.19 0.33 -0.24 0.42 -0.25 0.00 0.00 175.29 175.74 3f83 s ILE 117 N 0.00 2.21 -0.12 1.08 -1.09 0.69 -4.37 121.20 119.60 3f83 s ILE 117 Ca 0.28 -1.10 -0.04 0.00 -2.23 0.00 0.00 60.65 57.55 3f83 s ILE 117 Cb -0.17 -1.79 -0.04 0.00 -1.58 0.00 0.00 42.46 38.88 3f83 s ILE 117 CO 0.14 0.55 0.04 -0.54 -1.23 0.00 0.00 174.94 173.90 3f83 s LYS 118 N -0.73 3.37 0.04 2.79 -0.14 0.55 -0.39 119.74 125.22 3f83 s LYS 118 Ca 0.11 -0.34 0.02 0.00 -1.36 0.00 0.00 55.97 54.40 3f83 s LYS 118 Cb -0.10 -2.99 -0.02 0.00 -1.68 0.00 0.00 37.83 33.03 3f83 s LYS 118 CO -0.00 0.59 -0.08 0.20 -0.76 0.00 0.00 175.35 175.30 3f83 s GLY 119 N -0.53 0.52 0.23 -3.33 0.00 -0.56 -0.55 107.32 103.10 3f83 s GLY 119 Ca 0.10 -0.78 -0.19 0.00 0.00 0.00 0.00 44.72 43.85 3f83 s GLY 119 CO 0.02 -0.83 0.60 -2.52 0.00 0.00 0.00 173.10 170.37 3f83 s TYR 120 N -1.43 -0.12 0.18 1.90 -0.85 0.39 0.47 117.35 117.88 3f83 s TYR 120 Ca -0.09 -0.26 0.03 0.00 -0.52 0.00 0.00 57.07 56.23 3f83 s TYR 120 Cb -0.10 0.50 -0.05 0.00 0.38 0.00 0.00 41.96 42.70 3f83 s TYR 120 CO 0.00 -1.05 -0.05 -1.59 -1.52 0.00 0.00 175.55 171.35 3f83 s LYS 121 N -3.90 1.14 0.02 -3.49 -2.85 -0.04 -0.16 119.74 110.47 3f83 s LYS 121 Ca 0.11 -1.53 0.01 0.00 -1.00 0.00 0.00 55.97 53.56 3f83 s LYS 121 Cb -0.03 -0.53 -0.01 0.00 -2.06 0.00 0.00 37.83 35.20 3f83 s LYS 121 CO 0.02 -0.02 -0.04 -0.65 0.10 0.00 0.00 175.35 174.75 3f83 s GLN 122 N -3.82 0.33 -0.06 1.78 -0.21 -0.82 -0.66 119.66 116.19 3f83 s GLN 122 Ca 0.22 -0.47 -0.07 0.00 0.02 0.00 0.00 55.36 55.05 3f83 s GLN 122 Cb 0.04 -0.10 -0.04 0.00 1.00 0.00 0.00 33.01 33.91 3f83 s GLN 122 CO 0.03 0.01 0.20 -0.06 -2.12 0.00 0.00 175.29 173.35 3f83 s PHE 123 N -0.96 3.60 -0.13 0.91 0.40 -1.26 -1.41 117.98 119.13 3f83 s PHE 123 Ca -0.09 0.56 -0.04 0.00 -0.60 0.00 0.00 56.93 56.76 3f83 s PHE 123 Cb -0.07 -1.97 -0.03 0.00 0.51 0.00 0.00 43.02 41.46 3f83 s PHE 123 CO -0.00 0.69 0.02 -0.51 0.70 0.00 0.00 175.22 176.12 3f83 s LEU 124 N -1.33 3.66 0.02 -0.37 1.43 0.27 -4.70 118.68 117.66 3f83 s LEU 124 Ca 0.20 0.10 0.07 0.00 -1.03 0.00 0.00 54.13 53.47 3f83 s LEU 124 Cb -0.13 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 44.19 3f83 s LEU 124 CO 0.10 0.28 -0.21 -0.36 0.23 0.00 0.00 176.35 176.38 3f83 s PHE 125 N -0.26 1.88 0.14 0.29 0.40 -1.26 -0.02 117.98 119.14 3f83 s PHE 125 Ca 0.07 -0.37 -0.18 0.00 -0.60 0.00 0.00 56.93 55.85 3f83 s PHE 125 Cb -0.12 -1.16 -0.03 0.00 0.51 0.00 0.00 43.02 42.22 3f83 s PHE 125 CO 0.02 0.04 1.78 0.87 0.70 0.00 0.00 175.22 178.63 3f83 h LYS 126 N 5.19 0.41 -0.17 0.44 1.57 -1.95 -3.34 116.57 118.72 3f83 h LYS 126 Ca -0.41 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3f83 h LYS 126 Cb 1.15 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.37 3f83 h LYS 126 CO 0.46 0.29 0.00 0.09 -0.57 0.00 0.00 179.45 179.71 3f83 n ASN 127 N -4.86 2.46 -3.75 0.86 3.02 -1.26 -5.05 115.26 106.68 3f83 n ASN 127 Ca -0.01 -2.02 -0.10 0.00 -0.03 0.00 0.00 54.58 52.42 3f83 n ASN 127 Cb 0.03 -0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.04 3f83 n ASN 127 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3f83 s ALA 128 N -1.04 -0.20 -0.13 5.41 0.00 -1.25 -5.15 121.76 119.41 3f83 s ALA 128 Ca 0.12 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.15 3f83 s ALA 128 Cb 0.06 1.03 0.02 0.00 0.00 0.00 0.00 23.12 24.23 3f83 s ALA 128 CO 0.08 -0.87 -0.11 -0.80 0.00 0.00 0.00 175.76 174.05 3f83 s ASN 129 N -3.05 2.41 -0.40 0.00 -0.87 -1.26 -4.24 114.94 107.52 3f83 s ASN 129 Ca 0.22 -0.39 0.03 0.00 -1.57 0.00 0.00 52.86 51.15 3f83 s ASN 129 Cb -0.01 -1.01 0.16 0.00 -0.02 0.00 0.00 41.25 40.37 3f83 s ASN 129 CO 0.11 -0.07 0.32 0.00 -2.57 0.00 0.00 177.10 174.89 3f83 n PRO 131 N 3.08 1.18 -1.77 0.00 -0.04 -1.26 -4.54 135.00 131.64 3f83 n PRO 131 Ca 0.26 -0.40 -0.39 0.00 -0.04 0.00 0.00 63.50 62.94 3f83 n PRO 131 Cb 0.46 -1.17 0.04 0.00 -0.04 0.00 0.00 33.50 32.78 3f83 n PRO 131 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3f83 s SER 132 N 0.66 5.34 -0.13 3.54 0.01 -1.26 -4.96 113.70 116.92 3f83 s SER 132 Ca 0.07 2.81 -0.20 0.00 1.31 0.00 0.00 55.95 59.94 3f83 s SER 132 Cb 0.06 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 3f83 s SER 132 CO 0.01 -1.52 0.58 -0.54 0.41 0.00 0.00 173.24 172.18 3f83 s LYS 133 N -2.84 4.33 0.14 12.44 1.02 -1.26 -4.55 119.74 129.02 3f83 s LYS 133 Ca 0.70 0.62 0.11 0.00 0.02 0.00 0.00 55.97 57.42 3f83 s LYS 133 Cb -0.41 -3.48 -0.04 0.00 -0.52 0.00 0.00 37.83 33.38 3f83 s LYS 133 CO 0.50 0.02 -0.26 -0.51 -0.92 0.00 0.00 175.35 174.17 3f83 s LEU 134 N 1.04 2.33 0.61 3.17 1.43 0.16 -1.84 118.68 125.58 3f83 s LEU 134 Ca 0.30 -0.76 -0.19 0.00 -1.03 0.00 0.00 54.13 52.45 3f83 s LEU 134 Cb -0.16 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 3f83 s LEU 134 CO 0.13 0.16 1.14 0.00 0.23 0.00 0.00 176.35 178.00 3f83 n ALA 135 N 0.84 0.72 -0.21 4.21 0.00 -0.50 -0.86 120.51 124.72 3f83 n ALA 135 Ca -0.17 0.03 0.16 0.00 0.00 0.00 0.00 53.44 53.45 3f83 n ALA 135 Cb 0.53 -2.22 0.48 0.00 0.00 0.00 0.00 19.45 18.25 3f83 n ALA 135 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3f83 h LEU 136 N 0.66 0.44 -3.04 0.00 3.38 -1.84 -2.21 115.31 112.71 3f83 h LEU 136 Ca -0.50 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3f83 h LEU 136 Cb 1.35 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3f83 h LEU 136 CO 0.53 0.21 0.00 -0.46 0.09 0.00 0.00 178.44 178.81 3f83 n ASN 137 N -4.50 4.18 -4.76 -0.43 2.04 -1.26 -1.62 115.26 108.91 3f83 n ASN 137 Ca 0.17 -2.35 -0.41 0.00 -0.44 0.00 0.00 54.58 51.55 3f83 n ASN 137 Cb 0.58 -0.49 -0.02 0.00 -2.53 0.00 0.00 39.78 37.31 3f83 n ASN 137 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 3f83 s SER 138 N -1.06 6.76 1.10 0.53 0.15 -0.83 -3.72 113.70 116.63 3f83 s SER 138 Ca 0.44 2.65 -0.14 0.00 0.70 0.00 0.00 55.95 59.60 3f83 s SER 138 Cb 0.28 -2.64 0.24 0.00 -1.71 0.00 0.00 66.02 62.19 3f83 s SER 138 CO 0.23 -0.57 1.07 -0.44 1.20 0.00 0.00 173.24 174.73 3f83 s SER 139 N -0.20 1.67 0.91 5.45 0.01 -1.26 -4.89 113.70 115.40 3f83 s SER 139 Ca 0.52 1.10 -0.12 0.00 1.31 0.00 0.00 55.95 58.77 3f83 s SER 139 Cb -0.40 -1.70 0.14 0.00 0.21 0.00 0.00 66.02 64.27 3f83 s SER 139 CO 0.49 -3.71 1.09 -1.38 0.41 0.00 0.00 173.24 170.14 3f83 s HIS 140 N -2.84 2.24 0.00 2.43 -3.43 -1.26 -4.62 115.29 107.81 3f83 s HIS 140 Ca 0.67 1.26 -0.05 0.00 -0.80 0.00 0.00 55.06 56.14 3f83 s HIS 140 Cb -0.18 -3.17 -0.00 0.00 -1.43 0.00 0.00 32.58 27.80 3f83 s HIS 140 CO 0.59 -2.50 0.09 -0.59 -2.00 0.00 0.00 174.74 170.33 3f83 s PHE 141 N -2.90 0.08 0.18 0.38 -0.71 -1.26 -4.66 117.98 109.09 3f83 s PHE 141 Ca 0.64 -0.19 -0.13 0.00 -1.04 0.00 0.00 56.93 56.21 3f83 s PHE 141 Cb -0.18 -0.07 -0.07 0.00 -1.21 0.00 0.00 43.02 41.48 3f83 s PHE 141 CO 0.57 -0.24 0.56 -0.65 -1.34 0.00 0.00 175.22 174.12 3f83 s GLN 142 N -1.26 3.93 -0.27 1.99 -0.21 -1.26 -4.49 119.66 118.09 3f83 s GLN 142 Ca -0.14 0.44 -0.02 0.00 0.02 0.00 0.00 55.36 55.67 3f83 s GLN 142 Cb -0.08 -2.82 0.04 0.00 1.00 0.00 0.00 33.01 31.15 3f83 s GLN 142 CO 0.01 0.41 -0.03 0.00 -2.12 0.00 0.00 175.29 173.56 3f83 n ASN 144 N 4.65 -0.73 -3.39 0.00 5.03 -1.26 -2.67 115.26 116.88 3f83 n ASN 144 Ca -0.15 -0.96 -0.17 0.00 0.87 0.00 0.00 54.58 54.17 3f83 n ASN 144 Cb 0.45 -3.26 0.09 0.00 -1.02 0.00 0.00 39.78 36.04 3f83 n ASN 144 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3f83 n ARG 145 N -4.38 -6.49 -3.72 3.52 1.74 -1.26 -5.02 116.66 101.04 3f83 n ARG 145 Ca -0.28 0.84 -0.12 0.00 -0.77 0.00 0.00 57.85 57.52 3f83 n ARG 145 Cb 0.67 -5.81 -0.11 0.00 -1.02 0.00 0.00 32.46 26.19 3f83 n ARG 145 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3f83 s GLU 146 N -5.33 0.38 0.46 5.56 2.12 -1.09 -5.13 118.70 115.67 3f83 s GLU 146 Ca 0.00 0.66 -0.21 0.00 0.36 0.00 0.00 54.97 55.78 3f83 s GLU 146 Cb -0.00 0.04 -0.09 0.00 0.26 0.00 0.00 34.13 34.35 3f83 s GLU 146 CO 0.72 -0.12 1.04 -0.65 -0.54 0.00 0.00 175.26 175.71 3f83 s GLN 147 N 0.97 3.89 0.78 4.30 -0.21 -1.26 -1.96 119.66 126.17 3f83 s GLN 147 Ca -0.06 1.40 -0.13 0.00 0.02 0.00 0.00 55.36 56.59 3f83 s GLN 147 Cb -0.07 -2.21 0.07 0.00 1.00 0.00 0.00 33.01 31.80 3f83 s GLN 147 CO -0.08 -0.36 1.17 0.00 -2.12 0.00 0.00 175.29 173.91 3f83 s ALA 148 N -1.89 1.98 -0.39 6.09 0.00 -1.26 -4.81 121.76 121.47 3f83 s ALA 148 Ca 0.65 0.73 0.11 0.00 0.00 0.00 0.00 51.96 53.45 3f83 s ALA 148 Cb -0.18 -3.44 -0.13 0.00 0.00 0.00 0.00 23.12 19.37 3f83 s ALA 148 CO 0.22 -2.07 0.41 0.43 0.00 0.00 0.00 175.76 174.75 3f83 n SER 149 N -3.18 0.97 -2.07 0.00 7.64 0.97 -4.17 113.62 113.77 3f83 n SER 149 Ca 0.12 -0.58 0.01 0.00 1.01 0.00 0.00 58.87 59.44 3f83 n SER 149 Cb 0.51 1.12 0.00 0.00 -1.01 0.00 0.00 64.21 64.83 3f83 n SER 149 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f83 n GLY 150 N 1.40 0.44 3.31 0.23 0.00 -1.10 -1.78 105.19 107.68 3f83 n GLY 150 Ca 0.01 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 44.98 3f83 n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f83 s ALA 151 N -1.38 -1.03 0.20 4.61 0.00 -0.74 -0.56 121.76 122.86 3f83 s ALA 151 Ca 0.11 0.59 0.09 0.00 0.00 0.00 0.00 51.96 52.76 3f83 s ALA 151 Cb -0.00 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 3f83 s ALA 151 CO -0.00 -0.28 -0.10 0.95 0.00 0.00 0.00 175.76 176.32 3f83 s THR 152 N -1.23 3.13 -0.05 0.00 -4.23 -0.50 -1.30 115.64 111.46 3f83 s THR 152 Ca -0.12 -1.77 0.04 0.00 -1.18 0.00 0.00 61.69 58.65 3f83 s THR 152 Cb -0.04 -2.57 -0.03 0.00 1.34 0.00 0.00 72.50 71.20 3f83 s THR 152 CO 0.05 -0.17 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.59 3f83 s LEU 153 N -3.00 2.66 -0.03 4.79 2.96 0.19 -1.94 118.68 124.30 3f83 s LEU 153 Ca 0.26 -0.23 0.03 0.00 -0.22 0.00 0.00 54.13 53.97 3f83 s LEU 153 Cb -0.08 -1.53 0.00 0.00 0.50 0.00 0.00 46.19 45.08 3f83 s LEU 153 CO 0.16 0.34 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.98 3f83 s SER 154 N -0.72 1.43 0.00 3.68 0.01 0.77 -0.55 113.70 118.33 3f83 s SER 154 Ca 0.11 -0.23 0.01 0.00 1.31 0.00 0.00 55.95 57.16 3f83 s SER 154 Cb -0.11 -0.42 -0.01 0.00 0.21 0.00 0.00 66.02 65.70 3f83 s SER 154 CO 0.00 0.08 -0.04 -0.76 0.41 0.00 0.00 173.24 172.92 3f83 s LEU 155 N 0.22 2.06 0.09 2.44 1.43 -0.61 -0.46 118.68 123.86 3f83 s LEU 155 Ca -0.04 -0.16 -0.18 0.00 -1.03 0.00 0.00 54.13 52.71 3f83 s LEU 155 Cb -0.10 -0.18 0.04 0.00 0.03 0.00 0.00 46.19 45.98 3f83 s LEU 155 CO 0.01 -0.01 0.43 -0.72 0.23 0.00 0.00 176.35 176.29 3f83 s TYR 156 N -0.35 -0.27 -0.27 0.29 -0.85 0.29 -0.82 117.35 115.37 3f83 s TYR 156 Ca -0.01 0.09 -0.12 0.00 -0.52 0.00 0.00 57.07 56.50 3f83 s TYR 156 Cb -0.03 0.27 -0.05 0.00 0.38 0.00 0.00 41.96 42.53 3f83 s TYR 156 CO -0.00 -0.66 0.25 0.42 -1.52 0.00 0.00 175.55 174.04 3f83 s ILE 157 N -3.21 5.27 0.83 -3.49 1.01 0.45 -0.33 121.20 121.73 3f83 s ILE 157 Ca -0.01 0.32 -0.12 0.00 0.00 0.00 0.00 60.65 60.85 3f83 s ILE 157 Cb 0.01 -3.59 0.10 0.00 0.01 0.00 0.00 42.46 38.98 3f83 s ILE 157 CO -0.08 0.23 1.16 -2.84 0.00 0.00 0.00 174.94 173.41 3f83 s PRO 158 N 1.77 1.56 0.41 2.79 0.02 -1.26 -1.79 135.00 138.49 3f83 s PRO 158 Ca 0.10 1.55 -0.27 0.00 0.02 0.00 0.00 61.00 62.41 3f83 s PRO 158 Cb -0.16 -1.79 -0.10 0.00 0.02 0.00 0.00 34.50 32.48 3f83 s PRO 158 CO 0.10 -2.23 1.44 0.00 -0.33 0.00 0.00 177.00 175.98 3f83 s ALA 159 N -2.49 3.41 0.00 -1.55 0.00 -1.26 -2.71 121.76 117.15 3f83 s ALA 159 Ca 0.68 1.50 0.00 0.00 0.00 0.00 0.00 51.96 54.14 3f83 s ALA 159 Cb -0.24 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.29 3f83 s ALA 159 CO 0.54 -1.09 0.00 0.41 0.00 0.00 0.00 175.76 175.62 3f83 n GLY 160 N 0.54 2.45 0.37 0.00 0.00 0.70 -4.91 105.19 104.33 3f83 n GLY 160 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.06 3f83 n GLY 160 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3f83 h GLU 161 N 2.27 1.18 0.00 1.61 4.57 -1.77 -1.67 114.58 120.77 3f83 h GLU 161 Ca 0.00 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.09 3f83 h GLU 161 Cb 0.00 -0.27 -0.00 0.00 -0.16 0.00 0.00 28.75 28.32 3f83 h GLU 161 CO 0.00 0.78 -0.09 -0.07 -1.18 0.00 0.00 179.01 178.45 3f83 h LEU 162 N 1.21 0.00 -2.05 1.64 3.38 -1.90 -1.42 115.31 116.17 3f83 h LEU 162 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3f83 h LEU 162 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3f83 h LEU 162 CO -0.15 0.09 0.17 0.78 0.09 0.00 0.00 178.44 179.42 3f83 h ASN 163 N 0.00 0.00 1.29 -0.43 4.21 -1.65 -0.80 115.58 118.20 3f83 h ASN 163 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 3f83 h ASN 163 Cb 0.17 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.37 3f83 h ASN 163 CO 0.01 0.00 -0.03 0.29 -1.29 0.00 0.00 177.43 176.41 3f83 n LYS 164 N -2.72 0.18 -2.22 0.81 5.02 -0.54 -4.78 118.16 113.90 3f83 n LYS 164 Ca -0.02 0.14 -0.42 0.00 -2.02 0.00 0.00 58.31 55.99 3f83 n LYS 164 Cb 0.22 -1.70 -0.03 0.00 -0.02 0.00 0.00 35.03 33.50 3f83 n LYS 164 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3f83 s LEU 165 N -4.01 4.38 0.37 -0.35 1.43 -0.31 -4.93 118.68 115.26 3f83 s LEU 165 Ca 0.12 2.28 0.27 0.00 -1.03 0.00 0.00 54.13 55.77 3f83 s LEU 165 Cb 0.15 -3.59 1.09 0.00 0.03 0.00 0.00 46.19 43.87 3f83 s LEU 165 CO 0.58 -0.60 1.81 1.55 0.23 0.00 0.00 176.35 179.92 3f83 h PRO 166 N 6.58 0.00 -1.92 1.29 0.13 -1.89 -3.47 132.00 132.72 3f83 h PRO 166 Ca -0.42 0.00 0.23 0.00 -0.87 0.00 0.00 66.00 64.93 3f83 h PRO 166 Cb 1.21 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.22 3f83 h PRO 166 CO 0.84 0.00 0.64 -0.59 -0.23 0.00 0.00 178.00 178.66 3f83 s PHE 167 N -3.43 -0.13 0.46 1.56 -0.12 -1.26 -4.43 117.98 110.62 3f83 s PHE 167 Ca 0.04 -0.05 -0.22 0.00 -0.05 0.00 0.00 56.93 56.65 3f83 s PHE 167 Cb 0.09 0.58 -0.08 0.00 -0.63 0.00 0.00 43.02 42.98 3f83 s PHE 167 CO 0.47 -0.52 1.10 0.20 -0.05 0.00 0.00 175.22 176.42 3f83 s GLY 168 N -2.79 2.70 0.00 1.99 0.00 -1.25 -4.98 107.32 102.98 3f83 s GLY 168 Ca 0.11 0.79 0.00 0.00 0.00 0.00 0.00 44.72 45.62 3f83 s GLY 168 CO -0.02 1.20 0.00 0.61 0.00 0.00 0.00 173.10 174.89 3f83 n GLY 169 N 0.25 -1.12 3.33 0.20 0.00 -0.15 -2.03 105.19 105.66 3f83 n GLY 169 Ca 0.08 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 3f83 n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f83 s VAL 170 N -3.00 4.74 -0.28 1.61 1.01 -1.26 -1.68 120.40 121.54 3f83 s VAL 170 Ca 0.00 -1.25 -0.15 0.00 0.00 0.00 0.00 61.98 60.58 3f83 s VAL 