#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t3a s LYS 2 N 0.00 3.85 -0.18 0.54 -0.14 -1.26 -5.07 119.74 117.48 1t3a s LYS 2 Ca 0.00 0.25 -0.08 0.00 -1.36 0.00 0.00 55.97 54.77 1t3a s LYS 2 Cb 0.00 -3.24 -0.04 0.00 -1.68 0.00 0.00 37.83 32.86 1t3a s LYS 2 CO 0.00 0.65 0.09 0.42 -0.76 0.00 0.00 175.35 175.75 1t3a s ILE 3 N -0.85 5.08 -0.15 2.17 -1.09 -1.26 -4.60 121.20 120.50 1t3a s ILE 3 Ca 0.21 0.07 -0.13 0.00 -2.23 0.00 0.00 60.65 58.57 1t3a s ILE 3 Cb -0.15 -3.29 -0.05 0.00 -1.58 0.00 0.00 42.46 37.39 1t3a s ILE 3 CO 0.10 0.47 0.28 0.20 -1.23 0.00 0.00 174.94 174.76 1t3a s ASN 4 N 0.19 6.43 -0.26 3.58 0.01 0.91 -5.04 114.94 120.77 1t3a s ASN 4 Ca 0.06 0.51 -0.07 0.00 -0.71 0.00 0.00 52.86 52.66 1t3a s ASN 4 Cb -0.12 -2.17 -0.01 0.00 0.41 0.00 0.00 41.25 39.36 1t3a s ASN 4 CO -0.00 0.14 0.05 -0.44 -1.51 0.00 0.00 177.10 175.34 1t3a s SER 5 N 0.28 4.97 0.25 -1.22 0.01 -1.26 -4.68 113.70 112.06 1t3a s SER 5 Ca 0.16 -0.37 0.10 0.00 1.31 0.00 0.00 55.95 57.15 1t3a s SER 5 Cb -0.13 -1.88 -0.04 0.00 0.21 0.00 0.00 66.02 64.18 1t3a s SER 5 CO 0.04 -0.07 -0.07 -0.36 0.41 0.00 0.00 173.24 173.19 1t3a s PHE 6 N 1.56 2.59 -0.04 2.43 0.08 -1.26 -5.13 117.98 118.22 1t3a s PHE 6 Ca 0.05 -0.25 -0.02 0.00 0.12 0.00 0.00 56.93 56.84 1t3a s PHE 6 Cb -0.15 -1.17 -0.04 0.00 -0.57 0.00 0.00 43.02 41.09 1t3a s PHE 6 CO 0.02 0.62 0.09 -0.80 -0.10 0.00 0.00 175.22 175.05 1t3a s ASN 7 N -3.46 5.77 0.45 1.36 0.01 -1.26 -4.75 114.94 113.06 1t3a s ASN 7 Ca 0.30 0.21 0.15 0.00 -0.71 0.00 0.00 52.86 52.81 1t3a s ASN 7 Cb -0.07 -1.70 1.07 0.00 0.41 0.00 0.00 41.25 40.97 1t3a s ASN 7 CO 0.18 0.31 1.98 0.22 -1.51 0.00 0.00 177.10 178.28 1t3a h TYR 8 N 4.38 0.38 -0.14 2.20 3.20 -1.90 -1.08 116.97 124.03 1t3a h TYR 8 Ca -0.50 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.38 1t3a h TYR 8 Cb 1.19 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.34 1t3a h TYR 8 CO 0.66 0.18 0.00 0.27 -1.64 0.00 0.00 178.16 177.63 1t3a n ASN 9 N -4.46 0.83 -4.76 -2.11 0.23 -1.26 -4.85 115.26 98.87 1t3a n ASN 9 Ca 0.10 -1.87 -0.41 0.00 -0.53 0.00 0.00 54.58 51.86 1t3a n ASN 9 Cb 0.39 -0.09 -0.02 0.00 -2.08 0.00 0.00 39.78 37.99 1t3a n ASN 9 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 1t3a s ASP 10 N -1.16 6.61 0.67 0.53 1.01 -0.41 -4.93 116.67 118.98 1t3a s ASP 10 Ca 0.16 2.77 -0.16 0.00 0.71 0.00 0.00 52.55 56.03 1t3a s ASP 10 Cb 0.08 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.38 1t3a s ASP 10 CO 0.12 -0.70 1.18 -2.16 0.21 0.00 0.00 175.17 173.82 1t3a s PRO 11 N -1.11 2.58 0.25 8.23 0.04 -1.26 -4.95 135.00 138.78 1t3a s PRO 11 Ca 0.55 1.69 -0.30 0.00 0.04 0.00 0.00 61.00 62.99 1t3a s PRO 11 Cb -0.43 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.12 1t3a s PRO 11 CO 0.50 -1.48 1.49 0.08 0.04 0.00 0.00 177.00 177.63 1t3a s VAL 12 N -1.94 2.51 0.00 -0.36 1.01 -1.26 -4.87 120.40 115.48 1t3a s VAL 12 Ca 0.74 0.42 0.00 0.00 0.00 0.00 0.00 61.98 63.14 1t3a s VAL 12 Cb -0.27 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1t3a s VAL 12 CO 0.40 0.07 0.55 -0.46 0.00 0.00 0.00 175.10 175.65 1t3a n ASN 13 N 2.40 1.02 -1.30 3.32 0.23 -0.59 -4.96 115.26 115.38 1t3a n ASN 13 Ca 0.08 -1.24 -0.17 0.00 -0.53 0.00 0.00 54.58 52.71 1t3a n ASN 13 Cb 0.39 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.02 1t3a n ASN 13 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1t3a n ASP 14 N -0.12 -5.37 0.02 0.53 8.00 -0.58 -4.76 116.55 114.27 1t3a n ASP 14 Ca 0.00 0.42 0.00 0.00 0.71 0.00 0.00 54.79 55.92 1t3a n ASP 14 Cb 0.13 -4.36 0.00 0.00 -0.02 0.00 0.00 41.12 36.87 1t3a n ASP 14 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1t3a n ARG 15 N -2.08 0.00 -0.00 -1.24 1.74 -1.26 -4.91 116.66 108.91 1t3a n ARG 15 Ca -0.17 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.00 1t3a n ARG 15 Cb 0.61 -0.06 -0.11 0.00 -1.02 0.00 0.00 32.46 31.88 1t3a n ARG 15 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1t3a n THR 16 N -2.69 0.00 -3.79 0.55 -2.24 -1.26 -4.86 114.28 99.98 1t3a n THR 16 Ca 0.00 -0.16 -0.26 0.00 -2.27 0.00 0.00 64.05 61.36 1t3a n THR 16 Cb 0.00 0.75 -0.17 0.00 -2.10 0.00 0.00 70.33 68.82 1t3a n THR 16 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1t3a s ILE 17 N -2.88 0.61 0.09 2.28 1.01 -1.26 -0.46 121.20 120.59 1t3a s ILE 17 Ca 0.03 -0.32 -0.03 0.00 0.00 0.00 0.00 60.65 60.33 1t3a s ILE 17 Cb 0.13 -0.91 0.01 0.00 0.01 0.00 0.00 42.46 41.71 1t3a s ILE 17 CO 0.76 0.05 0.18 0.00 0.00 0.00 0.00 174.94 175.94 1t3a n LEU 18 N 5.04 0.00 -4.80 2.97 -0.00 -1.09 -1.53 117.00 117.59 1t3a n LEU 18 Ca -0.09 -0.57 -0.36 0.00 -0.00 0.00 0.00 56.01 54.99 1t3a n LEU 18 Cb 0.48 0.86 -0.07 0.00 -0.00 0.00 0.00 43.42 44.69 1t3a n LEU 18 CO 0.13 -0.19 -0.19 -0.31 -0.00 0.00 0.00 177.39 176.83 1t3a s TYR 19 N -7.36 3.49 -0.02 1.47 2.02 -0.72 0.50 117.35 116.72 1t3a s TYR 19 Ca 0.04 0.41 0.06 0.00 -0.37 0.00 0.00 57.07 57.21 1t3a s TYR 19 Cb -0.01 -2.00 -0.01 0.00 -0.40 0.00 0.00 41.96 39.54 1t3a s TYR 19 CO 0.03 0.55 -0.19 0.42 -1.57 0.00 0.00 175.55 174.78 1t3a s ILE 20 N -0.53 1.53 -0.33 2.71 1.01 0.11 -0.65 121.20 125.04 1t3a s ILE 20 Ca 0.12 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.97 1t3a s ILE 20 Cb -0.12 -1.27 0.09 0.00 0.01 0.00 0.00 42.46 41.17 1t3a s ILE 20 CO 0.02 0.43 0.03 -0.75 0.00 0.00 0.00 174.94 174.67 1t3a s LYS 21 N -0.39 1.82 0.83 2.79 2.20 -0.22 -0.13 119.74 126.64 1t3a s LYS 21 Ca 0.06 -1.69 -0.11 0.00 -0.36 0.00 0.00 55.97 53.87 1t3a s LYS 21 Cb -0.08 -3.19 0.09 0.00 -1.51 0.00 0.00 37.83 33.14 1t3a s LYS 21 CO -0.00 -0.85 1.10 -2.14 -0.36 0.00 0.00 175.35 173.10 1t3a s PRO 22 N 1.01 1.80 0.39 4.03 0.02 -1.26 -3.41 135.00 137.59 1t3a s PRO 22 Ca 0.05 1.10 -0.27 0.00 0.02 0.00 0.00 61.00 61.89 1t3a s PRO 22 Cb -0.20 -1.85 -0.10 0.00 0.02 0.00 0.00 34.50 32.38 1t3a s PRO 22 