170 Cb 0.00 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 3f83 s VAL 170 CO 0.00 -0.56 0.35 0.26 0.00 0.00 0.00 175.10 175.16 3f83 s TRP 171 N 1.53 3.24 -0.01 5.22 0.52 -0.24 0.06 118.94 129.26 3f83 s TRP 171 Ca 0.04 0.34 0.03 0.00 0.02 0.00 0.00 56.10 56.52 3f83 s TRP 171 Cb -0.24 -2.56 -0.03 0.00 -1.15 0.00 0.00 33.47 29.48 3f83 s TRP 171 CO 0.04 -0.24 -0.07 -0.80 0.02 0.00 0.00 176.95 175.90 3f83 s ASN 172 N 1.66 4.61 0.03 2.95 0.01 -0.23 -0.24 114.94 123.74 3f83 s ASN 172 Ca 0.14 -0.13 -0.01 0.00 -0.71 0.00 0.00 52.86 52.15 3f83 s ASN 172 Cb -0.16 -1.08 -0.03 0.00 0.41 0.00 0.00 41.25 40.39 3f83 s ASN 172 CO 0.10 0.30 -0.02 0.00 -1.51 0.00 0.00 177.10 175.97 3f83 s ALA 173 N -0.96 0.26 -0.28 0.60 0.00 0.02 -0.16 121.76 121.24 3f83 s ALA 173 Ca 0.16 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.29 3f83 s ALA 173 Cb -0.11 0.21 0.09 0.00 0.00 0.00 0.00 23.12 23.30 3f83 s ALA 173 CO 0.06 -0.26 0.05 0.08 0.00 0.00 0.00 175.76 175.69 3f83 s VAL 174 N -2.57 1.21 -0.04 0.00 1.01 -1.26 -0.88 120.40 117.86 3f83 s VAL 174 Ca -0.06 -1.40 -0.28 0.00 0.00 0.00 0.00 61.98 60.25 3f83 s VAL 174 Cb -0.02 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 3f83 s VAL 174 CO -0.05 -0.47 0.90 -0.22 0.00 0.00 0.00 175.10 175.26 3f83 s LEU 175 N 1.48 4.33 -0.09 3.92 2.96 -0.43 -4.28 118.68 126.57 3f83 s LEU 175 Ca 0.05 1.49 0.04 0.00 -0.22 0.00 0.00 54.13 55.49 3f83 s LEU 175 Cb -0.18 -3.41 0.00 0.00 0.50 0.00 0.00 46.19 43.10 3f83 s LEU 175 CO -0.16 -0.24 -0.21 -0.54 -1.32 0.00 0.00 176.35 173.88 3f83 s LYS 176 N 1.10 2.65 -0.06 1.98 1.02 -0.19 -0.71 119.74 125.53 3f83 s LYS 176 Ca 0.47 -0.77 0.02 0.00 0.02 0.00 0.00 55.97 55.71 3f83 s LYS 176 Cb -0.20 -2.06 0.02 0.00 -0.52 0.00 0.00 37.83 35.07 3f83 s LYS 176 CO 0.23 0.16 -0.10 -0.51 -0.92 0.00 0.00 175.35 174.22 3f83 s LEU 177 N 0.36 1.55 0.08 3.17 1.43 -0.29 -4.30 118.68 120.68 3f83 s LEU 177 Ca -0.16 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.40 3f83 s LEU 177 Cb -0.17 -0.73 -0.05 0.00 0.03 0.00 0.00 46.19 45.26 3f83 s LEU 177 CO 0.07 0.01 0.91 0.20 0.23 0.00 0.00 176.35 177.77 3f83 s ASN 178 N 0.77 7.41 -0.28 2.29 0.01 0.15 -0.25 114.94 125.03 3f83 s ASN 178 Ca -0.13 1.68 -0.16 0.00 -0.71 0.00 0.00 52.86 53.54 3f83 s ASN 178 Cb -0.15 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 38.93 3f83 s ASN 178 CO 0.02 -0.06 0.44 -0.69 -1.51 0.00 0.00 177.10 175.30 3f83 s VAL 179 N 0.08 5.12 0.22 1.60 1.01 0.23 -1.40 120.40 127.26 3f83 s VAL 179 Ca 0.45 0.62 -0.01 0.00 0.00 0.00 0.00 61.98 63.04 3f83 s VAL 179 Cb -0.22 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 3f83 s VAL 179 CO 0.28 0.07 0.19 -0.54 0.00 0.00 0.00 175.10 175.10 3f83 s LYS 180 N 2.19 1.32 0.00 2.72 1.02 0.20 -0.29 119.74 126.91 3f83 s LYS 180 Ca 0.17 -1.65 0.00 0.00 0.02 0.00 0.00 55.97 54.51 3f83 s LYS 180 Cb -0.16 0.30 0.00 0.00 -0.52 0.00 0.00 37.83 37.45 3f83 s LYS 180 CO 0.10 -0.46 0.00 -2.13 -0.92 0.00 0.00 175.35 171.95 3f83 n ARG 181 N -0.33 0.00 -2.50 1.68 0.63 -1.19 0.19 116.66 115.14 3f83 n ARG 181 Ca 0.02 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.82 3f83 n ARG 181 Cb 0.65 0.00 0.03 0.00 0.45 0.00 0.00 32.46 33.59 3f83 n ARG 181 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3f83 n ARG 182 N 0.00 0.81 0.26 -0.14 1.74 -1.26 -4.37 116.66 113.70 3f83 n ARG 182 Ca 0.00 -2.08 0.16 0.00 -0.77 0.00 0.00 57.85 55.16 3f83 n ARG 182 Cb 0.00 -0.04 0.89 0.00 -1.02 0.00 0.00 32.46 32.29 3f83 n ARG 182 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 3f83 h TYR 183 N 0.23 0.00 -0.00 -1.55 5.03 -1.97 -1.44 116.97 117.26 3f83 h TYR 183 Ca -0.19 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.12 3f83 h TYR 183 Cb 0.81 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.09 3f83 h TYR 183 CO 0.00 0.00 -0.23 -0.40 -1.32 0.00 0.00 178.16 176.21 3f83 n ASP 184 N -3.77 0.37 -4.29 -2.11 3.85 -1.26 -4.75 116.55 104.59 3f83 n ASP 184 Ca -0.01 -0.15 -0.34 0.00 -0.71 0.00 0.00 54.79 53.58 3f83 n ASP 184 Cb 0.19 -0.07 -0.15 0.00 -1.35 0.00 0.00 41.12 39.75 3f83 n ASP 184 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3f83 s THR 185 N -2.83 2.97 -0.14 2.12 2.01 -0.54 -5.08 115.64 114.15 3f83 s THR 185 Ca 0.17 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.53 3f83 s THR 185 Cb 0.19 -2.30 0.02 0.00 0.01 0.00 0.00 72.50 70.42 3f83 s THR 185 CO 0.58 0.48 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.95 3f83 s THR 186 N 1.06 1.63 -0.11 -0.82 2.01 -1.26 -3.16 115.64 114.99 3f83 s THR 186 Ca -0.00 -0.68 0.16 0.00 0.31 0.00 0.00 61.69 61.48 3f83 s THR 186 Cb -0.15 -1.50 -0.19 0.00 0.01 0.00 0.00 72.50 70.67 3f83 s THR 186 CO -0.02 0.47 0.63 -1.22 -0.69 0.00 0.00 174.62 173.79 3f83 n TYR 187 N 4.56 0.76 -3.60 4.92 4.02 0.60 -5.01 117.16 123.42 3f83 n TYR 187 Ca -0.18 0.26 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 3f83 n TYR 187 Cb 0.50 -1.06 0.00 0.00 -0.02 0.00 0.00 39.34 38.76 3f83 n TYR 187 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3f83 n GLY 188 N 1.49 -0.47 2.97 2.72 0.00 -1.21 -4.18 105.19 106.51 3f83 n GLY 188 Ca -0.15 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 3f83 n GLY 188 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f83 s THR 189 N -3.09 0.01 -0.24 2.61 2.01 -1.26 -0.60 115.64 115.08 3f83 s THR 189 Ca 0.00 -0.07 -0.11 0.00 0.31 0.00 0.00 61.69 61.81 3f83 s THR 189 Cb 0.00 -0.16 -0.05 0.00 0.01 0.00 0.00 72.50 72.31 3f83 s THR 189 CO 0.00 -0.04 0.20 -0.31 -0.69 0.00 0.00 174.62 173.79 3f83 s TYR 190 N -0.08 3.31 -0.24 4.92 2.02 0.65 -2.01 117.35 125.91 3f83 s TYR 190 Ca -0.01 0.27 -0.02 0.00 -0.37 0.00 0.00 57.07 56.94 3f83 s TYR 190 Cb -0.01 -2.33 0.02 0.00 -0.40 0.00 0.00 41.96 39.24 3f83 s TYR 190 CO 0.00 0.01 -0.07 0.99 -1.57 0.00 0.00 175.55 174.92 3f83 s THR 191 N 1.23 2.87 -0.26 -0.71 2.01 -0.05 -1.14 115.64 119.59 3f83 s THR 191 Ca 0.09 -0.96 0.02 0.00 0.31 0.00 0.00 61.69 61.15 3f83 s THR 191 Cb -0.14 -2.43 0.06 0.00 0.01 0.00 0.00 72.50 70.00 3f83 s THR 191 CO 0.06 0.24 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.51 3f83 s ILE 192 N 1.34 2.33 -0.20 1.82 1.01 0.11 -0.65 121.20 126.95 3f83 s ILE 192 Ca 0.01 -1.57 -0.22 0.00 0.00 0.00 0.00 60.65 58.87 3f83 s ILE 192 Cb -0.16 -2.35 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 3f83 s ILE 192 CO -0.05 -0.03 0.69 0.20 0.00 0.00 0.00 174.94 175.76 3f83 s ASN 193 N 1.14 6.74 -0.17 3.58 0.01 0.19 -1.31 114.94 125.12 3f83 s ASN 193 Ca -0.08 0.91 -0.01 0.00 -0.71 0.00 0.00 52.86 52.98 3f83 s ASN 193 Cb -0.20 -2.38 -0.00 0.00 0.41 0.00 0.00 41.25 39.08 3f83 s ASN 193 CO -0.04 -0.34 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.45 3f83 s ILE 194 N 2.13 2.75 -0.12 0.60 1.01 -0.06 0.44 121.20 127.94 3f83 s ILE 194 Ca 0.31 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 60.25 3f83 s ILE 194 Cb -0.16 -2.19 -0.01 0.00 0.01 0.00 0.00 42.46 40.12 3f83 s ILE 194 CO 0.10 0.50 -0.18 -0.89 0.00 0.00 0.00 174.94 174.47 3f83 s THR 195 N 1.03 2.59 -0.25 2.92 2.01 -0.50 -0.80 115.64 122.65 3f83 s THR 195 Ca -0.01 -0.82 -0.03 0.00 0.31 0.00 0.00 61.69 61.14 3f83 s THR 195 Cb -0.15 -2.06 0.02 0.00 0.01 0.00 0.00 72.50 70.32 3f83 s THR 195 CO -0.03 0.54 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.70 3f83 s VAL 196 N 0.45 3.08 -0.56 3.82 1.01 0.66 -0.83 120.40 128.04 3f83 s VAL 196 Ca -0.13 -0.90 -0.21 0.00 0.00 0.00 0.00 61.98 60.75 3f83 s VAL 196 Cb -0.17 -2.54 0.07 0.00 0.00 0.00 0.00 36.38 33.74 3f83 s VAL 196 CO 0.05 0.22 0.76 0.20 0.00 0.00 0.00 175.10 176.34 3f83 s ASN 197 N 1.37 6.23 -0.32 3.32 0.02 -0.63 -1.08 114.94 123.85 3f83 s ASN 197 Ca 0.01 -0.92 -0.05 0.00 -1.02 0.00 0.00 52.86 50.89 3f83 s ASN 197 Cb -0.16 -2.34 0.04 0.00 0.02 0.00 0.00 41.25 38.80 3f83 s ASN 197 CO -0.04 -1.10 0.07 -0.22 0.02 0.00 0.00 177.10 175.84 3f83 s LEU 198 N 3.16 4.16 0.54 0.60 2.96 -0.67 -0.68 118.68 128.73 3f83 s LEU 198 Ca 0.19 -1.15 0.03 0.00 -0.22 0.00 0.00 54.13 52.97 3f83 s LEU 198 Cb -0.18 -1.82 0.04 0.00 0.50 0.00 0.00 46.19 44.72 3f83 s LEU 198 CO 0.12 -0.30 0.75 0.42 -1.32 0.00 0.00 176.35 176.02 3f83 s THR 199 N 1.36 2.68 -0.44 3.68 -4.23 -0.11 -0.98 115.64 117.60 3f83 s THR 199 Ca -0.02 -0.73 0.07 0.00 -1.18 0.00 0.00 61.69 59.82 3f83 s THR 199 Cb -0.19 -2.95 0.24 0.00 1.34 0.00 0.00 72.50 70.94 3f83 s THR 199 CO 0.02 0.00 0.71 -0.67 -0.54 0.00 0.00 174.62 174.14 3f83 n ASP 200 N -2.28 -1.47 -0.01 3.99 -0.08 -0.88 -1.11 116.55 114.71 3f83 n ASP 200 Ca 0.09 -3.01 0.03 0.00 -1.51 0.00 0.00 54.79 50.39 3f83 n ASP 200 Cb 0.60 0.67 0.40 0.00 2.34 0.00 0.00 41.12 45.13 3f83 n ASP 200 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3f83 h LYS 201 N 4.02 0.56 0.00 -0.67 1.57 -1.88 -1.88 116.57 118.29 3f83 h LYS 201 Ca -0.04 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3f83 h LYS 201 Cb 0.96 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3f83 h LYS 201 CO 0.39 0.39 0.00 0.78 -0.57 0.00 0.00 179.45 180.44 3f83 h GLY 202 N 0.61 0.00 -1.55 3.86 0.00 -1.95 -3.12 103.07 100.92 3f83 h GLY 202 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3f83 h GLY 202 CO -0.03 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.21 3f83 n ASN 203 N -2.90 2.72 -4.77 0.19 3.02 -0.71 -4.54 115.26 108.27 3f83 n ASN 203 Ca -0.01 -1.80 -0.41 0.00 -0.03 0.00 0.00 54.58 52.33 3f83 n ASN 203 Cb 0.19 -0.10 -0.01 0.00 -0.61 0.00 0.00 39.78 39.25 3f83 n ASN 203 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3f83 s ILE 204 N -1.30 2.02 0.02 2.41 1.01 -1.18 -4.58 121.20 119.59 3f83 s ILE 204 Ca 0.25 0.02 -0.28 0.00 0.00 0.00 0.00 60.65 60.63 3f83 s ILE 204 Cb 0.16 -3.01 0.10 0.00 0.01 0.00 0.00 42.46 39.71 3f83 s ILE 204 CO 0.22 0.00 0.90 0.00 0.00 0.00 0.00 174.94 176.07 3f83 s GLN 205 N -1.52 0.87 -0.25 2.79 -2.07 -0.87 -4.94 119.66 113.67 3f83 s GLN 205 Ca 0.57 -0.36 -0.11 0.00 -1.82 0.00 0.00 55.36 53.65 3f83 s GLN 205 Cb -0.47 0.38 -0.05 0.00 -1.09 0.00 0.00 33.01 31.78 3f83 s GLN 205 CO 0.58 -0.38 0.17 0.42 -1.32 0.00 0.00 175.29 174.75 3f83 s ILE 206 N -3.14 5.35 -0.15 3.63 1.01 -1.26 -1.76 121.20 124.89 3f83 s ILE 206 Ca 0.06 0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.86 3f83 s ILE 206 Cb -0.01 -3.51 -0.02 0.00 0.01 0.00 0.00 42.46 38.93 3f83 s ILE 206 CO -0.07 0.32 -0.06 0.86 0.00 0.00 0.00 174.94 175.99 3f83 s TRP 207 N 1.24 2.97 -0.25 3.97 -0.00 0.11 -4.93 118.94 122.04 3f83 s TRP 207 Ca 0.07 -0.40 -0.01 0.00 -0.00 0.00 0.00 56.10 55.77 3f83 s TRP 207 Cb -0.14 -1.93 0.03 0.00 -0.00 0.00 0.00 33.47 31.43 3f83 s TRP 207 CO 0.06 -0.09 -0.06 -0.51 -0.00 0.00 0.00 176.95 176.35 3f83 s LEU 208 N 0.37 3.28 0.39 5.86 1.43 -1.26 0.12 118.68 128.86 3f83 s LEU 208 Ca -0.06 -0.98 0.07 0.00 -1.03 0.00 0.00 54.13 52.13 3f83 s LEU 208 Cb -0.15 -1.65 0.81 0.00 0.03 0.00 0.00 46.19 45.23 3f83 s LEU 208 CO 0.04 -0.15 2.00 -0.65 0.23 0.00 0.00 176.35 177.82 3f83 h PRO 209 N 7.98 0.64 0.00 1.29 0.11 -1.96 -2.24 132.00 137.81 3f83 h PRO 209 Ca -0.30 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3f83 h PRO 209 Cb 1.09 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3f83 h PRO 209 CO 0.56 0.42 0.00 0.37 -0.21 0.00 0.00 178.00 179.14 3f83 h GLN 210 N 0.65 0.00 -3.55 1.05 4.15 -1.94 -3.44 115.11 112.02 3f83 h GLN 210 Ca 0.24 0.00 -0.47 0.00 0.77 0.00 0.00 58.65 59.19 3f83 h GLN 210 Cb 0.14 0.00 -0.39 0.00 0.21 0.00 0.00 27.48 27.44 3f83 h GLN 210 CO -0.07 0.00 -0.76 -0.06 -1.93 0.00 0.00 178.83 176.01 3f83 s PHE 211 N -3.19 0.76 0.14 3.99 0.40 -0.84 -4.96 117.98 114.28 3f83 s PHE 211 Ca 0.08 -0.47 0.19 0.00 -0.60 0.00 0.00 56.93 56.14 3f83 s PHE 211 Cb 0.07 -0.88 0.68 0.00 0.51 0.00 0.00 43.02 43.41 3f83 s PHE 211 CO 0.64 -0.47 1.73 -0.22 0.70 0.00 0.00 175.22 177.61 3f83 h LYS 212 N 8.30 0.00 -3.08 0.44 3.64 -1.86 -3.40 116.57 120.61 3f83 h LYS 212 Ca -0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 3f83 h LYS 212 Cb 1.13 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 3f83 h LYS 212 CO 0.29 0.35 0.22 -1.54 -2.27 0.00 0.00 179.45 176.50 3f83 s SER 213 N -6.39 -0.05 -1.39 4.20 1.04 -1.26 -5.03 113.70 104.81 3f83 s SER 213 Ca 0.00 -0.96 -0.09 0.00 0.48 0.00 0.00 55.95 55.39 3f83 s SER 213 Cb 0.11 0.79 0.01 0.00 0.10 0.00 0.00 66.02 67.02 3f83 s SER 213 CO 0.68 -1.52 0.36 0.59 0.98 0.00 0.00 173.24 174.33 3f83 n ASN 214 N -1.02 -1.17 -4.75 7.02 4.13 -1.26 -4.91 115.26 113.29 3f83 n ASN 214 Ca -0.06 -1.16 -0.41 0.00 1.68 0.00 0.00 54.58 54.62 3f83 n ASN 214 Cb 0.60 -2.31 -0.02 0.00 -1.54 0.00 0.00 39.78 36.51 3f83 n ASN 214 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3f83 s ALA 215 N -3.97 3.65 -0.05 5.41 0.00 -1.26 -4.94 121.76 120.59 3f83 s ALA 215 Ca 0.15 1.45 -0.10 0.00 0.00 0.00 0.00 51.96 53.47 3f83 s ALA 215 Cb -0.07 -3.59 0.02 0.00 0.00 0.00 0.00 23.12 19.47 3f83 s ALA 215 CO 0.94 -0.87 0.24 1.03 0.00 0.00 0.00 175.76 177.10 3f83 s ARG 216 N -0.84 0.43 0.00 0.00 0.52 -1.26 -1.34 118.95 116.46 3f83 s ARG 216 Ca 0.59 0.05 -0.03 0.00 -0.52 0.00 0.00 55.73 55.83 3f83 s ARG 216 Cb -0.45 0.19 -0.01 0.00 0.52 0.00 0.00 34.95 35.21 3f83 s ARG 216 CO 0.49 -0.09 0.04 0.08 0.02 0.00 0.00 175.30 175.85 3f83 s VAL 217 N -0.55 0.07 -0.11 3.52 1.01 -0.49 -4.95 120.40 118.90 3f83 s VAL 217 Ca -0.07 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 3f83 s VAL 217 Cb -0.04 -0.25 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 3f83 s VAL 217 CO 0.02 -0.30 0.03 -0.62 0.00 0.00 0.00 175.10 174.22 3f83 s ASP 218 N -0.92 5.42 0.05 3.32 2.15 -1.26 -1.09 116.67 124.34 3f83 s ASP 218 Ca -0.10 0.16 0.17 0.00 0.43 0.00 0.00 52.55 53.21 3f83 s ASP 218 Cb -0.06 -1.65 0.73 0.00 -0.30 0.00 0.00 42.92 41.64 3f83 s ASP 218 CO 0.00 0.34 1.55 0.18 -0.17 0.00 0.00 175.17 177.07 3f83 n LEU 219 N 2.41 0.14 -3.64 -1.34 4.77 -0.33 -4.62 117.00 114.39 3f83 n LEU 219 Ca -0.18 0.53 -0.22 0.00 -0.03 0.00 0.00 56.01 56.10 3f83 n LEU 219 Cb 0.54 -0.51 0.04 0.00 -2.33 0.00 0.00 43.42 41.15 3f83 n LEU 219 CO 0.30 -0.29 -0.06 0.59 -1.33 0.00 0.00 177.39 176.60 3f83 n ASN 220 N -1.65 -2.58 -4.77 -1.43 3.02 -1.26 -1.20 115.26 105.39 3f83 n ASN 220 Ca 0.03 -0.85 -0.41 0.00 -0.03 0.00 0.00 54.58 53.33 3f83 n ASN 220 Cb 0.20 -4.06 0.00 0.00 -0.61 0.00 0.00 39.78 35.31 3f83 n ASN 220 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3f83 n LEU 221 N -4.13 4.71 -3.90 3.41 4.32 -1.26 -4.42 117.00 115.73 3f83 n LEU 221 Ca -0.23 1.22 -0.14 0.00 -0.02 0.00 0.00 56.01 56.84 3f83 n LEU 221 Cb 0.66 -1.61 -0.14 0.00 -1.62 0.00 0.00 43.42 40.70 3f83 n LEU 221 CO 0.67 0.10 -0.38 0.00 -1.22 0.00 0.00 177.39 176.56 3f83 s ARG 222 N -2.10 0.18 0.05 3.23 1.70 0.02 -4.92 118.95 117.10 3f83 s ARG 222 Ca 0.54 -0.06 -0.31 0.00 -0.47 0.00 0.00 55.73 55.43 3f83 s ARG 222 Cb -0.48 -0.19 -0.06 0.00 -0.57 0.00 0.00 34.95 33.65 3f83 s ARG 222 CO 0.64 0.03 1.30 -2.14 -1.08 0.00 0.00 175.30 174.05 3f83 s PRO 223 N 0.05 4.35 -0.00 3.89 0.02 -1.26 -1.32 135.00 140.73 3f83 s PRO 223 Ca -0.00 1.89 0.16 0.00 0.02 0.00 0.00 61.00 63.07 3f83 s PRO 223 Cb -0.02 -3.40 -0.19 0.00 0.02 0.00 0.00 34.50 30.91 3f83 s PRO 223 CO -0.00 -0.41 0.62 0.25 -0.33 0.00 0.00 177.00 177.13 3f83 n THR 224 N 4.19 0.00 0.00 0.99 -2.24 -0.61 -4.96 114.28 111.66 3f83 n THR 224 Ca 0.11 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3f83 n THR 224 Cb 0.45 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 3f83 n THR 224 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f83 n GLY 225 N 1.41 3.57 2.30 3.38 0.00 -1.24 -4.98 105.19 109.62 3f83 n GLY 225 Ca 0.02 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.25 3f83 n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f83 n GLY 226 N -1.14 1.10 1.93 -0.02 0.00 -1.26 -2.55 105.19 103.24 3f83 n GLY 226 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 3f83 n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f83 n GLY 227 N -1.66 0.82 3.75 -0.02 0.00 -1.26 -4.79 105.19 102.02 3f83 n GLY 227 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 3f83 n GLY 227 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f83 s THR 228 N -3.23 4.49 -0.04 2.61 2.01 -1.06 0.80 115.64 121.23 3f83 s THR 228 Ca 0.00 1.87 0.06 0.00 0.31 0.00 0.00 61.69 63.92 3f83 s THR 228 Cb 0.00 -4.22 -0.01 0.00 0.01 0.00 0.00 72.50 68.28 3f83 s THR 228 CO 0.00 0.40 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.80 3f83 s TYR 229 N -0.39 2.02 -0.01 4.92 1.51 0.82 -1.57 117.35 124.64 3f83 s TYR 229 Ca 0.41 -0.52 0.04 0.00 -1.01 0.00 0.00 57.07 55.99 3f83 s TYR 229 Cb -0.23 -1.33 -0.01 0.00 -0.11 0.00 0.00 41.96 40.29 3f83 s TYR 229 CO 0.27 -0.14 -0.13 0.42 -1.11 0.00 0.00 175.55 174.87 3f83 s ILE 230 N -0.21 1.02 0.05 2.71 1.01 -0.43 -0.63 121.20 124.71 3f83 s ILE 230 Ca 0.00 -0.54 -0.12 0.00 0.00 0.00 0.00 60.65 59.99 3f83 s ILE 230 Cb -0.11 -0.86 0.01 0.00 0.01 0.00 0.00 42.46 41.51 3f83 s ILE 230 CO 0.02 0.29 0.26 -0.83 0.00 0.00 0.00 174.94 174.67 3f83 s GLY 231 N -0.25 -0.05 -0.20 6.18 0.00 -0.12 -0.80 107.32 112.07 3f83 s GLY 231 Ca 0.04 -0.15 -0.15 0.00 0.00 0.00 0.00 44.72 44.46 3f83 s GLY 231 CO -0.00 -0.35 0.52 -1.60 0.00 0.00 0.00 173.10 171.67 3f83 s ARG 232 N -2.67 0.56 0.27 2.90 3.52 -0.34 -1.61 118.95 121.57 3f83 s ARG 232 Ca -0.04 0.84 -0.12 0.00 -0.13 0.00 0.00 55.73 56.28 3f83 s ARG 232 Cb -0.00 0.17 0.00 0.00 -1.56 0.00 0.00 34.95 33.55 3f83 s ARG 232 CO -0.04 -0.12 0.51 1.21 -0.81 0.00 0.00 175.30 176.05 3f83 s ASN 233 N 0.90 0.01 0.03 -2.12 3.84 -0.83 -4.69 114.94 112.07 3f83 s ASN 233 Ca -0.05 -0.98 -0.01 0.00 0.21 0.00 0.00 52.86 52.03 3f83 s ASN 233 Cb -0.05 0.62 -0.02 0.00 -0.55 0.00 0.00 41.25 41.24 3f83 s ASN 233 CO -0.08 -1.20 -0.02 -0.44 -2.79 0.00 0.00 177.10 172.58 3f83 s SER 234 N -3.04 0.28 -0.09 -4.21 0.01 -1.26 0.28 113.70 105.67 3f83 s SER 234 Ca 0.22 -0.58 -0.00 0.00 1.31 0.00 0.00 55.95 56.90 3f83 s SER 234 Cb -0.01 0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.37 3f83 s SER 234 CO 0.10 -0.37 -0.05 -0.69 0.41 0.00 0.00 173.24 172.64 3f83 s VAL 235 N -1.96 0.79 0.21 3.43 1.01 0.24 -4.94 120.40 119.18 3f83 s VAL 235 Ca -0.11 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 3f83 s VAL 235 Cb -0.06 -0.84 -0.08 0.00 0.00 0.00 0.00 36.38 35.39 3f83 s VAL 235 CO -0.03 0.32 1.04 -1.81 0.00 0.00 0.00 175.10 174.62 3f83 s ASP 236 N 1.64 7.40 -0.04 3.32 1.01 -1.26 -0.34 116.67 128.39 3f83 s ASP 236 Ca 0.02 2.05 -0.15 0.00 0.71 0.00 0.00 52.55 55.18 3f83 s ASP 236 Cb -0.13 -2.61 0.03 0.00 1.01 0.00 0.00 42.92 41.22 3f83 s ASP 236 CO -0.06 -0.09 0.34 0.00 0.21 0.00 0.00 175.17 175.58 3f83 s MET 237 N -0.76 0.65 -0.08 8.23 0.23 0.58 -4.20 119.30 123.95 3f83 s MET 237 Ca 0.46 -0.03 0.05 0.00 -1.03 0.00 0.00 55.69 55.13 3f83 s MET 237 Cb -0.28 0.29 -0.00 0.00 -1.53 0.00 0.00 34.83 33.31 3f83 s MET 237 CO 0.35 -0.17 -0.22 0.00 -2.03 0.00 0.00 175.02 172.95 3f83 s PHE 239 N 0.17 3.31 -0.15 0.00 0.40 0.09 0.09 117.98 121.89 3f83 s PHE 239 Ca -0.12 0.34 0.01 0.00 -0.60 0.00 0.00 56.93 56.56 3f83 s PHE 239 Cb -0.16 -2.39 0.02 0.00 0.51 0.00 0.00 43.02 41.00 3f83 s PHE 239 CO 0.06 -0.02 -0.17 -0.47 0.70 0.00 0.00 175.22 175.32 3f83 s TYR 240 N 1.35 2.40 -2.03 0.36 5.04 -0.72 -0.86 117.35 122.88 3f83 s TYR 240 Ca 0.11 -1.32 0.12 0.00 -2.44 0.00 0.00 57.07 53.54 3f83 s TYR 240 Cb -0.14 -1.70 0.36 0.00 0.35 0.00 0.00 41.96 40.83 3f83 s TYR 240 CO 0.07 -0.67 1.29 -0.40 -1.34 0.00 0.00 175.55 174.50 3f83 n ASP 241 N 4.53 1.80 -1.91 4.32 5.75 -1.26 -2.04 116.55 127.74 3f83 n ASP 241 Ca -0.19 -1.96 -0.18 0.00 -0.01 0.00 0.00 54.79 52.44 3f83 n ASP 241 Cb 0.50 -0.21 -0.05 0.00 -1.03 0.00 0.00 41.12 40.33 3f83 n ASP 241 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3f83 n GLY 242 N 1.05 0.79 0.92 6.12 0.00 -1.26 -4.72 105.19 108.09 3f83 n GLY 242 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.14 3f83 n GLY 242 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3f83 n TYR 243 N -2.92 0.00 -2.14 1.61 9.36 -1.25 -2.08 117.16 119.74 3f83 n TYR 243 Ca -0.20 -0.27 -0.19 0.00 3.32 0.00 0.00 57.90 60.56 3f83 n TYR 243 Cb 0.63 0.11 -0.03 0.00 -0.63 0.00 0.00 39.34 39.42 3f83 n TYR 243 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3f83 n SER 244 N 0.15 -5.45 -1.85 2.98 2.88 -0.86 -1.73 113.62 109.74 3f83 n SER 244 Ca -0.05 0.17 -0.15 0.00 -1.33 0.00 0.00 58.87 57.51 3f83 n SER 244 Cb 0.80 -4.64 0.00 0.00 -0.75 0.00 0.00 64.21 59.62 3f83 n SER 244 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3f83 n THR 245 N -3.39 -0.95 0.54 2.46 -2.24 -1.26 -4.68 114.28 104.75 3f83 n THR 245 Ca -0.22 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.68 3f83 n THR 245 Cb 0.66 -2.42 0.26 0.00 -2.10 0.00 0.00 70.33 66.73 3f83 n THR 245 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3f83 h ASN 246 N -0.34 0.00 -2.52 3.42 2.35 -1.74 -3.47 115.58 113.29 3f83 h ASN 246 Ca -0.36 -0.09 -0.58 0.00 -0.55 0.00 0.00 56.30 54.72 3f83 h ASN 246 Cb 1.26 0.00 0.07 0.00 0.05 0.00 0.00 38.32 39.70 3f83 h ASN 246 CO 0.41 0.05 0.72 -1.20 -1.65 0.00 0.00 177.43 175.76 3f83 n SER 247 N -2.29 3.00 0.20 5.81 7.64 -1.26 -4.91 113.62 121.81 3f83 n SER 247 Ca 0.04 1.11 0.08 0.00 1.01 0.00 0.00 58.87 61.12 3f83 n SER 247 Cb 0.45 -1.44 0.26 0.00 -1.01 0.00 0.00 64.21 62.47 3f83 n SER 247 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3f83 h SER 248 N 5.10 0.00 -5.05 6.43 4.64 -1.90 -3.43 113.55 119.34 3f83 h SER 248 Ca -0.45 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.81 3f83 h SER 248 Cb 1.26 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.21 3f83 h SER 248 CO 0.82 0.26 -0.04 -0.94 -0.87 0.00 0.00 176.83 176.06 3f83 s SER 249 N -6.25 -0.31 0.02 4.97 1.04 -1.26 -1.54 113.70 110.36 3f83 s SER 249 Ca 0.03 -0.11 0.09 0.00 0.48 0.00 0.00 55.95 56.44 3f83 s SER 249 Cb 0.08 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 3f83 s SER 249 CO 0.68 -0.78 -0.26 -0.76 0.98 0.00 0.00 173.24 173.09 3f83 s LEU 250 N -2.41 2.12 -0.27 2.42 1.43 0.43 -0.12 118.68 122.28 3f83 s LEU 250 Ca -0.01 -0.54 -0.04 0.00 -1.03 0.00 0.00 54.13 52.51 3f83 s LEU 250 Cb 0.00 -1.30 0.02 0.00 0.03 0.00 0.00 46.19 44.94 3f83 s LEU 250 CO -0.07 0.28 0.01 -0.70 0.23 0.00 0.00 176.35 176.10 3f83 s GLU 251 N -0.96 2.96 -0.09 1.70 2.12 0.44 -1.24 118.70 123.64 3f83 s GLU 251 Ca 0.11 -0.92 0.03 0.00 0.36 0.00 0.00 54.97 54.55 3f83 s GLU 251 Cb -0.10 -3.18 0.01 0.00 0.26 0.00 0.00 34.13 31.12 3f83 s GLU 251 CO 0.01 -0.42 -0.18 0.42 -0.54 0.00 0.00 175.26 174.55 3f83 s ILE 252 N 1.41 1.63 -0.01 -3.70 1.01 -0.17 -0.74 121.20 120.62 3f83 s ILE 252 Ca 0.01 -0.75 0.05 0.00 0.00 0.00 0.00 60.65 59.96 3f83 s ILE 252 Cb -0.17 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 3f83 s ILE 252 CO -0.01 0.46 -0.16 -0.60 0.00 0.00 0.00 174.94 174.64 3f83 s ARG 253 N 0.65 1.28 -0.20 2.79 3.52 -0.01 -0.37 118.95 126.62 3f83 s ARG 253 Ca -0.13 -0.55 -0.00 0.00 -0.13 0.00 0.00 55.73 54.91 3f83 s ARG 253 Cb -0.16 -1.23 0.02 0.00 -1.56 0.00 0.00 34.95 32.01 3f83 s ARG 253 CO 0.04 0.33 -0.15 -0.06 -0.81 0.00 0.00 175.30 174.64 3f83 s PHE 254 N -0.34 2.87 0.02 5.12 0.40 -1.26 -0.87 117.98 123.92 3f83 s PHE 254 Ca 0.05 -1.52 0.04 0.00 -0.60 0.00 0.00 56.93 54.91 3f83 s PHE 254 Cb -0.06 -1.97 -0.02 0.00 0.51 0.00 0.00 43.02 41.48 3f83 s PHE 254 CO -0.00 -0.75 -0.13 -1.14 0.70 0.00 0.00 175.22 173.89 3f83 s GLN 255 N 1.32 0.96 -0.11 0.44 0.74 -0.56 -1.45 119.66 121.01 3f83 s GLN 255 Ca 0.04 -0.64 0.02 0.00 0.05 0.00 0.00 55.36 54.83 3f83 s GLN 255 Cb -0.14 -0.95 -0.01 0.00 1.10 0.00 0.00 33.01 33.01 3f83 s GLN 255 CO -0.10 0.25 -0.19 0.34 -0.55 0.00 0.00 175.29 175.03 3f83 s ASP 256 N -0.83 3.48 0.00 6.67 2.15 -1.26 -0.64 116.67 126.24 3f83 s ASP 256 Ca 0.03 -0.46 0.00 0.00 0.43 0.00 0.00 52.55 52.54 3f83 s ASP 256 Cb -0.07 -1.50 0.00 0.00 -0.30 0.00 0.00 42.92 41.06 3f83 s ASP 256 CO 0.01 0.16 0.18 0.47 -0.17 0.00 0.00 175.17 175.82 3f83 n ASP 257 N 3.54 0.51 -3.33 -0.34 10.43 -1.24 -3.75 116.55 122.37 3f83 n ASP 257 Ca -0.19 -0.76 -0.26 0.00 2.57 0.00 0.00 54.79 56.15 3f83 n ASP 257 Cb 0.53 -0.10 -0.08 0.00 1.84 0.00 0.00 41.12 43.31 3f83 n ASP 257 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3f83 n ASN 258 N 1.51 2.01 -4.57 -2.24 5.03 -1.26 -5.01 115.26 110.73 3f83 n ASN 258 Ca 0.00 -3.07 -0.30 0.00 0.87 0.00 0.00 54.58 52.08 3f83 n ASN 258 Cb 0.06 -0.66 -0.05 0.00 -1.02 0.00 0.00 39.78 38.12 3f83 n ASN 258 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3f83 s SER 259 N -1.80 5.41 -0.24 6.41 0.15 -1.25 -4.85 113.70 117.52 3f83 s SER 259 Ca 0.37 -1.17 0.01 0.00 0.70 0.00 0.00 55.95 55.86 3f83 s SER 259 Cb 0.15 -2.57 0.06 0.00 -1.71 0.00 0.00 66.02 61.95 3f83 s SER 259 CO -0.06 -2.57 -0.06 -0.54 1.20 0.00 0.00 173.24 171.21 3f83 s LYS 260 N 6.41 1.69 -0.37 5.44 1.02 -1.26 -5.07 119.74 127.60 3f83 s LYS 260 Ca 0.65 -1.06 -0.37 0.00 0.02 0.00 0.00 55.97 55.22 3f83 s LYS 260 Cb -0.03 -2.64 -0.13 0.00 -0.52 0.00 0.00 37.83 34.51 3f83 s LYS 260 CO 0.02 -0.61 2.17 0.43 -0.92 0.00 0.00 175.35 176.44 3f83 n SER 261 N 4.63 1.93 0.00 2.83 7.64 -1.26 -4.83 113.62 124.56 3f83 n SER 261 Ca -0.12 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.24 3f83 n SER 261 Cb 0.44 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 3f83 n SER 261 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3f83 n ASP 262 N 9.33 0.00 -0.42 6.43 5.75 -1.26 -5.04 116.55 131.34 3f83 n ASP 262 Ca 0.43 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.21 3f83 n ASP 262 Cb 0.18 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.28 3f83 n ASP 262 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3f83 n GLY 263 N -0.36 1.00 3.91 6.12 0.00 -1.26 -4.63 105.19 109.98 3f83 n GLY 263 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 3f83 n GLY 263 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f83 s LYS 264 N -1.23 3.59 -0.09 1.61 1.02 -1.26 -1.33 119.74 122.04 3f83 s LYS 264 Ca 0.01 -0.15 -0.00 0.00 0.02 0.00 0.00 55.97 55.84 3f83 s LYS 264 Cb 0.01 -2.79 -0.03 0.00 -0.52 0.00 0.00 37.83 34.50 3f83 s LYS 264 CO 0.00 0.37 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.69 3f83 s PHE 265 N -1.85 2.96 0.02 3.18 0.40 -1.25 -4.65 117.98 116.80 3f83 s PHE 265 Ca 0.41 -0.06 0.03 0.00 -0.60 0.00 0.00 56.93 56.71 3f83 s PHE 265 Cb -0.11 -1.77 -0.02 0.00 0.51 0.00 0.00 43.02 41.63 3f83 s PHE 265 CO 0.27 0.25 -0.10 0.71 0.70 0.00 0.00 175.22 177.05 3f83 s TYR 266 N -0.54 0.89 0.01 0.36 1.51 -1.26 -2.02 117.35 116.29 3f83 s TYR 266 Ca 0.08 -0.29 -0.01 0.00 -1.01 0.00 0.00 57.07 55.84 3f83 s TYR 266 Cb -0.12 -0.54 -0.04 0.00 -0.11 0.00 0.00 41.96 41.15 3f83 s TYR 266 CO 0.02 -0.01 0.14 -0.51 -1.11 0.00 0.00 175.55 174.08 3f83 s LEU 267 N -0.84 4.16 -0.01 -1.29 1.43 0.17 -4.74 118.68 117.56 3f83 s LEU 267 Ca -0.00 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 3f83 s LEU 267 Cb -0.06 -2.52 -0.04 0.00 0.03 0.00 0.00 46.19 43.60 3f83 s LEU 267 CO 0.00 0.25 0.04 -0.54 0.23 0.00 0.00 176.35 176.34 3f83 s LYS 268 N -1.96 2.94 0.19 1.70 -0.14 -0.21 -1.30 119.74 120.97 3f83 s LYS 268 Ca 0.27 -0.53 -0.30 0.00 -1.36 0.00 0.00 55.97 54.04 3f83 s LYS 268 Cb -0.12 -2.78 -0.09 0.00 -1.68 0.00 0.00 37.83 33.16 3f83 s LYS 268 CO 0.18 0.64 1.35 0.21 -0.76 0.00 0.00 175.35 176.97 3f83 s LYS 269 N -1.61 4.35 0.24 1.68 2.20 -0.03 -1.21 119.74 125.36 3f83 s LYS 269 Ca 0.21 2.11 -0.05 0.00 -0.36 0.00 0.00 55.97 57.87 3f83 s LYS 269 Cb -0.12 -3.19 0.26 0.00 -1.51 0.00 0.00 37.83 33.28 3f83 s LYS 269 CO 0.12 -0.32 1.81 0.82 -0.36 0.00 0.00 175.35 177.42 3f83 h ILE 270 N 3.79 1.25 -0.10 5.43 2.04 -1.36 -2.73 117.51 125.83 3f83 h ILE 270 Ca -0.44 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 64.63 3f83 h ILE 270 Cb 1.21 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 3f83 h ILE 270 CO 0.79 0.32 0.00 0.59 0.00 0.00 0.00 178.15 179.85 3f83 n ASN 271 N -4.28 2.56 -3.23 1.72 3.02 -1.26 -4.72 115.26 109.06 3f83 n ASN 271 Ca 0.06 -1.84 -0.02 0.00 -0.03 0.00 0.00 54.58 52.75 3f83 n ASN 271 Cb 0.19 -0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 3f83 n ASN 271 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3f83 s ASP 272 N -1.87 -1.00 0.00 6.41 3.68 -1.03 -5.03 116.67 117.83 3f83 s ASP 272 Ca 0.33 -0.80 0.11 0.00 2.13 0.00 0.00 52.55 54.32 3f83 s ASP 272 Cb 0.20 1.70 0.63 0.00 -1.45 0.00 0.00 42.92 44.00 3f83 s ASP 272 CO 0.31 -0.21 1.17 -0.90 0.13 0.00 0.00 175.17 175.67 3f83 n ASP 273 N 4.53 0.00 0.07 -0.34 5.68 -1.20 -1.53 116.55 123.75 3f83 n ASP 273 Ca 0.10 -0.16 0.13 0.00 -0.50 0.00 0.00 54.79 54.36 3f83 n ASP 273 Cb 0.54 -0.12 0.36 0.00 -1.14 0.00 0.00 41.12 40.77 3f83 n ASP 273 