CO -0.06 -1.94 1.36 0.20 -0.33 0.00 0.00 177.00 176.23 1t3a s GLY 23 N -3.32 2.95 0.00 0.52 0.00 -1.26 -2.06 107.32 104.14 1t3a s GLY 23 Ca 0.62 1.35 0.00 0.00 0.00 0.00 0.00 44.72 46.69 1t3a s GLY 23 CO 0.57 1.98 0.00 0.61 0.00 0.00 0.00 173.10 176.25 1t3a n GLY 24 N 0.64 0.68 3.42 0.20 0.00 -1.26 -4.90 105.19 103.97 1t3a n GLY 24 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1t3a n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3a n GLN 26 N 0.43 1.63 -4.12 0.00 3.00 -1.26 -4.83 117.38 112.22 1t3a n GLN 26 Ca -0.14 -0.91 -0.08 0.00 -0.01 0.00 0.00 57.00 55.85 1t3a n GLN 26 Cb 0.55 -1.28 -0.10 0.00 0.00 0.00 0.00 30.24 29.41 1t3a n GLN 26 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 1t3a s GLU 27 N -1.81 0.74 0.18 -1.09 -1.05 -1.26 -5.15 118.70 109.26 1t3a s GLU 27 Ca 0.14 -1.31 -0.19 0.00 -0.15 0.00 0.00 54.97 53.46 1t3a s GLU 27 Cb 0.13 0.16 -0.08 0.00 -0.44 0.00 0.00 34.13 33.90 1t3a s GLU 27 CO 0.37 -0.14 0.68 -0.06 0.95 0.00 0.00 175.26 177.06 1t3a s PHE 28 N -3.92 3.70 -0.02 4.83 0.08 -1.26 -4.44 117.98 116.95 1t3a s PHE 28 Ca 0.13 1.35 0.06 0.00 0.12 0.00 0.00 56.93 58.59 1t3a s PHE 28 Cb 0.07 -2.58 -0.01 0.00 -0.57 0.00 0.00 43.02 39.93 1t3a s PHE 28 CO -0.06 0.41 -0.19 0.71 -0.10 0.00 0.00 175.22 175.99 1t3a s TYR 29 N -1.41 1.70 0.17 0.36 2.02 0.82 -4.82 117.35 116.19 1t3a s TYR 29 Ca 0.39 -0.33 -0.32 0.00 -0.37 0.00 0.00 57.07 56.45 1t3a s TYR 29 Cb -0.18 -1.10 -0.11 0.00 -0.40 0.00 0.00 41.96 40.18 1t3a s TYR 29 CO 0.21 -0.04 1.79 1.17 -1.57 0.00 0.00 175.55 177.11 1t3a n LYS 30 N 2.64 2.81 -4.32 -0.62 4.81 -1.26 -0.71 118.16 121.50 1t3a n LYS 30 Ca -0.15 1.02 -0.19 0.00 -0.87 0.00 0.00 58.31 58.12 1t3a n LYS 30 Cb 0.53 -2.89 -0.10 0.00 0.02 0.00 0.00 35.03 32.59 1t3a n LYS 30 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1t3a s SER 31 N 1.94 2.45 -0.06 3.14 0.01 0.18 -4.40 113.70 116.96 1t3a s SER 31 Ca 0.78 -0.95 0.01 0.00 1.31 0.00 0.00 55.95 57.10 1t3a s SER 31 Cb -0.49 -0.12 0.02 0.00 0.21 0.00 0.00 66.02 65.64 1t3a s SER 31 CO 0.34 -0.15 -0.07 -0.36 0.41 0.00 0.00 173.24 173.41 1t3a s PHE 32 N -2.67 1.10 -1.21 2.43 0.08 -0.37 -2.66 117.98 114.68 1t3a s PHE 32 Ca 0.18 -0.40 -0.16 0.00 0.12 0.00 0.00 56.93 56.67 1t3a s PHE 32 Cb -0.02 -0.90 0.12 0.00 -0.57 0.00 0.00 43.02 41.65 1t3a s PHE 32 CO 0.06 -0.28 1.52 1.21 -0.10 0.00 0.00 175.22 177.63 1t3a s ASN 33 N 1.02 6.91 0.46 1.36 2.47 0.39 0.01 114.94 127.55 1t3a s ASN 33 Ca -0.09 -2.60 0.15 0.00 0.42 0.00 0.00 52.86 50.74 1t3a s ASN 33 Cb -0.14 -2.48 1.10 0.00 -1.45 0.00 0.00 41.25 38.27 1t3a s ASN 33 CO -0.00 -0.99 2.02 -0.29 -3.72 0.00 0.00 177.10 174.12 1t3a h ILE 34 N 5.26 0.92 -2.33 -5.21 2.10 -1.77 -3.44 117.51 113.03 1t3a h ILE 34 Ca 0.34 -0.11 0.13 0.00 1.08 0.00 0.00 64.86 66.31 1t3a h ILE 34 Cb 0.89 0.58 -0.13 0.00 -1.09 0.00 0.00 36.82 37.08 1t3a h ILE 34 CO 1.33 0.06 0.48 0.00 -1.08 0.00 0.00 178.15 178.93 1t3a s MET 35 N -5.30 0.96 -0.31 2.19 0.23 -1.20 -0.06 119.30 115.81 1t3a s MET 35 Ca -0.07 -0.43 -0.28 0.00 -1.03 0.00 0.00 55.69 53.89 1t3a s MET 35 Cb 0.19 0.40 -0.12 0.00 -1.53 0.00 0.00 34.83 33.77 1t3a s MET 35 CO 0.73 -0.43 1.30 1.17 -2.03 0.00 0.00 175.02 175.77 1t3a n LYS 36 N -0.33 0.00 -1.09 3.16 3.00 -1.26 -0.05 118.16 121.60 1t3a n LYS 36 Ca -0.08 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.20 1t3a n LYS 36 Cb 0.62 -0.94 -0.01 0.00 0.00 0.00 0.00 35.03 34.69 1t3a n LYS 36 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1t3a n ASN 37 N 4.46 -5.07 -4.15 3.14 3.02 -1.26 -4.47 115.26 110.93 1t3a n ASN 37 Ca 0.33 0.08 -0.31 0.00 -0.03 0.00 0.00 54.58 54.65 1t3a n ASN 37 Cb -0.03 -2.84 -0.17 0.00 -0.61 0.00 0.00 39.78 36.14 1t3a n ASN 37 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1t3a s ILE 38 N -1.55 1.83 0.06 2.41 1.01 0.93 -1.23 121.20 124.66 1t3a s ILE 38 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 60.65 59.86 1t3a s ILE 38 Cb 0.00 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 1t3a s ILE 38 CO 0.00 0.51 -0.21 0.26 0.00 0.00 0.00 174.94 175.49 1t3a s TRP 39 N 0.64 1.87 -0.17 3.97 0.52 -0.40 -2.61 118.94 122.76 1t3a s TRP 39 Ca -0.13 -0.39 -0.02 0.00 0.02 0.00 0.00 56.10 55.58 1t3a s TRP 39 Cb -0.16 -1.09 -0.02 0.00 -1.15 0.00 0.00 33.47 31.05 1t3a s TRP 39 CO 0.03 0.12 -0.08 0.42 0.02 0.00 0.00 176.95 177.47 1t3a s ILE 40 N -0.88 3.39 -0.35 2.03 1.01 0.10 -0.37 121.20 126.14 1t3a s ILE 40 Ca 0.08 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.20 1t3a s ILE 40 Cb -0.09 -2.48 0.09 0.00 0.01 0.00 0.00 42.46 39.98 1t3a s ILE 40 CO 0.02 0.48 0.09 -0.63 0.00 0.00 0.00 174.94 174.91 1t3a s ILE 41 N 0.73 2.92 -1.12 2.92 1.01 0.45 -1.24 121.20 126.87 1t3a s ILE 41 Ca -0.03 -1.89 -0.17 0.00 0.00 0.00 0.00 60.65 58.55 1t3a s ILE 41 Cb -0.15 -2.92 -0.06 0.00 0.01 0.00 0.00 42.46 39.34 1t3a s ILE 41 CO 0.02 -0.46 2.11 -0.81 0.00 0.00 0.00 174.94 175.80 1t3a n PRO 42 N 4.52 2.22 -3.93 2.79 -0.04 -1.26 -3.54 135.00 135.76 1t3a n PRO 42 Ca -0.05 -2.18 -0.09 0.00 -0.04 0.00 0.00 63.50 61.14 1t3a n PRO 42 Cb 0.42 -3.06 -0.09 0.00 -0.04 0.00 0.00 33.50 30.73 1t3a n PRO 42 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1t3a s GLU 43 N 4.01 0.64 0.51 0.54 0.41 -1.26 -4.80 118.70 118.74 1t3a s GLU 43 Ca 0.52 -0.84 -0.22 0.00 -0.41 0.00 0.00 54.97 54.03 1t3a s GLU 43 Cb 0.14 0.25 -0.06 0.00 -1.78 0.00 0.00 34.13 32.68 1t3a s GLU 43 CO 0.01 -0.16 1.23 1.03 -0.49 0.00 0.00 175.26 176.88 1t3a s ARG 44 N -2.97 3.40 -0.67 1.61 1.81 -1.26 0.22 118.95 121.09 1t3a s ARG 44 Ca -0.02 1.93 -0.24 0.00 -1.72 0.00 0.00 55.73 55.68 1t3a s ARG 44 Cb 0.01 -2.26 0.05 0.00 -0.45 0.00 0.00 34.95 32.30 1t3a s ARG 44 CO -0.06 -0.89 1.07 1.21 -0.68 0.00 0.00 175.30 175.95 1t3a s ASN 45 N -1.28 6.21 0.00 0.23 3.84 -0.44 -4.74 114.94 118.75 1t3a s ASN 45 Ca 0.69 -0.67 0.27 