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3f83 n SER 274 N -1.12 0.64 -4.66 -1.12 3.41 -1.26 -4.81 113.62 104.69 3f83 n SER 274 Ca 0.07 0.38 -0.35 0.00 -0.26 0.00 0.00 58.87 58.72 3f83 n SER 274 Cb 0.06 -0.41 -0.09 0.00 -0.26 0.00 0.00 64.21 63.50 3f83 n SER 274 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3f83 s LYS 275 N -3.10 3.55 0.25 4.33 3.01 -0.58 -5.04 119.74 122.16 3f83 s LYS 275 Ca 0.10 -0.36 0.05 0.00 -1.01 0.00 0.00 55.97 54.75 3f83 s LYS 275 Cb 0.14 -3.04 -0.05 0.00 -1.01 0.00 0.00 37.83 33.87 3f83 s LYS 275 CO 0.63 0.47 -0.04 -1.21 0.51 0.00 0.00 175.35 175.71 3f83 s GLU 276 N -0.22 1.42 -0.05 1.68 2.02 -1.26 -0.85 118.70 121.43 3f83 s GLU 276 Ca 0.07 -1.71 -0.01 0.00 0.02 0.00 0.00 54.97 53.34 3f83 s GLU 276 Cb -0.12 -0.89 0.03 0.00 0.10 0.00 0.00 34.13 33.24 3f83 s GLU 276 CO 0.02 -0.01 0.02 -1.17 0.02 0.00 0.00 175.26 174.14 3f83 s LEU 277 N -3.36 0.47 0.41 1.80 0.20 -0.42 -4.95 118.68 112.83 3f83 s LEU 277 Ca 0.28 -0.01 -0.20 0.00 0.69 0.00 0.00 54.13 54.89 3f83 s LEU 277 Cb 0.04 -0.30 -0.10 0.00 -0.43 0.00 0.00 46.19 45.40 3f83 s LEU 277 CO 0.10 -0.21 0.91 -0.69 -0.29 0.00 0.00 176.35 176.16 3f83 s VAL 278 N 1.95 4.46 0.15 1.68 1.01 -1.26 -0.65 120.40 127.73 3f83 s VAL 278 Ca 0.03 1.37 -0.14 0.00 0.00 0.00 0.00 61.98 63.23 3f83 s VAL 278 Cb -0.12 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.67 3f83 s VAL 278 CO -0.04 -0.30 0.39 -0.72 0.00 0.00 0.00 175.10 174.43 3f83 s TYR 279 N -2.15 -0.03 0.18 5.22 -0.85 -0.86 -4.53 117.35 114.32 3f83 s TYR 279 Ca 0.60 -0.31 0.10 0.00 -0.52 0.00 0.00 57.07 56.94 3f83 s TYR 279 Cb -0.09 0.21 -0.04 0.00 0.38 0.00 0.00 41.96 42.41 3f83 s TYR 279 CO 0.14 -0.75 -0.22 0.95 -1.52 0.00 0.00 175.55 174.15 3f83 s THR 280 N -3.86 2.13 0.12 -3.49 -4.23 0.68 -3.78 115.64 103.21 3f83 s THR 280 Ca 0.07 -1.95 0.08 0.00 -1.18 0.00 0.00 61.69 58.71 3f83 s THR 280 Cb 0.02 -1.99 -0.04 0.00 1.34 0.00 0.00 72.50 71.83 3f83 s THR 280 CO -0.07 -0.17 -0.12 -0.76 -0.54 0.00 0.00 174.62 172.96 3f83 s LEU 281 N -2.59 2.93 -0.11 4.79 1.43 -1.26 -1.13 118.68 122.72 3f83 s LEU 281 Ca 0.18 -0.48 -0.05 0.00 -1.03 0.00 0.00 54.13 52.75 3f83 s LEU 281 Cb -0.07 -1.71 0.06 0.00 0.03 0.00 0.00 46.19 44.49 3f83 s LEU 281 CO 0.08 0.16 0.25 -0.55 0.23 0.00 0.00 176.35 176.52 3f83 s SER 282 N -2.31 0.14 -0.32 2.29 0.15 -0.52 -4.03 113.70 109.10 3f83 s SER 282 Ca 0.21 0.54 -0.08 0.00 0.70 0.00 0.00 55.95 57.32 3f83 s SER 282 Cb -0.10 0.54 0.02 0.00 -1.71 0.00 0.00 66.02 64.76 3f83 s SER 282 CO 0.13 -0.21 0.11 -0.22 1.20 0.00 0.00 173.24 174.25 3f83 s LEU 283 N 1.94 4.12 -0.56 3.45 2.96 -0.56 -0.36 118.68 129.66 3f83 s LEU 283 Ca -0.03 -0.83 -0.20 0.00 -0.22 0.00 0.00 54.13 52.85 3f83 s LEU 283 Cb -0.11 -1.91 0.07 0.00 0.50 0.00 0.00 46.19 44.73 3f83 s LEU 283 CO -0.08 -0.25 0.74 -0.76 -1.32 0.00 0.00 176.35 174.68 3f83 s LEU 284 N 1.50 4.91 -0.31 -0.68 1.43 0.23 -1.34 118.68 124.42 3f83 s LEU 284 Ca 0.02 -1.03 -0.02 0.00 -1.03 0.00 0.00 54.13 52.07 3f83 s LEU 284 Cb -0.18 -2.44 0.05 0.00 0.03 0.00 0.00 46.19 43.66 3f83 s LEU 284 CO 0.04 -1.09 0.02 -0.22 0.23 0.00 0.00 176.35 175.32 3f83 s LEU 285 N 3.04 4.02 -1.53 1.79 2.96 0.14 -1.06 118.68 128.03 3f83 s LEU 285 Ca 0.17 -1.33 -0.18 0.00 -0.22 0.00 0.00 54.13 52.56 3f83 s LEU 285 Cb -0.20 -1.72 0.18 0.00 0.50 0.00 0.00 46.19 44.95 3f83 s LEU 285 CO 0.11 -0.28 0.46 0.00 -1.32 0.00 0.00 176.35 175.31 3f83 n ALA 286 N 4.62 -1.05 0.00 5.97 0.00 -0.16 0.73 120.51 130.62 3f83 n ALA 286 Ca -0.12 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.14 3f83 n ALA 286 Cb 0.43 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.92 3f83 n ALA 286 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f83 n GLY 287 N -1.05 3.34 3.75 0.00 0.00 -1.26 -1.66 105.19 108.31 3f83 n GLY 287 Ca 0.07 -0.96 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 3f83 n GLY 287 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f83 s LYS 288 N 0.00 4.80 -0.28 1.61 1.02 0.22 -5.06 119.74 122.05 3f83 s LYS 288 Ca 0.00 1.51 -0.09 0.00 0.02 0.00 0.00 55.97 57.42 3f83 s LYS 288 Cb 0.00 -3.29 -0.02 0.00 -0.52 0.00 0.00 37.83 34.00 3f83 s LYS 288 CO 0.00 0.42 0.12 -0.80 -0.92 0.00 0.00 175.35 174.17 3f83 s ASN 289 N -0.90 5.39 0.21 2.83 0.01 -1.26 0.25 114.94 121.48 3f83 s ASN 289 Ca 0.43 -0.37 0.10 0.00 -0.71 0.00 0.00 52.86 52.30 3f83 s ASN 289 Cb -0.26 -1.97 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 3f83 s ASN 289 CO 0.32 -0.12 -0.13 -0.76 -1.51 0.00 0.00 177.10 174.90 3f83 s LEU 290 N 1.62 2.81 -0.51 0.60 1.43 -0.45 -4.99 118.68 119.19 3f83 s LEU 290 Ca 0.05 -0.73 0.03 0.00 -1.03 0.00 0.00 54.13 52.45 3f83 s LEU 290 Cb -0.16 -1.46 0.14 0.00 0.03 0.00 0.00 46.19 44.74 3f83 s LEU 290 CO 0.05 0.08 0.28 -0.89 0.23 0.00 0.00 176.35 176.11 3f83 s THR 291 N -1.93 2.11 0.29 5.49 2.01 -1.26 -1.50 115.64 120.86 3f83 s THR 291 Ca 0.26 -3.13 -0.29 0.00 0.31 0.00 0.00 61.69 58.84 3f83 s THR 291 Cb -0.08 -2.46 -0.10 0.00 0.01 0.00 0.00 72.50 69.87 3f83 s THR 291 CO 0.15 -0.87 1.45 -2.84 -0.69 0.00 0.00 174.62 171.82 3f83 s PRO 292 N -0.18 4.23 0.21 4.92 0.02 -1.26 -5.02 135.00 137.92 3f83 s PRO 292 Ca 0.19 2.38 0.09 0.00 0.02 0.00 0.00 61.00 63.68 3f83 s PRO 292 Cb -0.22 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.19 3f83 s PRO 292 CO -0.02 -0.44 -0.07 0.95 -0.33 0.00 0.00 177.00 177.09 3f83 s THR 293 N -0.39 3.28 -0.18 0.99 -4.23 -1.26 -4.46 115.64 109.39 3f83 s THR 293 Ca 0.57 -1.74 -0.35 0.00 -1.18 0.00 0.00 61.69 59.00 3f83 s THR 293 Cb -0.43 -2.67 -0.12 0.00 1.34 0.00 0.00 72.50 70.62 3f83 s THR 293 CO 0.49 -0.19 1.95 -3.20 -0.54 0.00 0.00 174.62 173.12 3f83 n ASN 294 N -0.25 3.04 0.00 3.99 2.85 -0.44 -1.86 115.26 122.58 3f83 n ASN 294 Ca -0.09 0.83 0.00 0.00 -0.11 0.00 0.00 54.58 55.20 3f83 n ASN 294 Cb 0.57 -1.33 0.00 0.00 1.24 0.00 0.00 39.78 40.26 3f83 n ASN 294 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3f83 n GLY 295 N 4.88 1.72 3.51 8.20 0.00 -0.53 -4.59 105.19 118.38 3f83 n GLY 295 Ca 0.27 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 3f83 n GLY 295 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3f83 s GLN 296 N -0.01 3.26 0.25 1.61 2.00 -0.78 -4.95 119.66 121.04 3f83 s GLN 296 Ca 0.00 -0.49 -0.30 0.00 -2.00 0.00 0.00 55.36 52.57 3f83 s GLN 296 Cb 0.00 -3.94 -0.10 0.00 0.80 0.00 0.00 33.01 29.77 3f83 s GLN 296 CO 0.00 -0.90 1.51 0.00 -0.50 0.00 0.00 175.29 175.40 3f83 s ALA 297 N 2.50 3.69 -0.13 1.58 0.00 -1.26 -4.60 121.76 123.54 3f83 s ALA 297 Ca 0.18 1.40 -0.13 0.00 0.00 0.00 0.00 51.96 53.42 3f83 s ALA 297 Cb -0.15 -3.59 -0.05 0.00 0.00 0.00 0.00 23.12 19.33 3f83 s ALA 297 CO 0.16 -0.81 0.28 -0.51 0.00 0.00 0.00 175.76 174.87 3f83 s LEU 298 N -0.13 4.31 -0.30 0.00 1.43 0.50 -4.93 118.68 119.55 3f83 s LEU 298 Ca 0.62 0.56 -0.05 0.00 -1.03 0.00 0.00 54.13 54.24 3f83 s LEU 298 Cb -0.44 -2.34 0.03 0.00 0.03 0.00 0.00 46.19 43.47 3f83 s LEU 298 CO 0.42 0.20 0.05 0.20 0.23 0.00 0.00 176.35 177.45 3f83 s ASN 299 N -0.08 4.98 -0.17 2.29 0.01 -1.26 -1.00 114.94 119.72 3f83 s ASN 299 Ca 0.17 -0.97 -0.01 0.00 -0.71 0.00 0.00 52.86 51.34 3f83 s ASN 299 Cb -0.13 -1.80 -0.01 0.00 0.41 0.00 0.00 41.25 39.71 3f83 s ASN 299 CO 0.05 -0.23 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.68 3f83 s ILE 300 N 1.39 3.09 0.11 0.60 -1.09 -0.37 -4.97 121.20 119.96 3f83 s ILE 300 Ca -0.01 -0.62 -0.30 0.00 -2.23 0.00 0.00 60.65 57.49 3f83 s ILE 300 Cb -0.18 -2.34 -0.06 0.00 -1.58 0.00 0.00 42.46 38.29 3f83 s ILE 300 CO 0.01 0.49 1.18 0.20 -1.23 0.00 0.00 174.94 175.58 3f83 s ASN 301 N 0.86 7.12 0.22 3.58 -0.87 -1.26 -0.43 114.94 124.16 3f83 s ASN 301 Ca -0.03 2.06 0.24 0.00 -1.57 0.00 0.00 52.86 53.56 3f83 s ASN 301 Cb -0.15 -2.59 0.26 0.00 -0.02 0.00 0.00 41.25 38.75 3f83 s ASN 301 CO 0.00 -0.40 1.31 0.71 -2.57 0.00 0.00 177.10 176.15 3f83 h THR 302 N 4.22 0.00 -1.00 1.60 1.35 -1.55 -3.38 112.91 114.16 3f83 h THR 302 Ca -0.43 -0.77 0.33 0.00 -0.55 0.00 0.00 66.41 64.99 3f83 h THR 302 Cb 1.21 1.43 -0.15 0.00 -1.73 0.00 0.00 68.15 68.91 3f83 h THR 302 CO 0.78 0.00 0.56 0.00 -0.25 0.00 0.00 175.52 176.61 3f83 h ALA 303 N 2.23 1.96 0.00 6.62 0.00 -1.89 0.37 119.26 128.55 3f83 h ALA 303 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3f83 h ALA 303 Cb 0.88 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3f83 h ALA 303 CO 0.00 -0.60 -0.67 -1.13 0.00 0.00 0.00 179.25 176.85 3f83 n SER 304 N -5.07 0.60 -4.74 0.00 3.41 -1.26 -4.96 113.62 101.60 3f83 n SER 304 Ca 0.32 -0.25 -0.41 0.00 -0.26 0.00 0.00 58.87 58.27 3f83 n SER 304 Cb 1.00 0.41 -0.05 0.00 -0.26 0.00 0.00 64.21 65.31 3f83 n SER 304 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3f83 s LEU 305 N -3.38 4.56 0.61 1.04 1.43 0.12 -4.95 118.68 118.11 3f83 s LEU 305 Ca 0.09 1.96 -0.15 0.00 -1.03 0.00 0.00 54.13 55.00 3f83 s LEU 305 Cb 0.16 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.75 3f83 s LEU 305 CO 0.74 -0.02 1.05 -1.61 0.23 0.00 0.00 176.35 176.74 3f83 s GLU 306 N -0.66 3.27 0.25 1.70 2.02 -0.66 -5.06 118.70 119.55 3f83 s GLU 306 Ca 0.45 1.14 0.01 0.00 0.02 0.00 0.00 54.97 56.59 3f83 s GLU 306 Cb -0.26 -2.03 -0.00 0.00 0.10 0.00 0.00 34.13 31.93 3f83 s GLU 306 CO 0.33 -0.85 0.03 0.25 0.02 0.00 0.00 175.26 175.04 3f83 n THR 307 N -2.23 0.00 -3.66 3.63 -2.24 -1.26 -4.54 114.28 103.98 3f83 n THR 307 Ca 0.08 -1.29 -0.14 0.00 -2.27 0.00 0.00 64.05 60.43 3f83 n THR 307 Cb 0.53 0.34 -0.08 0.00 -2.10 0.00 0.00 70.33 69.02 3f83 n THR 307 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3f83 s ASN 308 N -2.45 -0.55 0.14 3.42 3.04 -0.95 -4.93 114.94 112.66 3f83 s ASN 308 Ca 0.04 0.91 -0.25 0.00 0.04 0.00 0.00 52.86 53.61 3f83 s ASN 308 Cb 0.00 0.91 -0.07 0.00 -1.54 0.00 0.00 41.25 40.55 3f83 s ASN 308 CO 0.03 -0.32 0.75 0.26 -3.04 0.00 0.00 177.10 174.78 3f83 s TRP 309 N -0.24 3.88 0.03 0.43 0.52 -1.26 -1.33 118.94 120.96 3f83 s TRP 309 Ca -0.04 1.57 -0.10 0.00 0.02 0.00 0.00 56.10 57.55 3f83 s TRP 309 Cb -0.03 -2.74 0.01 0.00 -1.15 0.00 0.00 33.47 29.55 3f83 s TRP 309 CO 0.03 0.49 0.21 -0.80 0.02 0.00 0.00 176.95 176.91 3f83 s ASN 310 N -1.00 -0.00 -1.15 2.95 0.01 -0.50 -4.95 114.94 110.29 3f83 s ASN 310 Ca 0.35 -0.30 -0.13 0.00 -0.71 0.00 0.00 52.86 52.07 3f83 s ASN 310 Cb -0.22 0.29 0.19 0.00 0.41 0.00 0.00 41.25 41.92 3f83 s ASN 310 CO 0.25 -0.54 1.32 -0.60 -1.51 0.00 0.00 177.10 176.02 3f83 s ARG 311 N -2.37 4.05 -0.26 -0.60 6.06 -1.26 -1.14 118.95 123.43 3f83 s ARG 311 Ca -0.07 -2.62 -0.17 0.00 -2.50 0.00 0.00 55.73 50.38 3f83 s ARG 311 Cb -0.02 -4.93 -0.03 0.00 0.06 0.00 0.00 34.95 30.03 3f83 s ARG 311 CO -0.03 -1.65 0.46 0.42 -2.50 0.00 0.00 175.30 172.00 3f83 s ILE 312 N 1.09 5.11 0.67 4.11 1.01 -1.26 -5.03 121.20 126.90 3f83 s ILE 312 Ca 0.39 0.75 -0.05 0.00 0.00 0.00 0.00 60.65 61.74 3f83 s ILE 312 Cb -0.05 -3.77 0.05 0.00 0.01 0.00 0.00 42.46 38.70 3f83 s ILE 312 CO -0.03 0.12 0.96 0.42 0.00 0.00 0.00 174.94 176.41 3f83 s THR 313 N 2.21 2.51 0.43 2.92 -4.23 -1.26 -4.84 115.64 113.38 3f83 s THR 313 Ca 0.19 -0.29 -0.25 0.00 -1.18 0.00 0.00 61.69 60.15 3f83 s THR 313 Cb -0.16 -3.06 -0.08 0.00 1.34 0.00 0.00 72.50 70.54 3f83 s THR 313 CO 0.09 -0.06 1.31 0.00 -0.54 0.00 0.00 174.62 175.42 3f83 s ALA 314 N -3.14 3.18 0.01 3.99 0.00 -1.26 -4.94 121.76 119.59 3f83 s ALA 314 Ca 0.59 1.23 -0.22 0.00 0.00 0.00 0.00 51.96 53.56 3f83 s ALA 314 Cb -0.11 -3.49 -0.12 0.00 0.00 0.00 0.00 23.12 19.40 3f83 s ALA 314 CO 0.44 -0.90 1.01 0.28 0.00 0.00 0.00 175.76 176.59 3f83 h VAL 315 N 2.27 0.00 0.00 0.00 2.07 -1.86 -3.47 116.25 115.26 3f83 h VAL 315 Ca -0.50 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.75 3f83 h VAL 315 Cb 1.25 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3f83 h VAL 315 CO 0.62 0.00 0.00 0.35 0.02 0.00 0.00 177.57 178.56 3f83 n THR 316 N -4.91 0.00 -4.27 2.57 -2.24 -1.26 -5.14 114.28 99.03 3f83 n THR 316 Ca -0.10 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.48 3f83 n THR 316 Cb 0.31 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.43 3f83 n THR 316 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3f83 s MET 317 N 0.62 1.09 0.61 -0.78 1.00 -1.26 -4.64 119.30 115.93 3f83 s MET 317 Ca 0.00 -1.23 -0.01 0.00 0.00 0.00 0.00 55.69 54.46 3f83 s MET 317 Cb 0.00 -1.14 0.05 0.00 0.00 0.00 0.00 34.83 33.75 3f83 s MET 317 CO 0.00 0.24 0.86 -1.25 0.00 0.00 0.00 175.02 174.87 3f83 s PRO 318 N -2.38 2.34 0.65 2.03 0.05 -1.26 -4.80 135.00 131.63 3f83 s PRO 318 Ca 0.09 -0.73 -0.17 0.00 0.05 0.00 0.00 61.00 60.23 3f83 s PRO 318 Cb -0.07 -2.40 -0.01 0.00 0.05 0.00 0.00 34.50 32.07 3f83 s PRO 318 CO 0.04 -0.93 1.22 -1.83 0.05 0.00 0.00 177.00 175.55 3f83 s GLU 319 N -4.92 2.63 -0.26 4.56 -1.05 -1.26 -4.71 118.70 113.68 3f83 s GLU 319 Ca 0.59 1.83 0.03 0.00 -0.15 0.00 0.00 54.97 57.27 3f83 s GLU 319 Cb -0.10 -1.88 0.06 0.00 -0.44 0.00 0.00 34.13 31.77 3f83 s GLU 319 CO 0.41 -1.48 -0.10 0.42 0.95 0.00 0.00 175.26 175.46 3f83 s ILE 320 N -1.72 2.14 -1.96 1.83 1.01 -1.26 -4.94 121.20 116.30 3f83 s ILE 320 Ca 0.77 -1.65 0.23 0.00 0.00 0.00 0.00 60.65 60.00 3f83 s ILE 320 Cb -0.31 -2.27 0.66 0.00 0.01 0.00 0.00 42.46 40.55 3f83 s ILE 320 CO 0.38 -0.06 1.55 -1.20 0.00 0.00 0.00 174.94 175.62 3f83 n SER 321 N 4.44 4.02 -3.64 3.58 7.64 -1.26 -4.55 113.62 123.84 3f83 n SER 321 Ca -0.13 -2.02 -0.15 0.00 1.01 0.00 0.00 58.87 57.58 3f83 n SER 321 Cb 0.42 -0.50 -0.07 0.00 -1.01 0.00 0.00 64.21 63.04 3f83 n SER 321 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3f83 s VAL 322 N -1.04 0.02 0.71 0.44 0.11 -1.26 -5.14 120.40 114.24 3f83 s VAL 322 Ca 0.50 -0.17 -0.16 0.00 -2.93 0.00 0.00 61.98 59.22 3f83 s VAL 322 Cb 0.26 -0.81 -0.02 0.00 -1.53 0.00 0.00 36.38 34.28 3f83 s VAL 322 CO 0.33 -0.09 0.73 -2.65 -3.33 0.00 0.00 175.10 170.09 3f83 n PRO 323 N 1.41 0.40 -4.52 1.54 -0.02 -1.26 -4.79 135.00 127.77 3f83 n PRO 323 Ca -0.19 0.18 -0.25 0.00 -2.02 0.00 0.00 63.50 61.22 3f83 n PRO 323 Cb 0.56 -2.00 -0.08 0.00 -0.02 0.00 0.00 33.50 31.96 3f83 n PRO 323 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3f83 s VAL 324 N -1.86 0.71 -0.10 -1.45 -7.23 -0.29 -4.93 120.40 105.25 3f83 s VAL 324 Ca 0.69 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.76 3f83 s VAL 324 Cb -0.35 -2.40 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 3f83 s VAL 324 CO 0.54 0.00 0.22 -0.76 -0.31 0.00 0.00 175.10 174.79 3f83 s LEU 325 N -3.61 4.38 0.25 1.32 1.43 -1.26 -1.42 118.68 119.78 3f83 s LEU 325 Ca 0.24 0.58 -0.02 0.00 -1.03 0.00 0.00 54.13 53.90 3f83 s LEU 325 Cb 0.03 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 3f83 s LEU 325 CO 0.14 0.34 0.27 0.00 0.23 0.00 0.00 176.35 177.33 3f83 s TRP 327 N -3.84 3.22 0.05 0.00 0.51 -0.04 -2.23 118.94 116.61 3f83 s TRP 327 Ca 0.35 0.06 -0.27 0.00 -2.12 0.00 0.00 56.10 54.12 3f83 s TRP 327 Cb 0.04 -2.54 -0.05 0.00 -0.81 0.00 0.00 33.47 30.10 3f83 s TRP 327 CO 0.15 -0.31 0.85 -1.25 -0.51 0.00 0.00 176.95 175.88 3f83 s PRO 328 N 1.91 4.56 0.09 4.98 0.05 -1.26 -0.73 135.00 144.60 3f83 s PRO 328 Ca 0.10 1.22 0.01 0.00 0.05 0.00 0.00 61.00 62.38 3f83 s PRO 328 Cb -0.16 -3.39 -0.04 0.00 0.05 0.00 0.00 34.50 30.96 3f83 s PRO 328 CO 0.11 0.19 -0.04 0.20 0.05 0.00 0.00 177.00 177.51 3f83 s GLY 329 N 0.19 0.70 -0.12 0.56 0.00 0.45 -0.98 107.32 108.12 3f83 s GLY 329 Ca 0.43 -1.32 0.01 0.00 0.00 0.00 0.00 44.72 43.83 3f83 s GLY 329 CO 0.25 -1.40 -0.12 -1.60 0.00 0.00 0.00 173.10 170.23 3f83 s ARG 330 N -3.89 1.98 -0.36 2.90 3.52 -0.23 -0.31 118.95 122.57 3f83 s ARG 330 Ca 0.12 -0.45 -0.16 0.00 -0.13 0.00 0.00 55.73 55.10 3f83 s ARG 330 Cb 0.06 -1.81 -0.00 0.00 -1.56 0.00 0.00 34.95 31.64 3f83 s ARG 330 CO -0.06 -0.16 0.43 -1.17 -0.81 0.00 0.00 175.30 173.53 3f83 s LEU 331 N 1.31 4.47 -0.19 -0.88 2.96 0.54 -0.60 118.68 126.29 3f83 s LEU 331 Ca -0.01 -0.23 -0.09 0.00 -0.22 0.00 0.00 54.13 53.58 3f83 s LEU 331 Cb -0.14 -2.43 -0.05 0.00 0.50 0.00 0.00 46.19 44.08 3f83 s LEU 331 CO -0.06 -0.43 0.12 -1.58 -1.32 0.00 0.00 176.35 173.09 3f83 s GLN 332 N 2.17 4.07 -0.14 1.98 0.74 0.51 -0.59 119.66 128.40 3f83 s GLN 332 Ca 0.14 -0.22 -0.05 0.00 0.05 0.00 0.00 55.36 55.28 3f83 s GLN 332 Cb -0.16 -3.37 -0.03 0.00 1.10 0.00 0.00 33.01 30.55 3f83 s GLN 332 CO 0.13 0.36 0.01 -0.51 -0.55 0.00 0.00 175.29 174.73 3f83 s LEU 333 N 0.18 3.58 0.07 3.68 2.01 0.14 -1.44 118.68 126.90 3f83 s LEU 333 Ca 0.08 0.04 0.07 0.00 0.01 0.00 0.00 54.13 54.34 3f83 s LEU 333 Cb -0.11 -1.87 -0.03 0.00 0.01 0.00 0.00 46.19 44.19 3f83 s LEU 333 CO -0.01 0.24 -0.19 -1.81 1.01 0.00 0.00 176.35 175.59 3f83 s ASP 334 N -0.03 2.28 -0.12 2.29 1.01 -0.29 -1.96 116.67 119.85 3f83 s ASP 334 Ca 0.04 -0.59 -0.08 0.00 0.71 0.00 0.00 52.55 52.63 3f83 s ASP 334 Cb -0.13 -0.14 0.04 0.00 1.01 0.00 0.00 42.92 43.70 3f83 s ASP 334 CO 0.02 0.07 0.29 0.00 0.21 0.00 0.00 175.17 175.76 3f83 s ALA 335 N -1.01 -0.70 -0.31 5.23 0.00 -0.63 -0.23 121.76 124.10 3f83 s ALA 335 Ca 0.05 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 53.00 3f83 s ALA 335 Cb -0.09 -0.62 0.11 0.00 0.00 0.00 0.00 23.12 22.52 3f83 s ALA 335 CO 0.03 -0.18 0.15 0.21 0.00 0.00 0.00 175.76 175.96 3f83 s LYS 336 N 0.83 0.38 0.22 0.00 2.20 -1.26 -0.95 119.74 121.17 3f83 s LYS 336 Ca -0.06 -0.83 0.10 0.00 -0.36 0.00 0.00 55.97 54.83 3f83 s LYS 336 Cb -0.07 -1.34 -0.04 0.00 -1.51 0.00 0.00 37.83 34.86 3f83 s LYS 336 CO -0.06 -1.06 -0.15 0.14 -0.36 0.00 0.00 175.35 173.87 3f83 s VAL 337 N 1.75 2.82 -0.17 4.02 -7.23 0.20 -4.94 120.40 116.86 3f83 s VAL 337 Ca 0.11 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.30 3f83 s VAL 337 Cb -0.18 -2.43 0.01 0.00 0.56 0.00 0.00 36.38 34.34 3f83 s VAL 337 CO -0.26 -0.23 -0.16 -0.75 -0.31 0.00 0.00 175.10 173.39 3f83 s LYS 338 N -3.09 3.14 -1.34 4.82 2.20 -1.26 -0.13 119.74 124.08 3f83 s LYS 338 Ca 0.26 -0.77 -0.05 0.00 -0.36 0.00 0.00 55.97 55.04 3f83 s LYS 338 Cb -0.07 -2.64 -0.00 0.00 -1.51 0.00 0.00 37.83 33.61 3f83 s LYS 338 CO 0.14 -0.09 0.52 0.09 -0.36 0.00 0.00 175.35 175.65 3f83 n ASN 339 N 4.35 -1.47 -4.80 1.43 3.02 0.24 -4.97 115.26 113.06 3f83 n ASN 339 Ca -0.20 -1.01 -0.34 0.00 -0.03 0.00 0.00 54.58 53.01 3f83 n ASN 339 Cb 0.51 -3.14 -0.03 0.00 -0.61 0.00 0.00 39.78 36.51 3f83 n ASN 339 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3f83 s PRO 340 N -6.43 3.74 0.73 3.52 0.04 -1.26 -5.02 135.00 130.32 3f83 s PRO 340 Ca 0.11 1.30 -0.15 0.00 0.04 0.00 0.00 61.00 62.30 3f83 s PRO 340 Cb -0.04 -2.09 0.04 0.00 0.04 0.00 0.00 34.50 32.45 3f83 s PRO 340 CO 0.88 -0.47 1.22 -1.21 0.04 0.00 0.00 177.00 177.46 3f83 s GLU 341 N -3.42 2.13 0.61 4.56 2.02 -1.26 -4.87 118.70 118.47 3f83 s GLU 341 Ca 0.66 1.80 -0.15 0.00 0.02 0.00 0.00 54.97 57.29 3f83 s GLU 341 Cb -0.16 -1.83 -0.03 0.00 0.10 0.00 0.00 34.13 32.22 3f83 s GLU 341 CO 0.23 -1.85 1.07 0.00 0.02 0.00 0.00 175.26 174.73 3f83 s ALA 342 N -1.93 2.68 0.00 5.21 0.00 0.60 -4.76 121.76 123.56 3f83 s ALA 342 Ca 0.75 0.42 0.00 0.00 0.00 0.00 0.00 51.96 53.13 3f83 s ALA 342 Cb -0.30 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.57 3f83 s ALA 342 CO 0.45 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.69 3f83 n GLY 343 N -0.90 0.74 3.79 0.00 0.00 -0.86 -4.94 105.19 103.02 3f83 n GLY 343 Ca 0.09 -2.19 -0.39 0.00 0.00 0.00 0.00 46.02 43.54 3f83 n GLY 343 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3f83 s GLN 344 N -0.86 4.22 0.12 1.61 -1.52 -1.26 -1.80 119.66 120.17 3f83 s GLN 344 Ca 0.00 0.68 0.09 0.00 -1.95 0.00 0.00 55.36 54.18 3f83 s GLN 344 Cb 0.00 -3.29 -0.04 0.00 -0.22 0.00 0.00 33.01 29.46 3f83 s GLN 344 CO 0.00 0.50 -0.22 0.71 -0.25 0.00 0.00 175.29 176.03 3f83 s TYR 345 N -0.62 1.96 -0.01 0.91 1.51 -0.23 -0.89 117.35 119.97 3f83 s TYR 345 Ca 0.29 -0.41 -0.17 0.00 -1.01 0.00 0.00 57.07 55.76 3f83 s TYR 345 Cb -0.18 -1.05 0.03 0.00 -0.11 0.00 0.00 41.96 40.65 3f83 s TYR 345 CO 0.17 0.28 0.37 1.41 -1.11 0.00 0.00 175.55 176.66 3f83 s MET 346 N -2.12 0.74 0.38 -0.62 1.75 -0.35 -2.12 119.30 116.95 3f83 s MET 346 Ca 0.11 -0.15 -0.11 0.00 -1.25 0.00 0.00 55.69 54.29 3f83 s MET 346 Cb -0.09 0.33 0.04 0.00 2.84 0.00 0.00 34.83 37.95 3f83 s MET 346 CO 0.05 -0.21 0.69 0.20 -0.65 0.00 0.00 175.02 175.10 3f83 s GLY 347 N -1.37 0.81 0.01 2.11 0.00 0.53 -1.04 107.32 108.36 3f83 s GLY 347 Ca -0.12 -1.05 0.03 0.00 0.00 0.00 0.00 44.72 43.58 3f83 s GLY 347 CO 0.04 -0.57 -0.10 0.21 0.00 0.00 0.00 173.10 172.69 3f83 s ASN 348 N -3.14 1.20 -0.20 1.64 3.84 -1.26 -1.50 114.94 115.51 3f83 s ASN 348 Ca 0.21 -0.26 -0.02 0.00 0.21 0.00 0.00 52.86 52.99 3f83 s ASN 348 Cb -0.04 -0.11 -0.00 0.00 -0.55 0.00 0.00 41.25 40.56 3f83 s ASN 348 CO 0.15 0.07 -0.09 -0.63 -2.79 0.00 0.00 177.10 173.81 3f83 s ILE 349 N -0.45 2.99 -0.25 -5.21 1.01 0.07 -3.64 121.20 115.72 3f83 s ILE 349 Ca 0.02 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.91 3f83 s ILE 349 Cb -0.05 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 3f83 s ILE 349 CO 0.00 0.46 0.32 -0.75 0.00 0.00 0.00 174.94 174.97 3f83 s LYS 350 N 1.37 4.05 -0.23 2.79 2.20 0.19 -0.76 119.74 129.35 3f83 s LYS 350 Ca 0.05 -0.03 -0.07 0.00 -0.36 0.00 0.00 55.97 55.56 3f83 s LYS 350 Cb -0.14 -3.61 -0.03 0.00 -1.51 0.00 0.00 37.83 32.54 3f83 s LYS 350 CO -0.06 -0.15 0.07 0.42 -0.36 0.00 0.00 175.35 175.28 3f83 s ILE 351 N 1.67 4.46 0.10 5.43 1.01 0.85 -1.50 121.20 133.22 3f83 s ILE 351 Ca 0.13 -0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.73 3f83 s ILE 351 Cb -0.15 -3.06 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 3f83 s ILE 351 CO 0.09 0.37 -0.13 0.42 0.00 0.00 0.00 174.94 175.68 3f83 s THR 352 N 1.23 3.14 -0.11 2.92 -4.23 -0.05 -0.88 115.64 117.66 3f83 s THR 352 Ca 0.05 -1.31 -0.08 0.00 -1.18 0.00 0.00 61.69 59.17 3f83 s THR 352 Cb -0.14 -2.44 0.04 0.00 1.34 0.00 0.00 72.50 71.30 3f83 s THR 352 CO 0.03 0.15 0.28 0.12 -0.54 0.00 0.00 174.62 174.66 3f83 s PHE 353 N -1.15 -0.36 -0.16 3.99 5.99 -0.33 -0.83 117.98 125.14 3f83 s PHE 353 Ca 0.19 0.84 -0.04 0.00 0.00 0.00 0.00 56.93 57.92 3f83 s PHE 353 Cb -0.11 0.10 0.06 0.00 0.00 0.00 0.00 43.02 43.07 3f83 s PHE 353 CO 0.11 -0.21 0.06 0.99 -0.00 0.00 0.00 175.22 176.17 3f83 s THR 354 N 0.81 0.17 0.39 0.12 2.01 0.08 -1.32 115.64 117.90 3f83 s THR 354 Ca -0.05 -0.24 -0.24 0.00 0.31 0.00 0.00 61.69 61.47 3f83 s THR 354 Cb -0.07 -0.71 -0.09 0.00 0.01 0.00 0.00 72.50 71.64 3f83 s THR 354 CO -0.05 -0.18 1.01 -2.16 -0.69 0.00 0.00 174.62 172.55 3f83 s PRO 355 N 2.03 4.26 -0.13 4.92 0.05 -1.26 -0.42 135.00 144.44 3f83 s PRO 355 Ca 0.01 1.40 -0.29 0.00 0.05 0.00 0.00 61.00 62.17 3f83 s PRO 355 Cb -0.16 -2.53 -0.02 0.00 0.05 0.00 0.00 34.50 31.84 3f83 s PRO 355 CO -0.08 -0.04 1.29 -1.54 0.05 0.00 0.00 177.00 176.68 3f83 s SER 356 N -1.69 6.94 -0.50 6.66 1.04 0.83 -4.84 113.70 122.14 3f83 s SER 356 Ca 0.57 1.77 0.03 0.00 0.48 0.00 0.00 55.95 58.80 3f83 s SER 356 Cb -0.19 -2.54 0.14 0.00 0.10 0.00 0.00 66.02 63.53 3f83 s SER 356 CO 0.24 -0.74 0.28 -0.55 0.98 0.00 0.00 173.24 173.45 3f83 s SER 357 N 2.00 3.96 0.27 7.02 0.15 -1.26 -4.29 113.70 121.55 3f83 s SER 357 Ca 0.57 -2.95 0.00 0.00 0.70 0.00 0.00 55.95 54.27 3f83 s SER 357 Cb -0.23 -1.32 0.62 0.00 -1.71 0.00 0.00 66.02 63.38 3f83 s SER 357 CO 0.17 -0.23 1.69 -0.61 1.20 0.00 0.00 173.24 175.46 3f83 h GLN 358 N 6.43 0.32 -0.82 5.44 -0.00 -2.00 -2.86 115.11 121.61 3f83 h GLN 358 Ca -0.01 -0.02 0.18 0.00 -0.00 0.00 0.00 58.65 58.81 3f83 h GLN 358 Cb 0.89 -0.07 -0.11 0.00 0.00 0.00 0.00 27.48 28.18 3f83 h GLN 358 CO 0.59 0.21 0.31 0.00 0.00 0.00 0.00 178.83 179.94 3f83 h THR 359 N 0.33 0.53 -0.27 2.39 1.03 -2.03 -3.44 112.91 111.46 3f83 h THR 359 Ca 0.50 -0.13 0.25 0.00 -0.01 0.00 0.00 66.41 67.03 3f83 h THR 359 Cb 0.93 0.12 -0.22 0.00 -1.07 0.00 0.00 68.15 67.91 3f83 h THR 359 CO -0.54 0.07 0.23 -0.22 -0.01 0.00 0.00 175.52 175.05 3f83 s LEU 360 N -10.51 -0.31 -0.26 0.00 2.96 -1.08 -5.11 118.68 104.38 3f83 s LEU 360 Ca -0.12 0.23 -0.07 0.00 -0.22 0.00 0.00 54.13 53.95 3f83 s LEU 360 Cb 0.23 1.27 0.01 0.00 0.50 0.00 0.00 46.19 48.20 3f83 s LEU 360 CO 0.77 -0.06 0.24 -0.67 -1.32 0.00 0.00 176.35 175.32 3f83 n ASP 361 N 5.35 -1.97 -4.52 3.68 2.03 -1.26 -4.89 116.55 114.97 3f83 n ASP 361 Ca -0.08 -0.25 -0.43 0.00 0.52 0.00 0.00 54.79 54.56 3f83 n ASP 361 Cb 0.54 -0.62 -0.05 0.00 -0.72 0.00 0.00 41.12 40.28 3f83 n ASP 361 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3f83 s ASN 362 N -1.59 6.36 1.17 1.67 2.47 -1.26 -5.04 114.94 118.71 3f83 s ASN 362 Ca 0.07 -0.32 -0.16 0.00 0.42 0.00 0.00 52.86 52.86 3f83 s ASN 362 Cb -0.01 -2.40 0.20 0.00 -1.45 0.00 0.00 41.25 37.59 3f83 s ASN 362 CO 0.35 -1.07 0.45 0.29 -3.72 0.00 0.00 177.10 173.39 3f83 n LYS 363 N 7.03 -2.15 -3.78 0.43 5.02 -1.26 -4.77 118.16 118.68 3f83 n LYS 363 Ca 0.01 -0.61 -0.36 0.00 -2.02 0.00 0.00 58.31 55.33 3f83 n LYS 363 Cb 0.47 -1.90 -0.07 0.00 -0.02 0.00 0.00 35.03 33.52 3f83 n LYS 363 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 3f83 s GLN 364 N -3.86 3.84 0.33 1.97 0.74 -1.26 -4.64 119.66 116.77 3f83 s GLN 364 Ca 0.62 -0.15 0.09 0.00 0.05 0.00 0.00 55.36 55.97 3f83 s GLN 364 Cb -0.18 -3.31 -0.05 0.00 1.10 0.00 0.00 33.01 30.57 3f83 s GLN 364 CO 0.66 0.53 0.05 0.14 -0.55 0.00 0.00 175.29 176.12 3f83 s VAL 365 N -0.31 2.86 0.14 1.34 -7.23 -0.43 -4.95 120.40 111.81 3f83 s VAL 365 Ca 0.12 -1.88 -0.01 0.00 -1.81 0.00 0.00 61.98 58.40 3f83 s VAL 365 Cb -0.12 -2.86 -0.04 0.00 0.56 0.00 0.00 36.38 33.93 3f83 s VAL 365 CO 0.01 -0.22 0.07 -1.83 -0.31 0.00 0.00 175.10 172.83 3f83 s GLU 366 N -3.75 0.95 -0.12 4.82 -1.05 -1.26 -1.18 118.70 117.10 3f83 s GLU 366 Ca 0.35 -1.44 -0.10 0.00 -0.15 0.00 0.00 54.97 53.63 3f83 s GLU 366 Cb -0.02 0.25 0.04 0.00 -0.44 0.00 0.00 34.13 33.96 3f83 s GLU 366 CO 0.20 -0.27 0.32 0.21 0.95 0.00 0.00 175.26 176.67 3f83 s LYS 367 N -4.05 0.36 0.00 -4.83 2.47 -0.05 -4.77 119.74 108.87 3f83 s LYS 367 Ca 0.25 0.49 0.02 0.00 -1.56 0.00 0.00 55.97 55.17 3f83 s LYS 367 Cb 0.07 0.12 -0.04 0.00 -1.46 0.00 0.00 37.83 36.53 3f83 s LYS 367 CO 0.02 -0.07 -0.01 -0.80 0.16 0.00 0.00 175.35 174.65 3f83 s ASN 368 N 0.44 5.02 -0.12 1.43 -0.87 -1.26 -0.11 114.94 119.47 3f83 s ASN 368 Ca -0.02 -0.04 -0.00 0.00 -1.57 0.00 0.00 52.86 51.22 3f83 s ASN 368 Cb -0.04 -1.28 0.02 0.00 -0.02 0.00 0.00 41.25 39.93 3f83 s ASN 368 CO -0.02 0.28 -0.09 -0.63 -2.57 0.00 0.00 177.10 174.07 3f83 s ILE 369 N -1.08 1.10 -0.05 0.60 1.01 0.06 -4.28 121.20 118.57 3f83 s ILE 369 Ca 0.19 -0.34 -0.30 0.00 0.00 0.00 0.00 60.65 60.21 3f83 s ILE 369 Cb -0.11 -1.10 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 3f83 s ILE 369 CO 0.10 0.38 1.01 -0.89 0.00 0.00 0.00 174.94 175.54 3f83 s THR 370 N 1.65 4.76 -0.13 2.92 2.01 -0.45 -0.75 115.64 125.65 3f83 s THR 370 Ca 0.04 2.00 -0.01 0.00 0.31 0.00 0.00 61.69 64.04 3f83 s THR 370 Cb -0.13 -4.29 -0.02 0.00 0.01 0.00 0.00 72.50 68.08 3f83 s THR 370 CO -0.08 0.08 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.12 3f83 s VAL 371 N 1.55 3.21 0.36 3.82 1.01 -0.56 -1.39 120.40 128.39 3f83 s VAL 371 Ca 0.51 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.93 3f83 s VAL 371 Cb -0.20 -2.36 -0.07 0.00 0.00 0.00 0.00 36.38 33.75 3f83 s VAL 371 CO 0.23 0.52 0.02 0.42 0.00 0.00 0.00 175.10 176.30 3f83 s THR 372 N 0.29 1.58 0.11 3.92 -4.23 -0.25 -0.35 115.64 116.71 3f83 s THR 372 Ca -0.09 -2.02 -0.25 0.00 -1.18 0.00 0.00 61.69 58.16 3f83 s THR 372 Cb -0.15 -2.84 0.08 0.00 1.34 0.00 0.00 72.50 70.92 3f83 s THR 372 CO 0.05 -0.03 0.68 0.00 -0.54 0.00 0.00 174.62 174.77 3f83 s ALA 373 N -3.02 -1.66 -0.03 3.99 0.00 -0.90 -1.18 121.76 118.95 3f83 s ALA 373 Ca 0.35 0.67 -0.00 0.00 0.00 0.00 0.00 51.96 52.98 3f83 s ALA 373 Cb 0.09 0.72 0.03 0.00 0.00 0.00 0.00 23.12 23.95 3f83 s ALA 373 CO 0.16 -0.73 0.03 0.45 0.00 0.00 0.00 175.76 175.67 3f83 s SER 374 N -2.59 0.46 -0.20 0.00 0.15 -1.26 -1.07 113.70 109.18 3f83 s SER 374 Ca 0.01 0.02 -0.05 0.00 0.70 0.00 0.00 55.95 56.63 3f83 s SER 374 Cb -0.01 -0.14 -0.03 0.00 -1.71 0.00 0.00 66.02 64.13 3f83 s SER 374 CO -0.11 -0.15 0.01 -0.69 1.20 0.00 0.00 173.24 173.51 3f83 s VAL 375 N 1.33 4.09 0.16 4.45 1.01 -0.75 -4.48 120.40 126.22 3f83 s VAL 375 Ca -0.06 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 3f83 s VAL 375 Cb -0.13 -2.85 -0.07 0.00 0.00 0.00 0.00 36.38 33.32 3f83 s VAL 375 CO -0.03 0.43 1.15 -1.81 0.00 0.00 0.00 175.10 174.84 3f83 s ASP 376 N 0.94 7.16 0.29 3.32 1.11 -1.26 -2.02 116.67 126.22 3f83 s ASP 376 Ca 0.02 2.13 -0.30 0.00 0.18 0.00 0.00 52.55 54.58 3f83 s ASP 376 Cb -0.14 -2.60 -0.12 0.00 1.07 0.00 0.00 42.92 41.12 3f83 s ASP 376 CO 0.02 -0.32 1.46 -2.65 1.18 0.00 0.00 175.17 174.86 3f83 n PRO 377 N 2.66 2.36 -3.97 8.23 -0.02 -1.26 -4.83 135.00 