0.00 0.21 0.00 0.00 52.86 53.35 1t3a s ASN 45 Cb -0.33 -2.47 0.79 0.00 -0.55 0.00 0.00 41.25 38.69 1t3a s ASN 45 CO 0.38 -1.54 1.59 1.33 -2.79 0.00 0.00 177.10 176.07 1t3a n VAL 46 N 6.14 0.00 -1.67 -5.21 0.24 -1.26 -4.53 118.33 112.04 1t3a n VAL 46 Ca -0.00 -0.24 -0.50 0.00 -2.04 0.00 0.00 64.34 61.56 1t3a n VAL 46 Cb 0.47 0.63 -0.05 0.00 -1.47 0.00 0.00 33.84 33.42 1t3a n VAL 46 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1t3a n ILE 47 N 0.03 0.28 -2.26 1.34 5.41 -1.26 -1.29 119.36 121.60 1t3a n ILE 47 Ca 0.16 -0.05 -0.10 0.00 1.00 0.00 0.00 62.75 63.76 1t3a n ILE 47 Cb 0.39 -1.48 -0.00 0.00 -0.71 0.00 0.00 39.64 37.83 1t3a n ILE 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1t3a n GLY 48 N 3.79 -0.00 3.23 7.39 0.00 -1.26 -5.03 105.19 113.31 1t3a n GLY 48 Ca 0.21 -0.46 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 1t3a n GLY 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t3a s THR 49 N -2.55 0.17 0.00 2.61 -4.23 -0.41 -5.16 115.64 106.07 1t3a s THR 49 Ca 0.03 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.62 1t3a s THR 49 Cb -0.01 -2.51 -0.03 0.00 1.34 0.00 0.00 72.50 71.30 1t3a s THR 49 CO 0.03 -0.03 -0.23 -0.89 -0.54 0.00 0.00 174.62 172.96 1t3a s THR 50 N -4.04 2.33 0.54 3.99 2.01 -1.26 -5.02 115.64 114.19 1t3a s THR 50 Ca 0.38 -1.15 0.45 0.00 0.31 0.00 0.00 61.69 61.68 1t3a s THR 50 Cb 0.07 -1.88 0.67 0.00 0.01 0.00 0.00 72.50 71.38 1t3a s THR 50 CO 0.12 0.48 1.64 -0.65 -0.69 0.00 0.00 174.62 175.52 1t3a h PRO 51 N 5.13 0.01 0.00 4.92 0.11 -2.02 0.90 132.00 141.05 1t3a h PRO 51 Ca -0.45 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1t3a h PRO 51 Cb 1.14 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1t3a h PRO 51 CO 0.46 0.01 -0.08 1.96 -0.21 0.00 0.00 178.00 180.14 1t3a h GLN 52 N 0.01 0.00 0.00 1.05 1.08 -1.97 -3.18 115.11 112.10 1t3a h GLN 52 Ca 0.83 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 58.02 1t3a h GLN 52 Cb 3.27 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 30.70 1t3a h GLN 52 CO -0.05 0.08 -0.04 -0.44 -0.95 0.00 0.00 178.83 177.44 1t3a h ASP 53 N 0.00 0.00 1.54 1.46 3.32 0.45 -2.17 116.42 121.02 1t3a h ASP 53 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1t3a h ASP 53 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1t3a h ASP 53 CO 0.01 0.04 -0.31 -0.26 -1.72 0.00 0.00 179.24 176.99 1t3a h PHE 54 N 0.00 0.00 -3.78 4.55 -1.00 -1.67 -3.45 116.94 111.59 1t3a h PHE 54 Ca -0.00 0.00 -0.50 0.00 2.81 0.00 0.00 57.97 60.28 1t3a h PHE 54 Cb 0.13 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.70 1t3a h PHE 54 CO 0.00 0.00 0.47 -1.01 -1.61 0.00 0.00 178.31 176.16 1t3a s HIS 55 N -3.22 3.61 0.16 -0.55 3.76 -0.82 -3.56 115.29 114.67 1t3a s HIS 55 Ca 0.06 1.71 -0.33 0.00 -0.15 0.00 0.00 55.06 56.34 1t3a s HIS 55 Cb 0.08 -3.26 -0.13 0.00 1.11 0.00 0.00 32.58 30.38 1t3a s HIS 55 CO 0.69 -0.48 1.63 -2.30 -0.85 0.00 0.00 174.74 173.43 1t3a n PRO 56 N 1.32 2.30 0.21 8.40 -0.02 -1.26 -4.90 135.00 141.05 1t3a n PRO 56 Ca -0.01 0.83 0.07 0.00 -2.02 0.00 0.00 63.50 62.38 1t3a n PRO 56 Cb 0.45 -2.62 0.45 0.00 -0.02 0.00 0.00 33.50 31.76 1t3a n PRO 56 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1t3a h PRO 57 N 6.32 0.00 -3.84 0.52 0.11 -1.94 -3.44 132.00 129.73 1t3a h PRO 57 Ca -0.45 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.53 1t3a h PRO 57 Cb 1.24 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.17 1t3a h PRO 57 CO 0.91 0.29 -0.56 -0.08 -0.21 0.00 0.00 178.00 178.35 1t3a s THR 58 N -3.85 0.13 -0.09 -1.15 -1.32 -1.26 -5.10 115.64 103.00 1t3a s THR 58 Ca -0.01 -1.09 -0.09 0.00 -1.21 0.00 0.00 61.69 59.28 1t3a s THR 58 Cb 0.12 -0.82 -0.03 0.00 -1.51 0.00 0.00 72.50 70.26 1t3a s THR 58 CO 0.66 -0.60 -0.18 -1.20 -2.21 0.00 0.00 174.62 171.09 1t3a n SER 59 N 0.89 1.00 0.26 8.08 7.64 -1.26 -4.11 113.62 126.11 1t3a n SER 59 Ca -0.20 0.17 0.08 0.00 1.01 0.00 0.00 58.87 59.93 1t3a n SER 59 Cb 0.58 -0.61 0.64 0.00 -1.01 0.00 0.00 64.21 63.81 1t3a n SER 59 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1t3a h LEU 60 N -0.51 0.00 -2.06 -3.43 4.07 -1.99 -2.28 115.31 109.12 1t3a h LEU 60 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1t3a h LEU 60 Cb 0.51 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.25 1t3a h LEU 60 CO 0.00 0.01 0.00 0.29 -1.08 0.00 0.00 178.44 177.66 1t3a n LYS 61 N -4.50 2.37 -1.67 1.13 5.02 -1.26 -4.70 118.16 114.54 1t3a n LYS 61 Ca -0.03 -2.04 -0.43 0.00 -2.02 0.00 0.00 58.31 53.79 1t3a n LYS 61 Cb 0.10 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 1t3a n LYS 61 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1t3a n ASN 62 N 1.30 4.03 0.00 4.39 5.15 -0.86 -2.15 115.26 127.12 1t3a n ASN 62 Ca 0.18 0.93 0.00 0.00 -0.60 0.00 0.00 54.58 55.09 1t3a n ASN 62 Cb 0.57 -1.51 0.00 0.00 -0.53 0.00 0.00 39.78 38.31 1t3a n ASN 62 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1t3a n GLY 63 N 4.44 0.59 0.10 8.20 0.00 0.14 -4.71 105.19 113.96 1t3a n GLY 63 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 1t3a n GLY 63 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1t3a h ASP 64 N 0.00 -0.11 0.00 1.61 3.32 -1.83 -3.42 116.42 115.99 1t3a h ASP 64 Ca 0.00 -0.35 -0.24 0.00 0.02 0.00 0.00 57.03 56.47 1t3a h ASP 64 Cb 0.00 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 1t3a h ASP 64 CO 0.00 0.52 -1.89 -1.54 -1.72 0.00 0.00 179.24 174.61 1t3a n SER 65 N -4.83 2.39 -3.96 6.45 3.41 -1.26 -4.86 113.62 110.96 1t3a n SER 65 Ca -0.06 -0.05 -0.08 0.00 -0.26 0.00 0.00 58.87 58.42 1t3a n SER 65 Cb 0.22 0.21 -0.09 0.00 -0.26 0.00 0.00 64.21 64.29 1t3a n SER 65 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1t3a s SER 66 N -5.12 0.27 -0.14 4.04 1.04 -1.26 -5.01 113.70 107.53 1t3a s SER 66 Ca -0.15 -0.74 -0.00 0.00 0.48 0.00 0.00 55.95 55.54 1t3a s SER 66 Cb 0.05 0.25 0.03 0.00 0.10 0.00 0.00 66.02 66.45 1t3a s SER 66 CO 0.43 -0.61 -0.07 -0.47 0.98 0.00 0.00 173.24 173.50 1t3a s TYR 67 N -3.46 1.62 0.06 5.02 5.04 -1.26 -0.68 117.35 123.69 1t3a s TYR 67 Ca 0.02 -0.91 0.03 0.00 -2.44 0.00 0.00 57.07 53.77 1t3a s TYR 67 Cb 0.04 -1.29 -0.04 0.00 0.35 0.00 0.00 41.96 41.02 1t3a s TYR 67 CO -0.09 -0.57 0.04 0.71 -1.34 0.00 0.00 175.55 174.30 1t3a s TYR 68 N 1.66 3.11 -0.31 4.97 2.02 -1.26 0.19 117.35 127.73 1t3a s TYR 68 Ca 0.03 0.06 -0.05 0.00 -0.37 0.00 0.00 57.07 56.74 1t3a s TYR 68 Cb -0.14 -1.62 0.19 0.00 -0.40 0.00 0.00 41.96 39.99 1t3a s TYR 68 CO -0.08 0.50 0.90 0.34 -1.57 0.00 0.00 175.55 175.63 1t3a s ASP 69 N -2.10 -0.80 0.49 2.29 -1.08 -1.26 -4.81 116.67 109.40 1t3a s ASP 69 Ca 0.25 -0.03 0.33 0.00 -0.52 0.00 0.00 52.55 52.59 1t3a s ASP 69 Cb -0.12 1.38 1.56 0.00 -1.46 0.00 0.00 42.92 44.28 1t3a s ASP 69 CO 0.17 -0.13 1.99 1.55 0.52 0.00 0.00 175.17 179.27 1t3a h PRO 70 N 7.12 0.00 0.00 4.34 0.13 -1.92 -2.59 132.00 139.08 1t3a h PRO 70 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1t3a h PRO 70 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1t3a h PRO 70 CO -0.02 0.00 -0.40 0.09 -0.23 0.00 0.00 178.00 177.45 1t3a n ASN 71 N -2.81 0.59 -4.73 1.44 5.03 -1.26 -4.88 115.26 108.64 1t3a n ASN 71 Ca -0.00 0.19 -0.42 0.00 0.87 0.00 0.00 54.58 55.22 1t3a n ASN 71 Cb 0.19 -0.10 -0.03 0.00 -1.02 0.00 0.00 39.78 38.83 1t3a n ASN 71 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1t3a s TYR 72 N -3.10 2.97 -0.91 3.10 5.04 -0.98 -3.00 117.35 120.46 1t3a s TYR 72 Ca 0.09 0.70 -0.06 0.00 -2.44 0.00 0.00 57.07 55.36 1t3a s TYR 72 Cb 0.15 -3.97 0.01 0.00 0.35 0.00 0.00 41.96 38.50 1t3a s TYR 72 CO 0.67 -3.44 0.77 1.28 -1.34 0.00 0.00 175.55 173.49 1t3a n LEU 73 N 3.26 -2.90 -0.13 6.97 4.77 -1.26 -4.86 117.00 122.84 1t3a n LEU 73 Ca 0.11 -0.35 -0.24 0.00 -0.03 0.00 0.00 56.01 55.51 1t3a n LEU 73 Cb 0.38 -2.18 -0.11 0.00 -2.33 0.00 0.00 43.42 39.18 1t3a n LEU 73 CO 0.62 0.42 -1.40 0.00 -1.33 0.00 0.00 177.39 175.71 1t3a n GLN 74 N -3.47 0.62 -1.80 3.23 1.13 -1.16 -4.61 117.38 111.32 1t3a n GLN 74 Ca 0.00 0.20 -0.31 0.00 -1.94 0.00 0.00 57.00 54.96 1t3a n GLN 74 Cb 0.54 -1.51 0.03 0.00 0.11 0.00 0.00 30.24 29.41 1t3a n GLN 74 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1t3a s SER 75 N -6.98 5.85 0.38 1.08 1.04 -1.26 -4.94 113.70 108.87 1t3a s SER 75 Ca -0.37 1.41 0.13 0.00 0.48 0.00 0.00 55.95 57.60 1t3a s SER 75 Cb 0.12 -2.37 0.75 0.00 0.10 0.00 0.00 66.02 64.62 1t3a s SER 75 CO 0.55 -1.11 1.85 0.44 0.98 0.00 0.00 173.24 175.95 1t3a h ASP 76 N -0.49 0.02 -0.26 7.02 5.19 -1.99 -2.23 116.42 123.69 1t3a h ASP 76 Ca -0.44 -0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 55.86 1t3a h ASP 76 Cb 1.21 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.70 1t3a h ASP 76 CO 0.61 0.36 -0.19 -0.08 -3.12 0.00 0.00 179.24 176.82 1t3a h GLU 77 N 0.02 0.71 -0.02 3.56 4.57 -1.99 -0.67 114.58 120.75 1t3a h GLU 77 Ca -0.00 -0.26 -0.14 0.00 -1.18 0.00 0.00 59.36 57.78 1t3a h GLU 77 Cb 0.61 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 1t3a h GLU 77 CO 0.04 0.85 -0.64 0.93 -1.18 0.00 0.00 179.01 179.01 1t3a h GLU 78 N 0.63 0.07 -0.13 1.92 5.08 -1.82 -1.91 114.58 118.42 1t3a h GLU 78 Ca 0.10 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.23 1t3a h GLU 78 Cb 0.67 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1t3a h GLU 78 CO 0.05 0.69 -0.64 0.87 -1.00 0.00 0.00 179.01 178.98 1t3a h LYS 79 N 0.05 0.48 -0.45 2.33 1.57 -1.06 -0.93 116.57 118.56 1t3a h LYS 79 Ca -0.01 -0.34 -0.13 0.00 -1.87 0.00 0.00 60.65 58.29 1t3a h LYS 79 Cb 1.15 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 1t3a h LYS 79 CO 0.09 0.96 -0.25 0.22 -0.57 0.00 0.00 179.45 179.90 1t3a h ASP 80 N 0.35 0.98 -0.17 0.86 3.58 -0.99 -0.78 116.42 120.25 1t3a h ASP 80 Ca -0.01 -0.38 -0.01 0.00 0.42 0.00 0.00 57.03 57.05 1t3a h ASP 80 Cb 1.19 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.96 1t3a h ASP 80 CO 0.11 1.16 0.07 -0.09 -2.88 0.00 0.00 179.24 177.62 1t3a h ARG 81 N 0.81 0.24 -0.46 0.28 2.43 -1.18 -0.27 114.38 116.23 1t3a h ARG 81 Ca 0.10 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1t3a h ARG 81 Cb 0.82 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 1t3a h ARG 81 CO 0.07 0.30 0.30 0.35 -1.51 0.00 0.00 179.97 179.48 1t3a h PHE 82 N 0.13 0.59 -0.82 2.20 3.57 -1.07 -0.32 116.94 121.21 1t3a h PHE 82 Ca 0.06 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.58 1t3a h PHE 82 Cb 0.14 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 1t3a h PHE 82 CO -0.02 0.38 0.54 1.25 -2.23 0.00 0.00 178.31 178.23 1t3a h LEU 83 N 0.63 0.93 -0.64 0.59 5.85 -0.96 -0.94 115.31 120.77 1t3a h LEU 83 Ca 0.17 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.76 1t3a h LEU 83 Cb -0.06 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1t3a h LEU 83 CO -0.04 0.67 -0.12 0.11 -0.34 0.00 0.00 178.44 178.73 1t3a h LYS 84 N 1.10 0.95 -0.24 1.25 1.57 -0.51 -0.75 116.57 119.95 1t3a h LYS 84 Ca 0.31 -0.34 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1t3a h LYS 84 Cb -0.11 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1t3a h LYS 84 CO -0.07 1.01 0.02 0.82 -0.57 0.00 0.00 179.45 180.65 1t3a h ILE 85 N 0.85 1.24 -0.63 1.86 2.04 -0.66 -0.15 117.51 122.07 1t3a h ILE 85 Ca 0.13 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 65.13 1t3a h ILE 85 Cb 0.66 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 38.04 1t3a h ILE 85 CO 0.05 0.26 0.25 0.58 0.00 0.00 0.00 178.15 179.29 1t3a h VAL 86 N 0.19 1.23 -0.61 1.67 2.07 -1.12 -1.14 116.25 118.55 1t3a h VAL 86 Ca 0.07 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1t3a h VAL 86 Cb 0.37 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 1t3a h VAL 86 CO 0.01 0.29 0.40 0.74 0.02 0.00 0.00 177.57 179.03 