138.17 3f83 n PRO 377 Ca 0.04 0.83 -0.09 0.00 -2.02 0.00 0.00 63.50 62.27 3f83 n PRO 377 Cb 0.46 -2.53 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 3f83 n PRO 377 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3f83 s VAL 378 N -0.34 0.13 -0.09 -1.45 1.01 -1.26 -4.91 120.40 113.49 3f83 s VAL 378 Ca 0.63 -1.05 -0.08 0.00 0.00 0.00 0.00 61.98 61.48 3f83 s VAL 378 Cb -0.56 -0.62 0.02 0.00 0.00 0.00 0.00 36.38 35.22 3f83 s VAL 378 CO 0.53 -0.58 0.23 -0.51 0.00 0.00 0.00 175.10 174.78 3f83 s ILE 379 N -2.08 0.00 0.04 2.22 2.07 -1.26 -2.70 121.20 119.49 3f83 s ILE 379 Ca -0.10 -0.01 -0.04 0.00 -1.41 0.00 0.00 60.65 59.09 3f83 s ILE 379 Cb -0.05 -0.33 -0.02 0.00 0.13 0.00 0.00 42.46 42.19 3f83 s ILE 379 CO -0.03 -0.01 0.06 -0.62 -1.91 0.00 0.00 174.94 172.43 3f83 s ASP 380 N 0.10 0.26 -0.23 4.50 -1.08 0.56 -4.58 116.67 116.20 3f83 s ASP 380 Ca -0.00 -0.65 -0.02 0.00 -0.52 0.00 0.00 52.55 51.36 3f83 s ASP 380 Cb -0.02 0.21 0.01 0.00 -1.46 0.00 0.00 42.92 41.67 3f83 s ASP 380 CO 0.00 -0.52 -0.08 -0.22 0.52 0.00 0.00 175.17 174.87 3f83 s LEU 381 N -2.28 2.89 0.41 -1.34 2.96 -1.26 -0.15 118.68 119.92 3f83 s LEU 381 Ca -0.03 -0.69 0.07 0.00 -0.22 0.00 0.00 54.13 53.26 3f83 s LEU 381 Cb 0.00 -1.65 -0.07 0.00 0.50 0.00 0.00 46.19 44.97 3f83 s LEU 381 CO -0.06 -0.07 0.05 -0.76 -1.32 0.00 0.00 176.35 174.19 3f83 s LEU 382 N 1.36 2.91 0.88 -0.68 1.43 -0.64 -4.49 118.68 119.44 3f83 s LEU 382 Ca 0.03 -1.32 -0.12 0.00 -1.03 0.00 0.00 54.13 51.69 3f83 s LEU 382 Cb -0.15 -1.00 0.12 0.00 0.03 0.00 0.00 46.19 45.18 3f83 s LEU 382 CO -0.06 -0.49 1.09 -1.10 0.23 0.00 0.00 176.35 176.03 3f83 s GLN 383 N -3.76 1.43 0.49 1.70 -0.21 0.13 -0.82 119.66 118.63 3f83 s GLN 383 Ca 0.35 0.77 0.20 0.00 0.02 0.00 0.00 55.36 56.70 3f83 s GLN 383 Cb 0.08 -1.83 1.26 0.00 1.00 0.00 0.00 33.01 33.52 3f83 s GLN 383 CO 0.18 -2.10 2.06 0.00 -2.12 0.00 0.00 175.29 173.31 3f83 h ALA 384 N -1.45 1.56 -0.98 6.09 0.00 -1.51 -1.50 119.26 121.47 3f83 h ALA 384 Ca -0.49 -0.12 0.20 0.00 0.00 0.00 0.00 54.91 54.50 3f83 h ALA 384 Cb 1.28 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 3f83 h ALA 384 CO 0.56 0.16 0.62 -0.44 0.00 0.00 0.00 179.25 180.15 3f83 h ASP 385 N 0.00 0.64 0.00 0.00 3.32 -1.91 -3.46 116.42 115.01 3f83 h ASP 385 Ca -0.00 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3f83 h ASP 385 Cb 0.27 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3f83 h ASP 385 CO 0.02 0.22 0.00 0.61 -1.72 0.00 0.00 179.24 178.37 3f83 n GLY 386 N -1.40 0.68 3.88 2.75 0.00 -0.56 -5.08 105.19 105.46 3f83 n GLY 386 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 3f83 n GLY 386 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3f83 s ASN 387 N -2.51 6.59 0.52 1.61 0.02 -1.26 -4.82 114.94 115.08 3f83 s ASN 387 Ca 0.00 0.87 -0.21 0.00 -1.02 0.00 0.00 52.86 52.50 3f83 s ASN 387 Cb 0.00 -2.20 -0.06 0.00 0.02 0.00 0.00 41.25 39.01 3f83 s ASN 387 CO 0.00 -0.09 1.18 0.00 0.02 0.00 0.00 177.10 178.21 3f83 s ALA 388 N -1.86 2.80 0.39 0.60 0.00 -1.26 -0.70 121.76 121.74 3f83 s ALA 388 Ca 0.46 0.96 -0.27 0.00 0.00 0.00 0.00 51.96 53.12 3f83 s ALA 388 Cb -0.11 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.51 3f83 s ALA 388 CO 0.23 -0.85 1.32 -0.51 0.00 0.00 0.00 175.76 175.95 3f83 s LEU 389 N -3.48 4.26 0.75 0.00 1.43 -1.26 -4.74 118.68 115.64 3f83 s LEU 389 Ca 0.69 2.70 -0.15 0.00 -1.03 0.00 0.00 54.13 56.35 3f83 s LEU 389 Cb -0.29 -3.84 0.05 0.00 0.03 0.00 0.00 46.19 42.15 3f83 s LEU 389 CO 0.33 -0.80 1.21 -2.84 0.23 0.00 0.00 176.35 174.49 3f83 s PRO 390 N -2.15 1.98 0.00 1.29 0.02 -1.26 -4.92 135.00 129.96 3f83 s PRO 390 Ca 0.55 1.78 0.23 0.00 0.02 0.00 0.00 61.00 63.58 3f83 s PRO 390 Cb -0.39 -1.81 0.11 0.00 0.02 0.00 0.00 34.50 32.43 3f83 s PRO 390 CO 0.51 -1.96 1.14 -1.13 -0.33 0.00 0.00 177.00 175.23 3f83 n SER 391 N -2.88 0.84 -3.78 2.53 3.41 -1.26 -4.73 113.62 107.75 3f83 n SER 391 Ca 0.14 -0.71 -0.13 0.00 -0.26 0.00 0.00 58.87 57.91 3f83 n SER 391 Cb 0.50 0.64 -0.12 0.00 -0.26 0.00 0.00 64.21 64.98 3f83 n SER 391 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f83 s ALA 392 N -2.96 -0.60 0.04 7.33 0.00 -1.26 -0.50 121.76 123.81 3f83 s ALA 392 Ca 0.10 0.76 0.03 0.00 0.00 0.00 0.00 51.96 52.86 3f83 s ALA 392 Cb 0.17 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 3f83 s ALA 392 CO 0.78 -0.13 -0.10 0.08 0.00 0.00 0.00 175.76 176.39 3f83 s VAL 393 N 0.37 0.71 -0.20 0.00 1.01 0.11 -4.92 120.40 117.48 3f83 s VAL 393 Ca -0.02 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 3f83 s VAL 393 Cb -0.03 -0.72 0.05 0.00 0.00 0.00 0.00 36.38 35.68 3f83 s VAL 393 CO -0.02 -0.27 -0.03 -0.75 0.00 0.00 0.00 175.10 174.04 3f83 s LYS 394 N -1.44 1.30 0.01 2.72 2.20 -1.26 -0.07 119.74 123.19 3f83 s LYS 394 Ca -0.06 -0.69 -0.30 0.00 -0.36 0.00 0.00 55.97 54.55 3f83 s LYS 394 Cb -0.09 -2.28 -0.05 0.00 -1.51 0.00 0.00 37.83 33.90 3f83 s LYS 394 CO 0.01 -0.56 1.22 -0.51 -0.36 0.00 0.00 175.35 175.15 3f83 s LEU 395 N 1.59 4.33 0.21 5.43 1.43 0.27 -4.95 118.68 126.99 3f83 s LEU 395 Ca -0.03 1.95 -0.30 0.00 -1.03 0.00 0.00 54.13 54.73 3f83 s LEU 395 Cb -0.17 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.40 3f83 s LEU 395 CO -0.07 -0.54 1.06 0.00 0.23 0.00 0.00 176.35 177.03 3f83 s ALA 396 N 1.63 3.36 -0.06 4.21 0.00 -1.26 -4.58 121.76 125.06 3f83 s ALA 396 Ca 0.58 0.78 -0.02 0.00 0.00 0.00 0.00 51.96 53.30 3f83 s ALA 396 Cb -0.28 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 3f83 s ALA 396 CO 0.26 -0.11 0.03 -0.47 0.00 0.00 0.00 175.76 175.48 3f83 s TYR 397 N -0.60 3.22 -0.28 0.00 5.04 -1.26 0.16 117.35 123.63 3f83 s TYR 397 Ca 0.47 0.22 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 3f83 s TYR 397 Cb -0.29 -1.78 0.06 0.00 0.35 0.00 0.00 41.96 40.30 3f83 s TYR 397 CO 0.35 0.52 -0.04 0.45 -1.34 0.00 0.00 175.55 175.48 3f83 s SER 398 N -1.15 4.71 0.40 4.32 0.15 -0.50 -4.98 113.70 116.65 3f83 s SER 398 Ca 0.16 -1.34 0.28 0.00 0.70 0.00 0.00 55.95 55.75 3f83 s SER 398 Cb -0.12 -1.64 1.39 0.00 -1.71 0.00 0.00 66.02 63.94 3f83 s SER 398 CO 0.06 -0.23 1.84 -0.65 1.20 0.00 0.00 173.24 175.46 3f83 h PRO 399 N 7.90 0.00 0.01 5.44 0.11 -1.97 0.39 132.00 143.88 3f83 h PRO 399 Ca -0.20 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 3f83 h PRO 399 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3f83 h PRO 399 CO 0.50 0.00 -0.04 0.00 -0.21 0.00 0.00 178.00 178.26 3f83 h ALA 400 N 2.06 -0.00 0.00 -0.75 0.00 -1.96 -3.36 119.26 115.25 3f83 h ALA 400 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3f83 h ALA 400 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3f83 h ALA 400 CO 0.00 0.01 -0.86 -1.13 0.00 0.00 0.00 179.25 177.26 3f83 n SER 401 N -4.60 0.63 -3.57 0.00 3.41 -1.18 -4.97 113.62 103.35 3f83 n SER 401 Ca -0.10 -0.23 -0.23 0.00 -0.26 0.00 0.00 58.87 58.05 3f83 n SER 401 Cb 0.49 0.61 0.08 0.00 -0.26 0.00 0.00 64.21 65.13 3f83 n SER 401 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3f83 n LYS 402 N -1.86 -7.75 -4.26 4.33 4.01 0.14 -5.01 118.16 107.76 3f83 n LYS 402 Ca 0.03 0.83 -0.14 0.00 -0.51 0.00 0.00 58.31 58.52 3f83 n LYS 402 Cb 0.41 -5.88 -0.10 0.00 -0.51 0.00 0.00 35.03 28.94 3f83 n LYS 402 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 3f83 s THR 403 N -3.33 0.89 -0.07 -0.18 -4.23 -1.19 -4.79 115.64 102.74 3f83 s THR 403 Ca 0.48 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.96 3f83 s THR 403 Cb -0.21 -2.06 -0.04 0.00 1.34 0.00 0.00 72.50 71.53 3f83 s THR 403 CO 0.73 -0.55 0.06 -0.36 -0.54 0.00 0.00 174.62 173.96 3f83 s PHE 404 N -3.51 3.29 0.10 3.99 0.40 -1.26 -1.40 117.98 119.59 3f83 s PHE 404 Ca 0.22 0.27 -0.30 0.00 -0.60 0.00 0.00 56.93 56.52 3f83 s PHE 404 Cb 0.05 -1.80 -0.06 0.00 0.51 0.00 0.00 43.02 41.72 3f83 s PHE 404 CO 0.03 0.55 1.06 -2.00 0.70 0.00 0.00 175.22 175.57 3f83 s GLU 405 N -1.18 4.58 0.37 0.44 2.12 0.12 -4.83 118.70 120.31 3f83 s GLU 405 Ca 0.17 1.60 -0.26 0.00 0.36 0.00 0.00 54.97 56.83 3f83 s GLU 405 Cb -0.12 -3.36 -0.09 0.00 0.26 0.00 0.00 34.13 30.83 3f83 s GLU 405 CO 0.06 0.01 1.13 -1.12 -0.54 0.00 0.00 175.26 174.80 3f83 s SER 406 N 0.42 6.76 -0.17 -1.70 0.01 -1.26 -4.04 113.70 113.72 3f83 s SER 406 Ca 0.51 2.28 -0.23 0.00 1.31 0.00 0.00 55.95 59.82 3f83 s SER 406 Cb -0.26 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.34 3f83 s SER 406 CO 0.31 -0.50 0.73 -0.47 0.41 0.00 0.00 173.24 173.72 3f83 s TYR 407 N -1.40 3.41 -0.04 2.43 5.04 0.29 -4.93 117.35 122.16 3f83 s TYR 407 Ca 0.54 1.10 0.04 0.00 -2.44 0.00 0.00 57.07 56.31 3f83 s TYR 407 Cb -0.29 -2.90 -0.00 0.00 0.35 0.00 0.00 41.96 39.11 3f83 s TYR 407 CO 0.37 -0.18 -0.16 1.03 -1.34 0.00 0.00 175.55 175.27 3f83 s ARG 408 N 1.93 1.68 -0.14 4.97 0.52 -1.26 0.06 118.95 126.70 3f83 s ARG 408 Ca 0.34 -0.58 -0.11 0.00 -0.52 0.00 0.00 55.73 54.86 3f83 s ARG 408 Cb -0.16 -1.47 0.04 0.00 0.52 0.00 0.00 34.95 33.87 3f83 s ARG 408 CO 0.12 0.24 0.35 0.54 0.02 0.00 0.00 175.30 176.57 3f83 s VAL 409 N 0.02 -0.01 -0.04 3.52 0.11 0.44 -4.97 120.40 119.47 3f83 s VAL 409 Ca -0.03 0.04 -0.30 0.00 -2.93 0.00 0.00 61.98 58.76 3f83 s VAL 409 Cb -0.11 -0.51 -0.03 0.00 -1.53 0.00 0.00 36.38 34.20 3f83 s VAL 409 CO 0.02 0.02 1.13 -0.04 -3.33 0.00 0.00 175.10 172.90 3f83 s MET 410 N 0.62 4.41 0.32 1.54 -1.94 -1.26 0.13 119.30 123.12 3f83 s MET 410 Ca -0.04 1.60 0.07 0.00 -1.71 0.00 0.00 55.69 55.62 3f83 s MET 410 Cb -0.05 -3.51 -0.06 0.00 2.01 0.00 0.00 34.83 33.22 3f83 s MET 410 CO -0.04 -0.34 -0.04 0.95 -0.01 0.00 0.00 175.02 175.54 3f83 s THR 411 N 1.83 1.81 -0.08 2.05 -4.23 0.20 -1.48 115.64 115.75 3f83 s THR 411 Ca 0.54 -2.11 -0.04 0.00 -1.18 0.00 0.00 61.69 58.90 3f83 s THR 411 Cb -0.24 -2.64 0.04 0.00 1.34 0.00 0.00 72.50 71.00 3f83 s THR 411 CO 0.23 -0.19 0.18 -1.10 -0.54 0.00 0.00 174.62 173.20 3f83 s GLN 412 N -3.71 0.14 0.23 3.99 -0.21 0.00 -0.15 119.66 119.95 3f83 s GLN 412 Ca 0.32 0.40 -0.30 0.00 0.02 0.00 0.00 55.36 55.80 3f83 s GLN 412 Cb 0.05 -0.12 -0.09 0.00 1.00 0.00 0.00 33.01 33.86 3f83 s GLN 412 CO 0.15 -0.14 1.00 0.54 -2.12 0.00 0.00 175.29 174.71 3f83 s VAL 413 N 1.02 3.96 -0.21 1.09 0.11 -1.26 -1.62 120.40 123.48 3f83 s VAL 413 Ca -0.08 1.90 0.00 0.00 -2.93 0.00 0.00 61.98 60.87 3f83 s VAL 413 Cb -0.09 -4.21 0.02 0.00 -1.53 0.00 0.00 36.38 30.57 3f83 s VAL 413 CO -0.06 0.42 -0.14 -1.00 -3.33 0.00 0.00 175.10 171.00 3f83 s HIS 414 N -0.93 2.93 0.05 1.54 3.76 0.78 -0.85 115.29 122.56 3f83 s HIS 414 Ca 0.43 -1.62 -0.01 0.00 -0.15 0.00 0.00 55.06 53.72 3f83 s HIS 414 Cb -0.27 -1.98 -0.03 0.00 1.11 0.00 0.00 32.58 31.40 3f83 s HIS 414 CO 0.34 -0.76 -0.02 -0.08 -0.85 0.00 0.00 174.74 173.37 3f83 s THR 415 N 1.30 0.19 -1.76 1.30 -1.32 -0.17 -0.32 115.64 114.86 3f83 s THR 415 Ca 0.02 -1.60 0.19 0.00 -1.21 0.00 0.00 61.69 59.09 3f83 s THR 415 Cb -0.15 -1.27 0.52 0.00 -1.51 0.00 0.00 72.50 70.09 3f83 s THR 415 CO -0.09 -0.88 1.43 -0.46 -2.21 0.00 0.00 174.62 172.41 3f83 n ASN 416 N 0.38 3.59 -3.33 8.08 0.23 -1.10 -4.04 115.26 119.07 3f83 n ASN 416 Ca -0.16 -1.99 -0.26 0.00 -0.53 0.00 0.00 54.58 51.65 3f83 n ASN 416 Cb 0.60 -0.38 -0.09 0.00 -2.08 0.00 0.00 39.78 37.83 3f83 n ASN 416 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 3f83 n ASP 417 N 1.32 0.45 0.00 0.53 -0.08 -1.26 -0.30 116.55 117.21 3f83 n ASP 417 Ca 0.20 -2.68 0.05 0.00 -1.51 0.00 0.00 54.79 50.85 3f83 n ASP 417 Cb 0.56 -0.62 0.29 0.00 2.34 0.00 0.00 41.12 43.70 3f83 n ASP 417 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3f83 n ALA 418 N 1.93 2.28 1.22 -1.67 0.00 -1.26 -2.97 120.51 120.03 3f83 n ALA 418 Ca 0.25 -0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.76 3f83 n ALA 418 Cb 0.49 -1.16 0.28 0.00 0.00 0.00 0.00 19.45 19.06 3f83 n ALA 418 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3f83 n THR 419 N -0.71 0.00 -3.97 0.00 -2.24 -1.26 -4.83 114.28 101.26 3f83 n THR 419 Ca 0.07 -0.38 -0.26 0.00 -2.27 0.00 0.00 64.05 61.21 3f83 n THR 419 Cb 0.03 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.27 3f83 n THR 419 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3f83 s LYS 420 N -2.03 3.33 0.68 -0.78 -0.14 -1.16 -4.79 119.74 114.85 3f83 s LYS 420 Ca 0.32 -0.65 -0.16 0.00 -1.36 0.00 0.00 55.97 54.12 3f83 s LYS 420 Cb 0.20 -2.90 0.01 0.00 -1.68 0.00 0.00 37.83 33.46 3f83 s LYS 420 CO 0.33 0.52 1.18 0.15 -0.76 0.00 0.00 175.35 176.77 3f83 s LYS 421 N -3.19 2.51 -0.20 1.68 1.02 -1.26 -4.15 119.74 116.14 3f83 s LYS 421 Ca 0.34 1.69 -0.01 0.00 0.02 0.00 0.00 55.97 58.01 3f83 s LYS 421 Cb -0.11 -1.88 0.01 0.00 -0.52 0.00 0.00 37.83 35.33 3f83 s LYS 421 CO 0.27 -1.54 -0.13 0.08 -0.92 0.00 0.00 175.35 173.11 3f83 s VAL 422 N -1.96 2.60 -0.27 3.17 1.01 -0.57 -2.21 120.40 122.17 3f83 s VAL 422 Ca 0.73 -0.77 -0.09 0.00 0.00 0.00 0.00 61.98 61.86 3f83 s VAL 422 Cb -0.27 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 3f83 s VAL 422 CO 0.41 0.48 0.12 -0.63 0.00 0.00 0.00 175.10 175.48 3f83 s ILE 423 N 1.36 4.69 -0.07 2.22 1.01 0.17 -0.62 121.20 129.96 3f83 s ILE 423 Ca 0.05 -0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.67 3f83 s ILE 423 Cb -0.14 -3.