1t3a h THR 87 N 0.88 1.16 -0.46 2.57 2.02 -0.99 -0.11 112.91 117.98 1t3a h THR 87 Ca 0.21 -0.30 0.02 0.00 0.77 0.00 0.00 66.41 67.11 1t3a h THR 87 Cb 0.20 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 1t3a h THR 87 CO -0.02 0.16 0.28 0.50 0.37 0.00 0.00 175.52 176.81 1t3a h LYS 88 N 0.83 0.55 -0.78 6.66 3.64 -0.61 -0.89 116.57 125.97 1t3a h LYS 88 Ca 0.22 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.54 1t3a h LYS 88 Cb -0.09 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.57 1t3a h LYS 88 CO -0.05 0.36 0.37 0.82 -2.27 0.00 0.00 179.45 178.68 1t3a h ILE 89 N 0.57 1.25 -0.50 2.00 2.04 -0.59 -0.85 117.51 121.42 1t3a h ILE 89 Ca 0.18 -0.70 -0.08 0.00 1.00 0.00 0.00 64.86 65.26 1t3a h ILE 89 Cb -0.01 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 1t3a h ILE 89 CO -0.07 0.30 0.00 -0.26 0.00 0.00 0.00 178.15 178.12 1t3a h PHE 90 N 1.11 0.90 -0.10 1.37 -1.00 -0.63 -0.91 116.94 117.68 1t3a h PHE 90 Ca 0.27 -0.13 -0.08 0.00 2.81 0.00 0.00 57.97 60.83 1t3a h PHE 90 Cb 0.12 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.43 1t3a h PHE 90 CO 0.01 0.82 -0.32 -0.91 -1.61 0.00 0.00 178.31 176.31 1t3a h ASN 91 N 0.78 0.20 -0.17 2.17 2.35 -0.43 0.16 115.58 120.64 1t3a h ASN 91 Ca 0.15 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 1t3a h ASN 91 Cb 0.47 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.78 1t3a h ASN 91 CO 0.02 0.51 -0.12 -0.09 -1.65 0.00 0.00 177.43 176.11 1t3a h ARG 92 N 0.17 0.39 -0.73 0.81 2.43 -0.70 -1.47 114.38 115.27 1t3a h ARG 92 Ca 0.02 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 1t3a h ARG 92 Cb 0.65 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 1t3a h ARG 92 CO 0.05 0.72 0.42 0.82 -1.51 0.00 0.00 179.97 180.47 1t3a h ILE 93 N 0.05 1.22 0.00 1.20 2.04 -0.93 -1.59 117.51 119.50 1t3a h ILE 93 Ca 0.03 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1t3a h ILE 93 Cb 0.62 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1t3a h ILE 93 CO 0.03 0.23 0.00 -3.20 0.00 0.00 0.00 178.15 175.21 1t3a n ASN 94 N -4.49 0.00 -0.05 1.72 5.15 0.54 -2.91 115.26 115.22 1t3a n ASN 94 Ca 0.07 -0.84 0.12 0.00 -0.60 0.00 0.00 54.58 53.33 1t3a n ASN 94 Cb 0.07 0.00 0.33 0.00 -0.53 0.00 0.00 39.78 39.65 1t3a n ASN 94 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1t3a n ASN 95 N -0.97 0.53 -4.25 1.20 2.85 -0.57 -4.69 115.26 109.35 1t3a n ASN 95 Ca 0.18 -0.30 -0.31 0.00 -0.11 0.00 0.00 54.58 54.04 1t3a n ASN 95 Cb 0.08 0.14 -0.17 0.00 1.24 0.00 0.00 39.78 41.07 1t3a n ASN 95 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 1t3a s ASN 96 N -2.89 3.04 0.27 1.20 3.84 -1.14 -5.04 114.94 114.22 1t3a s ASN 96 Ca 0.15 -0.52 0.01 0.00 0.21 0.00 0.00 52.86 52.70 1t3a s ASN 96 Cb 0.18 -0.97 0.59 0.00 -0.55 0.00 0.00 41.25 40.50 1t3a s ASN 96 CO 0.64 0.22 1.76 -0.07 -2.79 0.00 0.00 177.10 176.86 1t3a h LEU 97 N 6.23 0.54 -0.74 3.21 3.38 -1.86 0.15 115.31 126.22 1t3a h LEU 97 Ca -0.29 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 1t3a h LEU 97 Cb 1.19 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1t3a h LEU 97 CO 0.47 0.20 0.30 0.28 0.09 0.00 0.00 178.44 179.78 1t3a h SER 98 N 0.61 1.02 -0.48 -0.43 0.02 -1.96 -0.49 113.55 111.84 1t3a h SER 98 Ca 0.49 -0.17 -0.05 0.00 -0.84 0.00 0.00 61.79 61.22 1t3a h SER 98 Cb 0.74 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1t3a h SER 98 CO -0.39 0.91 0.09 1.23 -1.14 0.00 0.00 176.83 177.53 1t3a h GLY 99 N 1.07 0.85 1.71 -3.77 0.00 -1.27 -2.10 103.07 99.55 1t3a h GLY 99 Ca 0.25 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 1t3a h GLY 99 CO -0.02 0.52 0.08 -1.33 0.00 0.00 0.00 176.54 175.78 1t3a h GLY 100 N 0.66 0.41 1.03 4.60 0.00 -0.64 -1.38 103.07 107.76 1t3a h GLY 100 Ca 0.15 -0.19 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 1t3a h GLY 100 CO 0.01 0.18 -0.17 -2.22 0.00 0.00 0.00 176.54 174.34 1t3a h ILE 101 N 0.38 1.28 -0.25 2.60 1.08 -0.75 0.11 117.51 121.96 1t3a h ILE 101 Ca 0.09 -1.31 0.00 0.00 -0.39 0.00 0.00 64.86 63.26 1t3a h ILE 101 Cb 0.13 1.24 -0.01 0.00 -3.07 0.00 0.00 36.82 35.11 1t3a h ILE 101 CO -0.01 0.44 0.16 0.25 -0.69 0.00 0.00 178.15 178.30 1t3a h LEU 102 N 0.67 0.27 -0.64 1.44 5.85 -0.67 0.27 115.31 122.50 1t3a h LEU 102 Ca 0.10 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 1t3a h LEU 102 Cb 0.73 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1t3a h LEU 102 CO 0.06 0.20 0.18 -0.07 -0.34 0.00 0.00 178.44 178.46 1t3a h LEU 103 N 0.33 0.95 -0.34 2.25 3.38 -1.19 -1.13 115.31 119.56 1t3a h LEU 103 Ca 0.09 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1t3a h LEU 103 Cb -0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1t3a h LEU 103 CO -0.03 0.92 0.22 -0.08 0.09 0.00 0.00 178.44 179.57 1t3a h GLU 104 N 0.94 0.44 -0.59 1.13 4.57 -0.60 -2.05 114.58 118.41 1t3a h GLU 104 Ca 0.20 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.36 1t3a h GLU 104 Cb 0.33 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.79 1t3a h GLU 104 CO -0.00 0.29 0.39 0.93 -1.18 0.00 0.00 179.01 179.44 1t3a h GLU 105 N 0.45 0.78 -0.59 1.92 4.39 -0.66 -2.43 114.58 118.45 1t3a h GLU 105 Ca 0.12 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.81 1t3a h GLU 105 Cb -0.05 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.39 1t3a h GLU 105 CO -0.03 0.52 0.39 -0.07 -1.16 0.00 0.00 179.01 178.66 1t3a h LEU 106 N 0.80 0.58 -1.07 1.33 3.38 -0.88 -1.78 115.31 117.67 1t3a h LEU 106 Ca 0.22 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1t3a h LEU 106 Cb -0.09 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1t3a h LEU 106 CO -0.05 0.40 0.00 0.77 0.09 0.00 0.00 178.44 179.65 1t3a h SER 107 N 0.68 0.00 -0.34 -0.43 4.64 -0.87 -3.00 113.55 114.23 1t3a h SER 107 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1t3a h SER 107 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1t3a h SER 107 CO -0.06 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.19 1t3a n LYS 108 N -2.93 2.37 -1.12 4.77 5.02 -0.72 -4.65 118.16 120.90 1t3a n LYS 108 Ca 0.02 -1.99 -0.22 0.00 -2.02 0.00 0.00 58.31 54.10 1t3a n LYS 108 Cb 0.33 -1.32 0.01 0.00 -0.02 0.00 0.00 35.03 34.03 1t3a n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1t3a n ALA 109 N 0.79 5.64 -1.67 7.82 0.00 -0.92 -4.83 120.51 127.34 1t3a n ALA 109 Ca 0.13 -2.25 -0.49 0.00 0.00 0.00 0.00 53.44 50.82 1t3a n ALA 109 Cb 0.44 -1.64 -0.05 0.00 0.00 0.00 0.00 19.45 18.20 1t3a n ALA 109 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1t3a n ASN 110 N 0.37 2.99 -4.78 0.00 4.13 -1.26 -4.68 115.26 112.04 1t3a n ASN 110 Ca 0.39 1.04 -0.41 0.00 1.68 0.00 0.00 54.58 57.27 1t3a n ASN 110 Cb 0.57 -1.33 0.00 0.00 -1.54 0.00 0.00 39.78 37.48 1t3a n ASN 110 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1t3a n PRO 111 N 5.09 2.69 -1.87 3.52 -0.02 -1.26 -4.92 135.00 138.24 1t3a n PRO 111 Ca 0.21 0.94 -0.39 0.00 -2.02 0.00 0.00 63.50 62.24 1t3a n PRO 111 Cb 0.26 -2.69 0.02 0.00 -0.02 0.00 0.00 33.50 31.07 1t3a n PRO 111 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1t3a s TYR 112 N -1.12 2.49 -1.34 6.00 5.04 -0.02 -4.88 117.35 123.52 1t3a s TYR 112 Ca 0.53 1.35 -0.11 0.00 -2.44 0.00 0.00 57.07 56.40 1t3a s TYR 112 Cb -0.47 -3.80 0.12 0.00 0.35 0.00 0.00 41.96 38.17 1t3a s TYR 112 CO 0.64 -2.68 1.97 1.28 -1.34 0.00 0.00 175.55 175.43 1t3a n LEU 113 N -0.46 6.65 0.00 6.97 4.77 -1.26 -4.82 117.00 128.85 1t3a n LEU 113 Ca 0.07 -4.47 0.00 0.00 -0.03 0.00 0.00 56.01 51.58 1t3a n LEU 113 Cb 0.44 -1.55 0.00 0.00 -2.33 0.00 0.00 43.42 39.98 1t3a n LEU 113 CO 0.55 1.25 0.00 0.61 -1.33 0.00 0.00 177.39 178.48 1t3a n GLY 114 N 3.30 0.82 0.00 -0.72 0.00 -1.21 -1.44 105.19 105.94 1t3a n GLY 114 Ca 0.44 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1t3a n GLY 114 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1t3a n ASN 115 N 0.00 0.00 0.31 1.61 0.23 -1.26 -4.89 115.26 111.26 1t3a n ASN 115 Ca 0.00 -0.90 0.18 0.00 -0.53 0.00 0.00 54.58 53.33 1t3a n ASN 115 Cb 0.00 0.00 1.02 0.00 -2.08 0.00 0.00 39.78 38.72 1t3a n ASN 115 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1t3a h ASP 116 N 0.00 0.00 -0.55 0.53 3.32 -1.98 -2.59 116.42 115.14 1t3a h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1t3a h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1t3a h ASP 116 CO 0.00 0.01 0.00 0.59 -1.72 0.00 0.00 179.24 178.12 1t3a n ASN 117 N -3.52 4.77 -4.26 6.45 5.03 -1.26 -4.97 115.26 117.51 1t3a n ASN 117 Ca -0.03 -2.63 -0.19 0.00 0.87 0.00 0.00 54.58 52.60 1t3a n ASN 117 Cb 0.09 -0.58 -0.11 0.00 -1.02 0.00 0.00 39.78 38.16 1t3a n ASN 117 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1t3a s THR 118 N -2.17 1.45 0.26 3.41 -4.23 -0.98 -5.12 115.64 108.26 1t3a s THR 118 Ca 0.49 -1.69 -0.31 0.00 -1.18 0.00 0.00 61.69 59.00 1t3a s THR 118 Cb 0.34 -1.54 -0.12 0.00 1.34 0.00 0.00 72.50 72.52 1t3a s THR 118 CO 0.19 -0.33 1.56 -2.65 -0.54 0.00 0.00 174.62 172.86 1t3a n PRO 119 N 0.64 2.50 0.09 3.99 -0.02 -1.26 -4.70 135.00 136.25 1t3a n PRO 119 Ca -0.16 0.89 0.05 0.00 -2.02 0.00 0.00 63.50 62.26 1t3a n PRO 119 Cb 0.56 -2.65 0.49 0.00 -0.02 0.00 0.00 33.50 31.88 1t3a n PRO 119 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1t3a h ASP 120 N 4.94 0.30 -0.26 2.55 5.19 -1.93 -2.99 116.42 124.22 1t3a h ASP 120 Ca -0.46 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1t3a h ASP 120 Cb 1.24 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.67 1t3a h ASP 120 CO 0.81 0.24 0.00 -0.46 -3.12 0.00 0.00 179.24 176.71 1t3a n ASN 121 N -4.47 3.08 -3.86 6.45 2.04 -1.25 -3.25 115.26 114.00 1t3a n ASN 121 Ca 0.01 -2.40 -0.11 0.00 -0.44 0.00 0.00 54.58 51.63 1t3a n ASN 121 Cb 0.09 -0.57 -0.09 0.00 -2.53 0.00 0.00 39.78 36.68 1t3a n ASN 121 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1t3a s GLN 122 N -1.78 0.58 -0.91 -3.83 -2.07 -1.13 -0.97 119.66 109.55 1t3a s GLN 122 Ca 0.24 -0.49 -0.17 0.00 -1.82 0.00 0.00 55.36 53.12 1t3a s GLN 122 Cb 0.18 0.24 0.17 0.00 -1.09 0.00 0.00 33.01 32.51 1t3a s GLN 122 CO 0.07 -0.15 1.02 -0.06 -1.32 0.00 0.00 175.29 174.85 1t3a s PHE 123 N -1.89 3.38 0.02 9.60 0.08 -1.26 -4.84 117.98 123.08 1t3a s PHE 123 Ca -0.11 -1.66 -0.30 0.00 0.12 0.00 0.00 56.93 54.98 1t3a s PHE 123 Cb -0.05 -4.12 -0.05 0.00 -0.57 0.00 0.00 43.02 38.23 1t3a s PHE 123 CO -0.00 -1.31 1.24 -1.58 -0.10 0.00 0.00 175.22 173.47 1t3a s HIS 124 N 1.70 3.28 -0.30 0.36 5.65 -0.52 -4.94 115.29 120.51 1t3a s HIS 124 Ca 0.28 1.19 -0.07 0.00 0.25 0.00 0.00 55.06 56.71 1t3a s HIS 124 Cb -0.07 -3.47 0.01 0.00 -1.18 0.00 0.00 32.58 27.88 1t3a s HIS 124 CO -0.09 -1.52 0.08 0.42 -0.65 0.00 0.00 174.74 172.99 1t3a s ILE 125 N 1.57 3.95 0.00 0.89 1.01 -1.26 -3.28 121.20 124.08 1t3a s ILE 125 Ca 0.59 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 60.50 1t3a s ILE 125 Cb -0.29 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.12 1t3a s ILE 125 CO 0.27 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.87 1t3a n GLY 126 N 4.86 4.42 0.22 6.18 0.00 -1.26 -4.97 105.19 114.65 1t3a n GLY 126 Ca -0.14 -1.78 0.15 0.00 0.00 0.00 0.00 46.02 44.25 1t3a n GLY 126 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1t3a h ASP 127 N 0.00 0.00 1.85 1.61 3.32 -1.98 0.15 116.42 121.37 1t3a h ASP 127 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1t3a h ASP 127 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1t3a h ASP 127 CO 0.00 0.00 -0.03 0.00 -1.72 0.00 0.00 179.24 177.49 1t3a h ALA 128 N 2.02 0.98 0.00 3.45 0.00 -1.93 -3.37 119.26 120.43 1t3a h ALA 128 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1t3a h ALA 128 Cb 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1t3a h ALA 128 CO 0.00 