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 3f83 s ILE 423 CO -0.09 0.28 -0.22 -0.69 0.00 0.00 0.00 174.94 174.22 3f83 s VAL 424 N 1.67 2.32 0.32 2.92 1.01 -0.02 0.34 120.40 128.95 3f83 s VAL 424 Ca 0.06 -0.96 -0.15 0.00 0.00 0.00 0.00 61.98 60.93 3f83 s VAL 424 Cb -0.16 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.37 3f83 s VAL 424 CO 0.06 0.57 0.66 -1.59 0.00 0.00 0.00 175.10 174.80 3f83 s LYS 425 N -0.13 1.91 -0.01 2.72 -2.85 -0.53 -1.10 119.74 119.76 3f83 s LYS 425 Ca -0.04 -1.32 -0.00 0.00 -1.00 0.00 0.00 55.97 53.61 3f83 s LYS 425 Cb -0.14 0.56 -0.04 0.00 -2.06 0.00 0.00 37.83 36.15 3f83 s LYS 425 CO 0.04 -0.86 0.06 -0.51 0.10 0.00 0.00 175.35 174.18 3f83 s LEU 426 N -3.04 3.81 0.36 2.77 1.43 -0.44 -1.11 118.68 122.46 3f83 s LEU 426 Ca 0.18 0.11 0.18 0.00 -1.03 0.00 0.00 54.13 53.57 3f83 s LEU 426 Cb -0.04 -2.20 0.65 0.00 0.03 0.00 0.00 46.19 44.63 3f83 s LEU 426 CO 0.11 0.28 1.72 0.00 0.23 0.00 0.00 176.35 178.69 3f83 h ALA 427 N 4.18 1.00 -2.82 4.21 0.00 -1.57 -3.37 119.26 120.89 3f83 h ALA 427 Ca -0.49 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.01 3f83 h ALA 427 Cb 1.18 -0.06 -0.12 0.00 0.00 0.00 0.00 17.79 18.78 3f83 h ALA 427 CO 0.61 0.50 -0.01 0.16 0.00 0.00 0.00 179.25 180.51 3f83 s ASP 428 N -6.49 -0.29 -0.26 0.00 -4.77 -1.26 -5.00 116.67 98.59 3f83 s ASP 428 Ca -0.00 -0.30 -0.29 0.00 -3.30 0.00 0.00 52.55 48.66 3f83 s ASP 428 Cb 0.11 0.51 -0.01 0.00 -1.09 0.00 0.00 42.92 42.44 3f83 s ASP 428 CO 0.70 -0.91 1.41 -0.89 0.70 0.00 0.00 175.17 176.18 3f83 s THR 429 N -3.81 4.00 0.48 2.11 2.01 -1.26 -4.81 115.64 114.36 3f83 s THR 429 Ca 0.04 1.13 -0.19 0.00 0.31 0.00 0.00 61.69 62.98 3f83 s THR 429 Cb 0.01 -3.99 -0.09 0.00 0.01 0.00 0.00 72.50 68.44 3f83 s THR 429 CO -0.11 -0.40 0.98 -2.16 -0.69 0.00 0.00 174.62 172.25 3f83 s PRO 430 N 4.30 3.99 -0.10 4.92 0.04 -1.26 -5.05 135.00 141.84 3f83 s PRO 430 Ca 0.61 1.09 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 3f83 s PRO 430 Cb -0.20 -2.14 0.03 0.00 0.04 0.00 0.00 34.50 32.23 3f83 s PRO 430 CO 0.25 -0.24 0.31 -0.65 0.04 0.00 0.00 177.00 176.71 3f83 s GLN 431 N -3.62 0.42 -0.41 4.56 -1.52 -1.26 -2.95 119.66 114.87 3f83 s GLN 431 Ca 0.62 0.33 -0.23 0.00 -1.95 0.00 0.00 55.36 54.13 3f83 s GLN 431 Cb -0.11 0.20 0.02 0.00 -0.22 0.00 0.00 33.01 32.90 3f83 s GLN 431 CO 0.23 -0.07 0.80 -0.51 -0.25 0.00 0.00 175.29 175.49 3f83 s LEU 432 N -0.08 4.17 -0.12 2.90 1.43 0.53 -3.98 118.68 123.53 3f83 s LEU 432 Ca -0.02 0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.18 3f83 s LEU 432 Cb -0.03 -3.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.15 3f83 s LEU 432 CO 0.01 -0.84 -0.02 -0.89 0.23 0.00 0.00 176.35 174.83 3f83 s THR 433 N 3.25 4.05 0.05 5.49 2.01 0.76 -0.57 115.64 130.69 3f83 s THR 433 Ca 0.31 -0.32 -0.34 0.00 0.31 0.00 0.00 61.69 61.65 3f83 s THR 433 Cb -0.12 -2.74 -0.13 0.00 0.01 0.00 0.00 72.50 69.51 3f83 s THR 433 CO 0.20 0.54 1.66 -0.67 -0.69 0.00 0.00 174.62 175.67 3f83 n ASP 434 N 2.94 3.06 -0.04 3.53 -0.08 0.07 -1.23 116.55 124.79 3f83 n ASP 434 Ca -0.18 1.05 0.13 0.00 -1.51 0.00 0.00 54.79 54.28 3f83 n ASP 434 Cb 0.53 -1.38 0.54 0.00 2.34 0.00 0.00 41.12 43.15 3f83 n ASP 434 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 3f83 h VAL 435 N 4.26 0.88 -0.02 5.18 2.07 -0.62 -2.14 116.25 125.87 3f83 h VAL 435 Ca -0.46 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 66.95 3f83 h VAL 435 Cb 1.27 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 3f83 h VAL 435 CO 0.90 0.06 -0.03 0.18 0.02 0.00 0.00 177.57 178.69 3f83 n LEU 436 N -4.46 2.44 -3.43 2.57 4.77 -1.26 -4.83 117.00 112.79 3f83 n LEU 436 Ca 0.09 -0.98 -0.22 0.00 -0.03 0.00 0.00 56.01 54.87 3f83 n LEU 436 Cb 0.38 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.36 3f83 n LEU 436 CO 0.34 0.43 -0.23 0.21 -1.33 0.00 0.00 177.39 176.81 3f83 s ASN 437 N -1.56 2.19 0.43 -1.43 3.84 -0.80 -5.03 114.94 112.58 3f83 s ASN 437 Ca 0.21 -1.41 0.28 0.00 0.21 0.00 0.00 52.86 52.14 3f83 s ASN 437 Cb 0.15 0.15 1.36 0.00 -0.55 0.00 0.00 41.25 42.36 3f83 s ASN 437 CO 0.25 -0.35 1.66 -1.28 -2.79 0.00 0.00 177.10 174.59 3f83 h SER 438 N 7.68 0.28 1.21 -4.21 0.87 -1.88 0.29 113.55 117.79 3f83 h SER 438 Ca -0.05 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 3f83 h SER 438 Cb 1.03 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 3f83 h SER 438 CO 0.30 -0.12 -0.12 0.35 -0.53 0.00 0.00 176.83 176.72 3f83 n THR 439 N -4.66 0.37 -3.13 2.23 -2.24 -1.26 -4.72 114.28 100.88 3f83 n THR 439 Ca 0.34 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.51 3f83 n THR 439 Cb 1.31 -0.45 -0.07 0.00 -2.10 0.00 0.00 70.33 69.02 3f83 n THR 439 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3f83 s VAL 440 N -3.08 4.87 -0.00 2.28 1.01 0.09 -5.04 120.40 120.53 3f83 s VAL 440 Ca 0.11 0.27 -0.05 0.00 0.00 0.00 0.00 61.98 62.31 3f83 s VAL 440 Cb 0.15 -4.14 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 3f83 s VAL 440 CO 0.60 -0.47 0.10 -1.10 0.00 0.00 0.00 175.10 174.23 3f83 s GLN 441 N 2.73 0.38 -0.05 2.72 -0.21 -1.26 -0.75 119.66 123.22 3f83 s GLN 441 Ca 0.23 -0.35 0.05 0.00 0.02 0.00 0.00 55.36 55.31 3f83 s GLN 441 Cb -0.14 0.16 -0.01 0.00 1.00 0.00 0.00 33.01 34.02 3f83 s GLN 441 CO 0.17 -0.08 -0.22 -1.64 -2.12 0.00 0.00 175.29 171.40 3f83 s MET 442 N -1.16 2.28 0.29 2.91 -1.94 0.27 -4.43 119.30 117.52 3f83 s MET 442 Ca -0.12 -0.79 -0.29 0.00 -1.71 0.00 0.00 55.69 52.78 3f83 s MET 442 Cb -0.07 -1.93 -0.10 0.00 2.01 0.00 0.00 34.83 34.74 3f83 s MET 442 CO 0.01 0.31 1.36 -2.14 -0.01 0.00 0.00 175.02 174.55 3f83 s PRO 443 N -0.05 4.32 -0.18 2.03 0.02 -1.25 -0.35 135.00 139.55 3f83 s PRO 443 Ca -0.05 2.24 -0.09 0.00 0.02 0.00 0.00 61.00 63.13 3f83 s PRO 443 Cb -0.13 -3.09 -0.05 0.00 0.02 0.00 0.00 34.50 31.25 3f83 s PRO 443 CO 0.03 -0.29 0.13 0.42 -0.33 0.00 0.00 177.00 176.97 3f83 s ILE 444 N -0.63 5.43 -0.11 2.83 1.01 -1.15 -3.23 121.20 125.35 3f83 s ILE 444 Ca 0.53 0.19 -0.01 0.00 0.00 0.00 0.00 60.65 61.37 3f83 s ILE 444 Cb -0.40 -3.45 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 3f83 s ILE 444 CO 0.49 0.49 -0.08 -0.55 0.00 0.00 0.00 174.94 175.29 3f83 s SER 445 N -0.04 4.50 -0.05 3.58 0.15 0.29 -4.66 113.70 117.47 3f83 s SER 445 Ca 0.10 -0.14 0.05 0.00 0.70 0.00 0.00 55.95 56.66 3f83 s SER 445 Cb -0.11 -1.42 -0.01 0.00 -1.71 0.00 0.00 66.02 62.77 3f83 s SER 445 CO -0.00 0.26 -0.20 -0.69 1.20 0.00 0.00 173.24 173.81 3f83 s VAL 446 N -0.20 1.64 0.04 4.45 1.01 -1.26 -0.33 120.40 125.76 3f83 s VAL 446 Ca 0.02 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3f83 s VAL 446 Cb -0.13 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 3f83 s VAL 446 CO 0.03 0.47 -0.07 -0.94 0.00 0.00 0.00 175.10 174.58 3f83 s SER 447 N -0.03 0.80 -0.06 3.32 1.04 -0.32 -0.29 113.70 118.15 3f83 s SER 447 Ca -0.04 -0.57 -0.03 0.00 0.48 0.00 0.00 55.95 55.79 3f83 s SER 447 Cb -0.12 0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.08 3f83 s SER 447 CO 0.03 -0.23 0.14 0.86 0.98 0.00 0.00 173.24 175.02 3f83 s TRP 448 N -1.50 -0.16 -1.61 5.02 -0.00 0.69 -1.21 118.94 120.19 3f83 s TRP 448 Ca -0.10 0.44 -0.01 0.00 -0.00 0.00 0.00 56.10 56.44 3f83 s TRP 448 Cb -0.09 -0.05 0.00 0.00 -0.00 0.00 0.00 33.47 33.33 3f83 s TRP 448 CO -0.00 -0.14 0.07 0.41 -0.00 0.00 0.00 176.95 177.30 3f83 n GLY 449 N 3.85 -0.50 1.79 5.86 0.00 -0.53 -0.86 105.19 114.80 3f83 n GLY 449 Ca -0.22 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3f83 n GLY 449 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f83 n GLY 450 N -1.03 0.51 3.14 -0.02 0.00 -1.26 -4.91 105.19 101.63 3f83 n GLY 450 Ca -0.21 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 3f83 n GLY 450 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3f83 s GLN 451 N -0.71 2.50 0.01 1.61 -1.52 -0.04 -5.10 119.66 116.41 3f83 s GLN 451 Ca 0.00 -0.69 -0.30 0.00 -1.95 0.00 0.00 55.36 52.41 3f83 s GLN 451 Cb 0.00 -1.94 -0.06 0.00 -0.22 0.00 0.00 33.01 30.79 3f83 s GLN 451 CO 0.00 0.12 1.45 0.08 -0.25 0.00 0.00 175.29 176.69 3f83 s VAL 452 N 0.46 3.60 0.41 1.09 1.01 -1.26 -0.22 120.40 125.48 3f83 s VAL 452 Ca -0.17 0.98 -0.00 0.00 0.00 0.00 0.00 61.98 62.79 3f83 s VAL 452 Cb -0.17 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 3f83 s VAL 452 CO 0.07 -0.01 0.63 -0.76 0.00 0.00 0.00 175.10 175.04 3f83 s LEU 453 N 2.49 3.79 0.00 3.92 1.43 0.61 -4.94 118.68 125.98 3f83 s LEU 453 Ca 0.66 0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 54.06 3f83 s LEU 453 Cb -0.33 -3.29 0.04 0.00 0.03 0.00 0.00 46.19 42.64 3f83 s LEU 453 CO 0.27 -0.53 0.59 -1.54 0.23 0.00 0.00 176.35 175.37 3f83 n SER 454 N -1.98 -1.46 0.00 2.29 3.41 -1.26 -4.68 113.62 109.94 3f83 n SER 454 Ca -0.01 -1.95 0.08 0.00 -0.26 0.00 0.00 58.87 56.73 3f83 n SER 454 Cb 0.57 2.41 0.44 0.00 -0.26 0.00 0.00 64.21 67.37 3f83 n SER 454 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3f83 n THR 455 N -0.40 0.42 -3.53 6.66 -2.24 -1.26 -1.32 114.28 112.61 3f83 n THR 455 Ca -0.05 0.11 -0.39 0.00 -2.27 0.00 0.00 64.05 61.45 3f83 n THR 455 Cb 0.40 -0.83 -0.11 0.00 -2.10 0.00 0.00 70.33 67.70 3f83 n THR 455 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3f83 s THR 456 N -2.48 5.28 0.61 4.28 2.01 -1.26 -4.79 115.64 119.28 3f83 s THR 456 Ca 0.18 0.04 -0.19 0.00 0.31 0.00 0.00 61.69 62.02 3f83 s THR 456 Cb 0.12 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 3f83 s THR 456 CO 0.25 0.11 1.28 0.00 -0.69 0.00 0.00 174.62 175.56 3f83 s ALA 457 N 1.79 2.52 0.14 7.40 0.00 -1.26 -4.86 121.76 127.50 3f83 s ALA 457 Ca 0.08 1.17 0.11 0.00 0.00 0.00 0.00 51.96 53.32 3f83 s ALA 457 Cb -0.17 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 3f83 s ALA 457 CO 0.11 -1.40 -0.25 0.15 0.00 0.00 0.00 175.76 174.36 3f83 s LYS 458 N -3.26 1.48 -0.09 0.00 1.02 -0.26 -4.95 119.74 113.68 3f83 s LYS 458 Ca 0.79 -1.36 0.01 0.00 0.02 0.00 0.00 55.97 55.43 3f83 s LYS 458 Cb -0.36 -1.92 -0.02 0.00 -0.52 0.00 0.00 37.83 35.01 3f83 s LYS 458 CO 0.39 0.44 -0.11 -1.21 -0.92 0.00 0.00 175.35 173.94 3f83 s GLU 459 N -2.20 3.00 -0.25 1.68 2.02 -1.26 -0.84 118.70 120.84 3f83 s GLU 459 Ca 0.16 -0.64 -0.01 0.00 0.02 0.00 0.00 54.97 54.50 3f83 s GLU 459 Cb -0.10 -2.57 0.03 0.00 0.10 0.00 0.00 34.13 31.59 3f83 s GLU 459 CO 0.07 0.45 -0.06 -0.06 0.02 0.00 0.00 175.26 175.68 3f83 s PHE 460 N -0.24 3.10 0.52 1.61 0.40 0.20 -4.98 117.98 118.59 3f83 s PHE 460 Ca 0.02 -1.64 -0.22 0.00 -0.60 0.00 0.00 56.93 54.49 3f83 s PHE 460 Cb -0.13 -2.05 -0.06 0.00 0.51 0.00 0.00 43.02 41.29 3f83 s PHE 460 CO 0.03 -0.75 1.30 -1.21 0.70 0.00 0.00 175.22 175.28 3f83 s GLU 461 N 1.30 3.33 0.47 0.44 0.41 -1.26 -1.51 118.70 121.88 3f83 s GLU 461 Ca -0.01 2.09 0.19 0.00 -0.41 0.00 0.00 54.97 56.83 3f83 s GLU 461 Cb -0.17 -2.30 1.16 0.00 -1.78 0.00 0.00 34.13 31.04 3f83 s GLU 461 CO -0.04 -0.99 2.02 0.00 -0.49 0.00 0.00 175.26 175.75 3f83 h ALA 462 N 1.63 1.54 -0.13 5.21 0.00 -1.87 -2.27 119.26 123.37 3f83 h ALA 462 Ca -0.50 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.17 3f83 h ALA 462 Cb 1.28 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3f83 h ALA 462 CO 0.58 0.21 -0.30 0.00 0.00 0.00 0.00 179.25 179.74 3f83 h ALA 463 N 1.83 1.26 -0.46 0.00 0.00 -1.90 -2.97 119.26 117.02 3f83 h ALA 463 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3f83 h ALA 463 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3f83 h ALA 463 CO 0.02 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.77 3f83 n ALA 464 N -2.48 3.15 0.69 0.00 0.00 -0.86 -3.90 120.51 117.11 3f83 n ALA 464 Ca -0.01 -1.24 0.08 0.00 0.00 0.00 0.00 53.44 52.26 3f83 n ALA 464 Cb 0.40 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.79 3f83 n ALA 464 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3f83 n LEU 465 N 0.66 1.48 -2.68 0.00 4.77 -1.12 -4.93 117.00 115.19 3f83 n LEU 465 Ca 0.19 -0.74 -0.13 0.00 -0.03 0.00 0.00 56.01 55.31 3f83 n LEU 465 Cb 0.78 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.93 3f83 n LEU 465 CO 0.20 0.29 0.10 0.61 -1.33 0.00 0.00 177.39 177.26 3f83 n GLY 466 N 1.14 -0.11 3.77 -0.72 0.00 -1.25 -1.05 105.19 106.97 3f83 n GLY 466 Ca 0.06 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 3f83 n GLY 466 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f83 s TYR 467 N -3.24 2.95 -0.49 1.61 1.51 -1.26 -3.11 117.35 115.31 3f83 s TYR 467 Ca 0.09 1.52 -0.16 0.00 -1.01 0.00 0.00 57.07 57.50 3f83 s TYR 467 Cb -0.04 -3.46 0.08 0.00 -0.11 0.00 0.00 41.96 38.43 3f83 s TYR 467 CO 0.51 -1.56 0.46 -1.54 -1.11 0.00 0.00 175.55 172.30 3f83 s SER 468 N -1.10 6.17 0.27 2.29 1.04 -1.25 -4.89 113.70 116.22 3f83 s SER 468 Ca 0.59 -1.30 0.05 0.00 0.48 0.00 0.00 55.95 55.76 3f83 s SER 468 Cb -0.32 -2.21 0.37 0.00 0.10 0.00 0.00 66.02 63.96 3f83 s SER 468 CO 0.40 -0.73 1.65 0.00 0.98 0.00 0.00 173.24 175.54 3f83 h ALA 469 N 8.83 1.01 0.12 5.32 0.00 -1.94 -3.24 119.26 129.35 3f83 h ALA 469 Ca -0.28 -0.44 -0.22 0.00 0.00 0.00 0.00 54.91 53.96 3f83 h ALA 469 Cb 1.11 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.81 3f83 h ALA 469 CO 0.92 0.63 -1.08 0.77 0.00 0.00 0.00 179.25 180.49 3f83 h SER 470 N 0.25 0.40 0.00 0.00 0.02 -2.03 -3.46 113.55 108.73 3f83 h SER 470 Ca 0.02 -0.89 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 3f83 h SER 470 Cb 0.89 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.30 3f83 h SER 470 CO 0.07 1.49 0.00 0.61 -1.14 0.00 0.00 176.83 177.86 3f83 n GLY 471 N 1.69 -1.60 3.47 -3.77 0.00 -1.22 -4.99 105.19 98.77 3f83 n GLY 471 Ca -0.19 -0.13 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 3f83 n GLY 471 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f83 s VAL 472 N 0.00 2.96 0.23 1.61 1.01 -1.25 -5.06 120.40 119.90 3f83 s VAL 472 Ca 0.00 -0.92 -0.31 0.00 0.00 0.00 0.00 61.98 60.74 3f83 s VAL 472 Cb 0.00 -2.20 -0.12 0.00 0.00 0.00 0.00 36.38 34.07 3f83 s VAL 472 CO 0.00 0.48 1.68 0.21 0.00 0.00 0.00 175.10 177.47 3f83 s ASN 473 N -1.06 6.38 0.00 3.32 3.84 -1.26 -3.32 114.94 122.85 3f83 s ASN 473 Ca 0.13 2.88 0.00 0.00 0.21 0.00 0.00 52.86 56.08 3f83 s ASN 473 Cb -0.11 -2.61 0.00 0.00 -0.55 0.00 0.00 41.25 37.98 3f83 s ASN 473 CO 0.03 -0.95 0.00 0.61 -2.79 0.00 0.00 177.10 174.00 3f83 n GLY 474 N 3.46 0.48 3.59 1.21 0.00 -1.26 -4.79 105.19 107.87 3f83 n GLY 474 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3f83 n GLY 474 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f83 s VAL 475 N -2.21 5.15 0.99 1.61 1.01 -1.21 -1.00 120.40 124.74 3f83 s VAL 475 Ca 0.00 0.43 -0.11 0.00 0.00 0.00 0.00 61.98 62.30 3f83 s VAL 475 Cb 0.00 -3.77 0.18 0.00 0.00 0.00 0.00 36.38 32.80 3f83 s VAL 475 CO 0.00 0.05 1.10 -0.55 0.00 0.00 0.00 175.10 175.70 3f83 s SER 476 N 1.68 2.42 0.53 3.32 0.15 -0.03 -3.88 113.70 117.88 3f83 s SER 476 Ca 0.15 1.88 -0.13 0.00 0.70 0.00 0.00 55.95 58.55 3f83 s SER 476 Cb -0.16 -2.44 -0.06 0.00 -1.71 0.00 0.00 66.02 61.65 3f83 s SER 476 CO 0.11 -3.36 0.95 -0.94 1.20 0.00 0.00 173.24 171.20 3f83 s SER 477 N -2.74 6.46 0.26 5.45 1.04 -0.21 -4.74 113.70 119.22 3f83 s SER 477 Ca 0.67 1.41 -0.30 0.00 0.48 0.00 0.00 55.95 58.21 3f83 s SER 477 Cb -0.23 -2.45 -0.13 0.00 0.10 0.00 0.00 66.02 63.31 3f83 s SER 477 CO 0.60 -0.64 1.33 -1.20 0.98 0.00 0.00 173.24 174.30 3f83 n SER 478 N -1.94 2.52 -3.96 7.02 7.64 -1.26 -4.76 113.62 118.89 3f83 n SER 478 Ca 0.05 1.16 -0.20 0.00 1.01 0.00 0.00 58.87 60.89 3f83 n SER 478 Cb 0.54 -1.41 -0.16 0.00 -1.01 0.00 0.00 64.21 62.17 3f83 n SER 478 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3f83 