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.16 1t3a n SER 129 N -3.11 0.14 -4.01 0.00 3.41 -0.53 -1.01 113.62 108.51 1t3a n SER 129 Ca 0.03 -0.47 -0.09 0.00 -0.26 0.00 0.00 58.87 58.08 1t3a n SER 129 Cb 0.51 0.48 -0.11 0.00 -0.26 0.00 0.00 64.21 64.83 1t3a n SER 129 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t3a s ALA 130 N -0.48 0.27 0.09 7.33 0.00 -0.07 -4.11 121.76 124.78 1t3a s ALA 130 Ca 0.00 -0.73 0.06 0.00 0.00 0.00 0.00 51.96 51.30 1t3a s ALA 130 Cb 0.00 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 1t3a s ALA 130 CO 0.00 -0.17 -0.16 0.14 0.00 0.00 0.00 175.76 175.57 1t3a s VAL 131 N -1.86 1.31 0.42 0.00 -7.23 -0.65 -4.42 120.40 107.97 1t3a s VAL 131 Ca -0.11 -1.42 -0.23 0.00 -1.81 0.00 0.00 61.98 58.41 1t3a s VAL 131 Cb -0.07 -1.26 -0.09 0.00 0.56 0.00 0.00 36.38 35.52 1t3a s VAL 131 CO -0.02 -0.20 1.07 -1.61 -0.31 0.00 0.00 175.10 174.03 1t3a s GLU 132 N -1.88 4.04 0.11 4.82 2.02 -1.22 -0.82 118.70 125.77 1t3a s GLU 132 Ca 0.02 1.55 0.02 0.00 0.02 0.00 0.00 54.97 56.58 1t3a s GLU 132 Cb -0.09 -2.47 -0.04 0.00 0.10 0.00 0.00 34.13 31.63 1t3a s GLU 132 CO 0.03 -0.26 -0.08 0.96 0.02 0.00 0.00 175.26 175.94 1t3a s ILE 133 N -1.67 0.82 -0.02 -1.63 -4.36 -0.32 -1.06 121.20 112.96 1t3a s ILE 133 Ca 0.60 -1.93 0.02 0.00 -0.26 0.00 0.00 60.65 59.08 1t3a s ILE 133 Cb -0.23 -1.68 0.00 0.00 1.25 0.00 0.00 42.46 41.80 1t3a s ILE 133 CO 0.28 -0.82 -0.08 -0.75 0.24 0.00 0.00 174.94 173.81 1t3a s LYS 134 N -3.71 0.80 0.67 0.37 2.20 0.17 -1.79 119.74 118.46 1t3a s LYS 134 Ca 0.12 -0.27 -0.01 0.00 -0.36 0.00 0.00 55.97 55.45 1t3a s LYS 134 Cb 0.04 -0.77 0.09 0.00 -1.51 0.00 0.00 37.83 35.69 1t3a s LYS 134 CO -0.03 0.12 0.94 -0.06 -0.36 0.00 0.00 175.35 175.95 1t3a s PHE 135 N 0.11 2.07 0.27 4.03 0.08 -0.47 -1.76 117.98 122.31 1t3a s PHE 135 Ca -0.01 -0.13 0.37 0.00 0.12 0.00 0.00 56.93 57.28 1t3a s PHE 135 Cb -0.07 -2.96 1.77 0.00 -0.57 0.00 0.00 43.02 41.19 1t3a s PHE 135 CO 0.00 -1.45 2.11 0.66 -0.10 0.00 0.00 175.22 176.43 1t3a h SER 136 N -0.38 0.00 -0.52 1.36 4.64 -1.92 -2.11 113.55 114.61 1t3a h SER 136 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1t3a h SER 136 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1t3a h SER 136 CO 0.45 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.95 1t3a n ASN 137 N -2.98 2.95 0.00 4.97 6.94 -1.26 -4.93 115.26 120.94 1t3a n ASN 137 Ca -0.01 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 52.57 1t3a n ASN 137 Cb 0.19 -0.35 0.00 0.00 -2.36 0.00 0.00 39.78 37.26 1t3a n ASN 137 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1t3a n GLY 138 N 1.38 3.06 3.73 4.83 0.00 -0.79 -5.03 105.19 112.38 1t3a n GLY 138 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1t3a n GLY 138 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1t3a s SER 139 N -0.41 4.72 0.28 1.61 1.04 -1.26 -4.66 113.70 115.01 1t3a s SER 139 Ca 0.00 2.66 0.11 0.00 0.48 0.00 0.00 55.95 59.20 1t3a s SER 139 Cb 0.00 -2.62 -0.05 0.00 0.10 0.00 0.00 66.02 63.45 1t3a s SER 139 CO 0.00 -1.93 -0.09 -1.10 0.98 0.00 0.00 173.24 171.09 1t3a s GLN 140 N -3.29 2.00 0.00 4.02 -0.21 -1.26 -1.37 119.66 119.55 1t3a s GLN 140 Ca 0.81 -1.60 0.00 0.00 0.02 0.00 0.00 55.36 54.59 1t3a s GLN 140 Cb -0.38 -1.97 0.00 0.00 1.00 0.00 0.00 33.01 31.66 1t3a s GLN 140 CO 0.42 0.33 0.00 -3.47 -2.12 0.00 0.00 175.29 170.45 1t3a n ASP 141 N -0.77 0.00 -4.23 5.90 -0.08 -0.74 -5.00 116.55 111.63 1t3a n ASP 141 Ca -0.06 -0.15 -0.17 0.00 -1.51 0.00 0.00 54.79 52.90 1t3a n ASP 141 Cb 0.60 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.95 1t3a n ASP 141 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1t3a s ILE 142 N -2.87 1.26 0.04 5.18 -4.36 -1.26 -1.18 121.20 118.01 1t3a s ILE 142 Ca 0.00 -1.72 0.07 0.00 -0.26 0.00 0.00 60.65 58.74 1t3a s ILE 142 Cb 0.00 -1.52 -0.03 0.00 1.25 0.00 0.00 42.46 42.17 1t3a s ILE 142 CO 0.00 -0.46 -0.21 -0.22 0.24 0.00 0.00 174.94 174.29 1t3a s LEU 143 N -2.49 2.16 -0.75 0.37 2.96 0.00 -4.87 118.68 116.07 1t3a s LEU 143 Ca 0.09 -0.53 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 1t3a s LEU 143 Cb -0.04 -1.01 0.18 0.00 0.50 0.00 0.00 46.19 45.82 1t3a s LEU 143 CO 0.02 0.17 0.57 -0.76 -1.32 0.00 0.00 176.35 175.04 1t3a s LEU 144 N -1.17 5.04 0.58 -0.68 1.43 -1.26 -1.64 118.68 120.98 1t3a s LEU 144 Ca 0.08 -3.78 0.01 0.00 -1.03 0.00 0.00 54.13 49.41 1t3a s LEU 144 Cb -0.09 -1.72 0.05 0.00 0.03 0.00 0.00 46.19 44.46 1t3a s LEU 144 CO 0.02 -0.12 0.81 -2.16 0.23 0.00 0.00 176.35 175.13 1t3a s PRO 145 N -1.37 2.37 -0.14 1.29 0.04 -1.26 -4.99 135.00 130.95 1t3a s PRO 145 Ca 0.25 -0.88 0.04 0.00 0.04 0.00 0.00 61.00 60.45 1t3a s PRO 145 Cb -0.06 -2.47 -0.11 0.00 0.04 0.00 0.00 34.50 31.89 1t3a s PRO 145 CO -0.15 -0.85 -0.08 0.09 0.04 0.00 0.00 177.00 176.05 1t3a n ASN 146 N -2.42 2.58 -3.89 6.66 3.02 -0.37 -4.67 115.26 116.16 1t3a n ASN 146 Ca 0.10 -0.06 -0.15 0.00 -0.03 0.00 0.00 54.58 54.44 1t3a n ASN 146 Cb 0.60 0.09 -0.15 0.00 -0.61 0.00 0.00 39.78 39.71 1t3a n ASN 146 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1t3a s VAL 147 N -2.30 0.19 -0.11 2.41 1.01 -0.96 -0.79 120.40 119.84 1t3a s VAL 147 Ca -0.16 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1t3a s VAL 147 Cb 0.05 -0.19 0.02 0.00 0.00 0.00 0.00 36.38 36.26 1t3a s VAL 147 CO 0.40 0.08 -0.09 -0.63 0.00 0.00 0.00 175.10 174.85 1t3a s ILE 148 N 0.20 1.12 -0.24 2.22 1.01 -0.02 -1.27 121.20 124.23 1t3a s ILE 148 Ca -0.02 -0.37 -0.11 0.00 0.00 0.00 0.00 60.65 60.15 1t3a s ILE 148 Cb -0.04 -1.10 -0.05 0.00 0.01 0.00 0.00 42.46 41.28 1t3a s ILE 148 CO -0.01 0.38 0.18 -0.63 0.00 0.00 0.00 174.94 174.86 1t3a s ILE 149 N 1.48 5.34 0.39 2.92 -1.09 0.50 -0.80 121.20 129.95 1t3a s ILE 149 Ca 0.01 0.23 0.08 0.00 -2.23 0.00 0.00 60.65 58.74 1t3a s ILE 149 Cb -0.13 -3.52 -0.07 0.00 -1.58 0.00 0.00 