s GLN 479 N -0.86 0.98 -0.07 1.43 -1.52 0.79 -4.93 119.66 115.48 3f83 s GLN 479 Ca 0.65 -0.23 -0.26 0.00 -1.95 0.00 0.00 55.36 53.57 3f83 s GLN 479 Cb -0.65 -0.91 -0.03 0.00 -0.22 0.00 0.00 33.01 31.20 3f83 s GLN 479 CO 0.54 0.02 0.81 -2.00 -0.25 0.00 0.00 175.29 174.40 3f83 s GLU 480 N 0.55 4.44 -0.16 2.91 2.12 -1.26 0.59 118.70 127.89 3f83 s GLU 480 Ca -0.08 1.06 -0.10 0.00 0.36 0.00 0.00 54.97 56.20 3f83 s GLU 480 Cb -0.12 -3.48 -0.05 0.00 0.26 0.00 0.00 34.13 30.75 3f83 s GLU 480 CO 0.01 -0.05 0.18 -1.17 -0.54 0.00 0.00 175.26 173.69 3f83 s LEU 481 N 1.15 4.28 -0.10 2.70 2.96 0.35 -1.45 118.68 128.56 3f83 s LEU 481 Ca 0.42 0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 54.70 3f83 s LEU 481 Cb -0.18 -2.16 0.03 0.00 0.50 0.00 0.00 46.19 44.38 3f83 s LEU 481 CO 0.20 0.23 0.00 -0.69 -1.32 0.00 0.00 176.35 174.77 3f83 s VAL 482 N -0.06 0.44 -0.20 1.68 1.01 -0.35 -0.42 120.40 122.51 3f83 s VAL 482 Ca 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.02 3f83 s VAL 482 Cb -0.12 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 3f83 s VAL 482 CO 0.02 0.16 -0.07 -0.63 0.00 0.00 0.00 175.10 174.58 3f83 s ILE 483 N 1.93 3.26 0.18 2.22 1.01 0.11 -1.18 121.20 128.73 3f83 s ILE 483 Ca 0.04 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 60.15 3f83 s ILE 483 Cb -0.13 -2.45 -0.05 0.00 0.01 0.00 0.00 42.46 39.84 3f83 s ILE 483 CO -0.06 0.46 0.03 -0.94 0.00 0.00 0.00 174.94 174.43 3f83 s SER 484 N 1.16 1.02 0.07 3.58 1.04 0.56 -0.55 113.70 120.58 3f83 s SER 484 Ca 0.02 -1.22 -0.09 0.00 0.48 0.00 0.00 55.95 55.14 3f83 s SER 484 Cb -0.14 0.16 -0.00 0.00 0.10 0.00 0.00 66.02 66.14 3f83 s SER 484 CO -0.02 -0.63 0.19 0.00 0.98 0.00 0.00 173.24 173.76 3f83 s ALA 485 N -3.76 -0.26 0.02 5.32 0.00 -1.26 0.11 121.76 121.93 3f83 s ALA 485 Ca 0.27 -0.50 -0.25 0.00 0.00 0.00 0.00 51.96 51.47 3f83 s ALA 485 Cb 0.07 0.41 0.06 0.00 0.00 0.00 0.00 23.12 23.65 3f83 s ALA 485 CO 0.05 -0.45 0.58 0.00 0.00 0.00 0.00 175.76 175.94 3f83 s ALA 486 N -3.39 -1.50 0.39 0.00 0.00 -1.20 -4.36 121.76 111.70 3f83 s ALA 486 Ca 0.01 0.84 -0.25 0.00 0.00 0.00 0.00 51.96 52.57 3f83 s ALA 486 Cb 0.03 0.29 -0.12 0.00 0.00 0.00 0.00 23.12 23.31 3f83 s ALA 486 CO -0.08 -0.47 0.84 -2.30 0.00 0.00 0.00 175.76 173.75 3f83 n PRO 487 N 0.54 1.04 -0.20 0.00 -0.02 -1.26 -3.84 135.00 131.26 3f83 n PRO 487 Ca -0.19 0.37 0.01 0.00 -2.02 0.00 0.00 63.50 61.68 3f83 n PRO 487 Cb 0.59 -1.79 0.11 0.00 -0.02 0.00 0.00 33.50 32.40 3f83 n PRO 487 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3f83 h SER 488 N 1.36 0.06 -3.61 2.55 0.87 -1.93 -3.38 113.55 109.47 3f83 h SER 488 Ca -0.41 0.11 -0.67 0.00 -1.23 0.00 0.00 61.79 59.58 3f83 h SER 488 Cb 1.36 0.13 -0.24 0.00 -0.44 0.00 0.00 62.40 63.21 3f83 h SER 488 CO 0.56 0.04 -0.62 -0.89 -0.53 0.00 0.00 176.83 175.39 3f83 s THR 489 N -6.10 4.14 0.28 2.23 2.01 -1.26 -4.99 115.64 111.95 3f83 s THR 489 Ca -0.13 -0.47 -0.30 0.00 0.31 0.00 0.00 61.69 61.10 3f83 s THR 489 Cb 0.18 -3.05 -0.12 0.00 0.01 0.00 0.00 72.50 69.51 3f83 s THR 489 CO 0.74 0.18 1.50 0.00 -0.69 0.00 0.00 174.62 176.36 3f83 n ALA 490 N 4.90 1.91 -0.29 7.40 0.00 -1.26 -2.10 120.51 131.08 3f83 n ALA 490 Ca -0.15 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3f83 n ALA 490 Cb 0.49 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.57 3f83 n ALA 490 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f83 n GLY 491 N 2.05 0.72 3.63 0.00 0.00 -1.26 -5.06 105.19 105.27 3f83 n GLY 491 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 3f83 n GLY 491 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3f83 s THR 492 N -2.62 3.50 0.11 2.61 -1.32 -0.89 -5.12 115.64 111.90 3f83 s THR 492 Ca 0.00 -1.57 -0.12 0.00 -1.21 0.00 0.00 61.69 58.79 3f83 s THR 492 Cb 0.00 -2.76 -0.06 0.00 -1.51 0.00 0.00 72.50 68.16 3f83 s THR 492 CO 0.00 -0.15 0.48 0.00 -2.21 0.00 0.00 174.62 172.74 3f83 s ALA 493 N -1.80 3.65 0.34 11.08 0.00 -1.26 -4.78 121.76 128.99 3f83 s ALA 493 Ca 0.27 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.69 3f83 s ALA 493 Cb -0.09 -2.40 -0.11 0.00 0.00 0.00 0.00 23.12 20.53 3f83 s ALA 493 CO 0.18 0.51 1.48 -2.14 0.00 0.00 0.00 175.76 175.79 3f83 s PRO 494 N -1.94 4.16 0.31 0.00 0.02 -1.26 -4.94 135.00 131.34 3f83 s PRO 494 Ca 0.35 2.51 -0.29 0.00 0.02 0.00 0.00 61.00 63.59 3f83 s PRO 494 Cb -0.14 -3.00 -0.11 0.00 0.02 0.00 0.00 34.50 31.27 3f83 s PRO 494 CO 0.19 -0.50 1.46 0.99 -0.33 0.00 0.00 177.00 178.81 3f83 s THR 495 N -0.79 2.36 0.41 0.99 2.01 -1.26 -4.95 115.64 114.41 3f83 s THR 495 Ca 0.55 0.33 -0.26 0.00 0.31 0.00 0.00 61.69 62.62 3f83 s THR 495 Cb -0.46 -3.21 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 3f83 s THR 495 CO 0.57 0.06 1.39 0.00 -0.69 0.00 0.00 174.62 175.95 3f83 s ALA 496 N -0.53 3.33 0.00 7.40 0.00 -1.26 -4.80 121.76 125.91 3f83 s ALA 496 Ca 0.56 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.91 3f83 s ALA 496 Cb -0.44 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.13 3f83 s ALA 496 CO 0.52 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.69 3f83 n GLY 497 N 0.60 -0.38 3.73 0.00 0.00 0.62 -4.96 105.19 104.80 3f83 n GLY 497 Ca 0.03 -1.61 -0.35 0.00 0.00 0.00 0.00 46.02 44.09 3f83 n GLY 497 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3f83 s ASN 498 N -2.64 5.75 0.07 1.61 0.01 -1.26 -1.19 114.94 117.29 3f83 s ASN 498 Ca 0.00 0.23 0.09 0.00 -0.71 0.00 0.00 52.86 52.47 3f83 s ASN 498 Cb 0.00 -1.83 -0.03 0.00 0.41 0.00 0.00 41.25 39.80 3f83 s ASN 498 CO 0.00 0.32 -0.24 -0.31 -1.51 0.00 0.00 177.10 175.36 3f83 s TYR 499 N -0.53 2.13 0.00 2.20 1.51 0.10 0.18 117.35 122.95 3f83 s TYR 499 Ca 0.11 -0.40 -0.09 0.00 -1.01 0.00 0.00 57.07 55.68 3f83 s TYR 499 Cb -0.12 -1.23 0.00 0.00 -0.11 0.00 0.00 41.96 40.50 3f83 s TYR 499 CO 0.02 0.17 0.17 0.45 -1.11 0.00 0.00 175.55 175.25 3f83 s SER 500 N -1.47 0.00 -0.07 2.29 0.15 -0.37 -2.04 113.70 112.19 3f83 s SER 500 Ca 0.11 -0.19 -0.31 0.00 0.70 0.00 0.00 55.95 56.26 3f83 s SER 500 Cb -0.10 0.23 0.11 0.00 -1.71 0.00 0.00 66.02 64.55 3f83 s SER 500 CO 0.03 -0.40 0.98 -0.83 1.20 0.00 0.00 173.24 174.22 3f83 s GLY 501 N -1.46 -0.40 -0.18 9.45 0.00 -0.38 -0.17 107.32 114.17 3f83 s GLY 501 Ca -0.14 1.26 -0.02 0.00 0.00 0.00 0.00 44.72 45.83 3f83 s GLY 501 CO 0.01 0.45 -0.10 0.14 0.00 0.00 0.00 173.10 173.60 3f83 s VAL 502 N -2.76 2.99 -0.34 1.40 1.01 -1.26 0.12 120.40 121.56 3f83 s VAL 502 Ca 0.06 -0.64 -0.18 0.00 0.00 0.00 0.00 61.98 61.22 3f83 s VAL 502 Cb -0.01 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 3f83 s VAL 502 CO -0.07 0.48 0.50 -0.69 0.00 0.00 0.00 175.10 175.32 3f83 s VAL 503 N 1.08 5.03 -0.49 2.92 1.01 0.44 -4.67 120.40 125.71 3f83 s VAL 503 Ca 0.00 0.34 -0.12 0.00 0.00 0.00 0.00 61.98 62.20 3f83 s VAL 503 Cb -0.15 -3.94 0.12 0.00 0.00 0.00 0.00 36.38 32.41 3f83 s VAL 503 CO -0.02 -0.19 0.40 -0.44 0.00 0.00 0.00 175.10 174.85 3f83 s SER 504 N 1.75 5.91 -0.36 3.32 0.01 -1.26 -0.51 113.70 122.56 3f83 s SER 504 Ca 0.18 -1.80 -0.19 0.00 1.31 0.00 0.00 55.95 55.45 3f83 s SER 504 Cb -0.16 -2.10 0.00 0.00 0.21 0.00 0.00 66.02 63.98 3f83 s SER 504 CO 0.13 -0.74 0.58 -0.22 0.41 0.00 0.00 173.24 173.39 3f83 s LEU 505 N 1.48 4.33 -0.19 2.44 2.96 0.57 -1.44 118.68 128.83 3f83 s LEU 505 Ca 0.04 0.02 -0.04 0.00 -0.22 0.00 0.00 54.13 53.93 3f83 s LEU 505 Cb -0.27 -2.68 -0.02 0.00 0.50 0.00 0.00 46.19 43.71 3f83 s LEU 505 CO 0.01 -0.55 -0.02 -0.69 -1.32 0.00 0.00 176.35 173.78 3f83 s VAL 506 N 2.56 3.84 -0.14 1.68 1.01 -0.27 0.40 120.40 129.47 3f83 s VAL 506 Ca 0.21 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.84 3f83 s VAL 506 Cb -0.15 -2.71 0.02 0.00 0.00 0.00 0.00 36.38 33.54 3f83 s VAL 506 CO 0.14 0.45 -0.15 -0.32 0.00 0.00 0.00 175.10 175.22 3f83 s MET 507 N 0.82 2.37 0.03 2.72 1.75 0.25 -1.45 119.30 125.79 3f83 s MET 507 Ca -0.00 -0.59 0.08 0.00 -1.25 0.00 0.00 55.69 53.92 3f83 s MET 507 Cb -0.14 -2.11 -0.03 0.00 2.84 0.00 0.00 34.83 35.39 3f83 s MET 507 CO 0.02 -0.19 -0.22 0.99 -0.65 0.00 0.00 175.02 174.97 3f83 s THR 508 N 1.33 2.46 1.02 10.11 2.01 0.15 -0.79 115.64 131.94 3f83 s THR 508 Ca 0.02 -1.21 -0.17 0.00 0.31 0.00 0.00 61.69 60.64 3f83 s THR 508 Cb -0.13 -1.98 0.23 0.00 0.01 0.00 0.00 72.50 70.63 3f83 s THR 508 CO -0.09 0.41 1.31 -0.76 -0.69 0.00 0.00 174.62 174.80 3f83 s LEU 509 N -1.18 2.42 -0.16 4.42 1.43 -0.83 0.44 118.68 125.22 3f83 s LEU 509 Ca 0.13 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 3f83 s LEU 509 Cb -0.10 -2.17 -0.00 0.00 0.03 0.00 0.00 46.19 43.95 3f83 s LEU 509 CO 0.03 -3.07 -0.15 -0.83 0.23 0.00 0.00 176.35 172.55 3f83 s GLY 510 N -4.80 1.48 0.00 -3.19 0.00 -0.94 -4.51 107.32 95.36 3f83 s GLY 510 Ca 0.75 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 44.43 3f83 s GLY 510 CO 0.54 0.03 0.00 -1.14 0.00 0.00 0.00 173.10 172.53 3f83 n SER 511 N 4.05 0.00 -4.53 1.64 3.41 -1.26 -4.71 113.62 112.22 3f83 n SER 511 Ca -0.19 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 3f83 n SER 511 Cb 0.52 -0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 64.30 3f83 n SER 511 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3f83 s ASP 512 N -0.78 6.28 -1.49 4.04 -0.00 -1.26 -4.97 116.67 118.49 3f83 s ASP 512 Ca 0.00 -0.30 -0.09 0.00 -0.00 0.00 0.00 52.55 52.17 3f83 s ASP 512 Cb 0.00 -2.27 0.01 0.00 -0.00 0.00 0.00 42.92 40.66 3f83 s ASP 512 CO 0.00 -0.58 2.62 0.59 -0.00 0.00 0.00 175.17 177.80 3f83 n ASN 513 N 5.83 7.79 -4.40 0.27 5.03 -1.26 -4.18 115.26 124.33 3f83 n ASN 513 Ca -0.05 -2.83 -0.23 0.00 0.87 0.00 0.00 54.58 52.34 3f83 n ASN 513 Cb 0.48 -1.50 -0.11 0.00 -1.02 0.00 0.00 39.78 37.64 3f83 n ASN 513 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 3f83 s LYS 514 N 1.04 1.46 0.22 3.52 2.36 -1.26 -5.04 119.74 122.04 3f83 s LYS 514 Ca 0.60 -1.57 -0.19 0.00 -2.55 0.00 0.00 55.97 52.25 3f83 s LYS 514 Cb 0.17 -1.55 0.03 0.00 -1.05 0.00 0.00 37.83 35.43 3f83 s LYS 514 CO -0.07 0.31 0.59 1.14 1.55 0.00 0.00 175.35 178.87 3f83 s GLN 515 N -3.12 1.49 0.05 4.03 -2.07 -1.26 -1.96 119.66 116.82 3f83 s GLN 515 Ca 0.22 -0.84 0.05 0.00 -1.82 0.00 0.00 55.36 52.98 3f83 s GLN 515 Cb -0.05 0.56 -0.02 0.00 -1.09 0.00 0.00 33.01 32.40 3f83 s GLN 515 CO 0.10 -0.65 -0.15 0.54 -1.32 0.00 0.00 175.29 173.81 3f83 s VAL 516 N -3.87 1.20 -0.11 3.63 0.11 0.02 -4.90 120.40 116.48 3f83 s VAL 516 Ca 0.09 -1.12 0.00 0.00 -2.93 0.00 0.00 61.98 58.02 3f83 s VAL 516 Cb -0.02 -1.10 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 3f83 s VAL 516 CO -0.01 -0.03 -0.10 -0.70 -3.33 0.00 0.00 175.10 170.92 3f83 s GLU 517 N -1.33 1.76 -0.26 1.54 2.12 -1.26 -0.58 118.70 120.69 3f83 s GLU 517 Ca 0.02 -0.36 -0.06 0.00 0.36 0.00 0.00 54.97 54.93 3f83 s GLU 517 Cb -0.09 -1.69 -0.00 0.00 0.26 0.00 0.00 34.13 32.61 3f83 s GLU 517 CO 0.02 -0.20 0.04 0.15 -0.54 0.00 0.00 175.26 174.72 3f83 s LYS 518 N 1.46 3.28 -0.28 4.30 -0.14 0.16 -4.94 119.74 123.58 3f83 s LYS 518 Ca 0.01 -0.71 -0.11 0.00 -1.36 0.00 0.00 55.97 53.80 3f83 s LYS 518 Cb -0.13 -3.24 -0.05 0.00 -1.68 0.00 0.00 37.83 32.73 3f83 s LYS 518 CO -0.07 -0.32 0.19 -0.80 -0.76 0.00 0.00 175.35 173.60 3f83 s ASN 519 N 1.51 6.00 -0.20 2.83 0.01 -1.26 -0.31 114.94 123.52 3f83 s ASN 519 Ca 0.04 -0.05 -0.01 0.00 -0.71 0.00 0.00 52.86 52.13 3f83 s ASN 519 Cb -0.16 -2.12 0.01 0.00 0.41 0.00 0.00 41.25 39.39 3f83 s ASN 519 CO 0.01 -0.06 -0.12 -0.63 -1.51 0.00 0.00 177.10 174.78 3f83 s ILE 520 N 1.75 2.72 -0.17 0.60 1.01 0.33 -4.65 121.20 122.80 3f83 s ILE 520 Ca 0.07 -0.72 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 3f83 s ILE 520 Cb -0.16 -2.20 -0.00 0.00 0.01 0.00 0.00 42.46 40.11 3f83 s ILE 520 CO 0.11 0.48 1.05 -0.89 0.00 0.00 0.00 174.94 175.69 3f83 s THR 521 N 1.39 4.67 -0.16 2.92 2.01 0.34 -0.42 115.64 126.38 3f83 s THR 521 Ca 0.05 1.98 -0.04 0.00 0.31 0.00 0.00 61.69 63.99 3f83 s THR 521 Cb -0.14 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.07 3f83 s THR 521 CO -0.08 -0.09 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.04 3f83 s VAL 522 N 2.68 3.96 0.22 3.82 1.01 0.12 0.10 120.40 132.31 3f83 s VAL 522 Ca 0.47 -0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.19 3f83 s VAL 522 Cb -0.17 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 3f83 s VAL 522 CO 0.12 0.48 -0.11 0.42 0.00 0.00 0.00 175.10 176.01 3f83 s THR 523 N 0.47 1.66 -0.08 3.92 -4.23 0.89 -1.25 115.64 117.02 3f83 s THR 523 Ca -0.03 -2.18 -0.30 0.00 -1.18 0.00 0.00 61.69 58.01 3f83 s THR 523 Cb -0.14 -2.16 0.10 0.00 1.34 0.00 0.00 72.50 71.64 3f83 s THR 523 CO 0.03 -0.51 0.84 0.00 -0.54 0.00 0.00 174.62 174.44 3f83 s ALA 524 N -3.02 -1.84 -0.03 3.99 0.00 -0.87 -0.57 121.76 119.43 3f83 s ALA 524 Ca 0.24 1.36 0.01 0.00 0.00 0.00 0.00 51.96 53.57 3f83 s ALA 524 Cb 0.01 -0.22 0.02 0.00 0.00 0.00 0.00 23.12 22.93 3f83 s ALA 524 CO 0.08 -0.40 -0.03 -1.12 0.00 0.00 0.00 175.76 174.29 3f83 s SER 525 N -1.38 0.74 -0.28 0.00 0.01 -1.26 0.00 113.70 111.53 3f83 s SER 525 Ca -0.04 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.12 3f83 s SER 525 Cb -0.00 -0.34 0.05 0.00 0.21 0.00 0.00 66.02 65.94 3f83 s SER 525 CO 0.03 -0.05 -0.05 -0.69 0.41 0.00 0.00 173.24 172.89 3f83 s VAL 526 N 0.82 2.62 0.66 3.43 1.01 -0.33 -4.69 120.40 123.92 3f83 s VAL 526 Ca -0.10 -1.51 -0.15 0.00 0.00 0.00 0.00 61.98 60.22 3f83 s VAL 526 Cb -0.13 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.73 3f83 s VAL 526 CO -0.00 -0.08 1.12 -1.81 0.00 0.00 0.00 175.10 174.33 3f83 s ASP 527 N 1.19 5.01 0.78 3.32 1.01 -1.26 -0.28 116.67 126.44 3f83 s ASP 527 Ca -0.07 2.05 -0.12 0.00 0.71 0.00 0.00 52.55 55.12 3f83 s ASP 527 Cb -0.20 -2.56 0.07 0.00 1.01 0.00 0.00 42.92 41.24 3f83 s ASP 527 CO -0.03 -1.70 1.13 -2.84 0.21 0.00 0.00 175.17 171.94 3f83 s PRO 528 N -4.05 1.99 0.35 8.23 0.02 -1.26 -4.75 135.00 135.53 3f83 s PRO 528 Ca 0.68 1.41 0.09 0.00 0.02 0.00 0.00 61.00 63.20 3f83 s PRO 528 Cb -0.22 -1.85 0.64 0.00 0.02 0.00 0.00 34.50 33.10 3f83 s PRO 528 CO 0.42 -1.88 1.81 0.28 -0.33 0.00 0.00 177.00 177.30 3f83 h VAL 529 N -1.00 1.25 0.00 3.83 2.07 -2.00 -3.52 116.25 116.88 3f83 h VAL 529 Ca -0.45 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 65.88 3f83 h VAL 529 Cb 1.25 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 3f83 h VAL 529 CO 0.49 0.36 0.00 2.30 0.02 0.00 0.00 177.57 180.73