42.46 37.15 1t3a s ILE 149 CO -0.06 0.33 -0.03 -0.04 -1.23 0.00 0.00 174.94 173.91 1t3a s MET 150 N 1.11 1.91 0.81 2.79 -1.94 0.12 -0.41 119.30 123.69 1t3a s MET 150 Ca 0.08 -2.05 -0.14 0.00 -1.71 0.00 0.00 55.69 51.88 1t3a s MET 150 Cb -0.14 -1.65 0.19 0.00 2.01 0.00 0.00 34.83 35.24 1t3a s MET 150 CO 0.05 0.01 1.02 0.41 -0.01 0.00 0.00 175.02 176.50 1t3a n GLY 151 N -0.91 -1.67 3.54 -0.03 0.00 0.13 -0.74 105.19 105.52 1t3a n GLY 151 Ca -0.05 -1.66 -0.40 0.00 0.00 0.00 0.00 46.02 43.92 1t3a n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3a n ALA 152 N -3.83 -0.53 -1.71 4.61 0.00 -1.21 -2.61 120.51 115.22 1t3a n ALA 152 Ca -0.17 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1t3a n ALA 152 Cb 0.46 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1t3a n ALA 152 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1t3a n GLU 153 N -0.11 0.91 -0.25 0.00 0.28 -1.26 -1.33 120.64 118.89 1t3a n GLU 153 Ca 0.11 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 57.17 1t3a n GLU 153 Cb 0.44 0.00 0.18 0.00 1.43 0.00 0.00 31.44 33.48 1t3a n GLU 153 CO 0.00 0.00 0.00 -1.35 -0.16 0.00 0.00 177.13 175.62 1t3a h PRO 154 N 0.00 0.28 -5.74 3.44 0.11 -1.86 -3.36 132.00 124.86 1t3a h PRO 154 Ca 0.00 -0.02 -0.62 0.00 0.11 0.00 0.00 66.00 65.47 1t3a h PRO 154 Cb 0.00 -0.06 -0.12 0.00 0.11 0.00 0.00 31.00 30.93 1t3a h PRO 154 CO 0.00 0.18 0.33 0.34 -0.21 0.00 0.00 178.00 178.65 1t3a s ASP 155 N -5.25 6.48 0.34 -2.05 2.15 -1.26 -4.30 116.67 112.78 1t3a s ASP 155 Ca -0.13 0.14 0.25 0.00 0.43 0.00 0.00 52.55 53.25 1t3a s ASP 155 Cb 0.21 -2.38 1.22 0.00 -0.30 0.00 0.00 42.92 41.67 1t3a s ASP 155 CO 0.76 -0.78 1.77 -0.07 -0.17 0.00 0.00 175.17 176.67 1t3a h LEU 156 N 9.84 0.00 -0.41 -1.34 4.07 -0.42 -2.49 115.31 124.56 1t3a h LEU 156 Ca -0.25 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.66 1t3a h LEU 156 Cb 1.09 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.83 1t3a h LEU 156 CO 0.92 0.00 -0.26 -0.26 -1.08 0.00 0.00 178.44 177.76 1t3a h PHE 157 N 0.00 0.00 -3.52 1.13 0.04 -1.92 -3.44 116.94 109.23 1t3a h PHE 157 Ca 0.00 0.00 -0.52 0.00 2.80 0.00 0.00 57.97 60.25 1t3a h PHE 157 Cb 0.18 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.34 1t3a h PHE 157 CO 0.00 0.26 0.51 -1.21 -0.60 0.00 0.00 178.31 177.27 1t3a s GLU 158 N -3.27 4.54 -0.09 1.51 0.41 -0.94 -4.91 118.70 115.96 1t3a s GLU 158 Ca 0.04 1.78 -0.03 0.00 -0.41 0.00 0.00 54.97 56.35 1t3a s GLU 158 Cb 0.08 -3.26 0.04 0.00 -1.78 0.00 0.00 34.13 29.20 1t3a s GLU 158 CO 0.68 -0.01 0.07 0.99 -0.49 0.00 0.00 175.26 176.51 1t3a s THR 159 N -0.11 -0.10 0.23 3.63 2.01 -1.26 -3.94 115.64 116.10 1t3a s THR 159 Ca 0.51 0.20 -0.04 0.00 0.31 0.00 0.00 61.69 62.66 1t3a s THR 159 Cb -0.31 -0.31 0.02 0.00 0.01 0.00 0.00 72.50 71.91 1t3a s THR 159 CO 0.35 -0.00 0.38 -0.46 -0.69 0.00 0.00 174.62 174.20 1t3a n ASN 160 N 5.29 -1.08 -3.85 3.53 0.23 -0.68 -5.00 115.26 113.70 1t3a n ASN 160 Ca -0.05 -2.08 -0.09 0.00 -0.53 0.00 0.00 54.58 51.84 1t3a n ASN 160 Cb 0.50 1.89 -0.04 0.00 -2.08 0.00 0.00 39.78 40.05 1t3a n ASN 160 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1t3a s SER 161 N -2.30 -0.22 -0.01 0.53 1.04 -1.26 -0.48 113.70 111.01 1t3a s SER 161 Ca 0.14 -0.65 -0.29 0.00 0.48 0.00 0.00 55.95 55.64 1t3a s SER 161 Cb -0.02 0.63 0.10 0.00 0.10 0.00 0.00 66.02 66.84 1t3a s SER 161 CO 0.10 -1.17 0.90 -0.94 0.98 0.00 0.00 173.24 173.11 1t3a s SER 162 N -2.93 -0.35 0.27 7.02 1.04 -0.75 -5.00 113.70 113.01 1t3a s SER 162 Ca 0.14 -0.02 0.07 0.00 0.48 0.00 0.00 55.95 56.62 1t3a s SER 162 Cb -0.02 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.44 1t3a s SER 162 CO 0.04 -0.62 0.22 0.20 0.98 0.00 0.00 173.24 174.06 1t3a s ASN 163 N -2.49 5.50 0.31 7.02 0.01 -1.26 -0.52 114.94 123.51 1t3a s ASN 163 Ca 0.05 -0.29 -0.29 0.00 -0.71 0.00 0.00 52.86 51.62 1t3a s ASN 163 Cb -0.01 -1.33 -0.11 0.00 0.41 0.00 0.00 41.25 40.21 1t3a s ASN 163 CO -0.08 -0.10 1.49 -0.63 -1.51 0.00 0.00 177.10 176.26 1t3a s ILE 164 N -2.17 2.27 -0.02 0.60 -1.09 -0.89 -4.95 121.20 114.95 1t3a s ILE 164 Ca 0.35 0.25 0.03 0.00 -2.23 0.00 0.00 60.65 59.04 1t3a s ILE 164 Cb -0.07 -3.16 -0.03 0.00 -1.58 0.00 0.00 42.46 37.62 1t3a s ILE 164 CO 0.25 0.05 -0.08 -0.55 -1.23 0.00 0.00 174.94 173.39 1t3a s SER 165 N 0.14 4.57 0.00 3.58 0.15 -1.26 -4.44 113.70 116.44 1t3a s SER 165 Ca 0.57 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 57.10 1t3a s SER 165 Cb -0.45 -1.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 1t3a s SER 165 CO 0.52 0.31 0.00 0.18 1.20 0.00 0.00 173.24 175.45 1t3a n LEU 166 N 1.80 0.00 -4.77 3.45 4.77 0.39 -4.92 117.00 117.72 1t3a n LEU 166 Ca -0.16 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.48 1t3a n LEU 166 Cb 0.53 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.64 1t3a n LEU 166 CO 0.29 -0.08 0.75 -0.13 -1.33 0.00 0.00 177.39 176.89 1t3a s ARG 167 N 1.47 3.03 -1.11 3.23 0.52 -1.26 -1.39 118.95 123.43 1t3a s ARG 167 Ca 0.00 1.46 -0.01 0.00 -0.52 0.00 0.00 55.73 56.66 1t3a s ARG 167 Cb 0.00 -1.98 0.00 0.00 0.52 0.00 0.00 34.95 33.50 1t3a s ARG 167 CO 0.00 -1.08 0.03 0.09 0.02 0.00 0.00 175.30 174.36 1t3a n ASN 168 N -2.00 -4.03 -2.54 0.23 3.02 -1.26 -2.20 115.26 106.47 1t3a n ASN 168 Ca 0.11 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 1t3a n ASN 168 Cb 0.52 -3.41 0.00 0.00 -0.61 0.00 0.00 39.78 36.27 1t3a n ASN 168 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1t3a n ASN 169 N -1.85 0.00 -4.81 6.41 4.13 -0.49 -4.92 115.26 113.73 1t3a n ASN 169 Ca -0.14 0.00 -0.37 0.00 1.68 0.00 0.00 54.58 55.74 1t3a n ASN 169 Cb 0.61 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.79 1t3a n ASN 169 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1t3a s TYR 170 N -2.13 3.73 -0.31 3.10 5.04 -0.93 -4.77 117.35 121.07 1t3a s TYR 170 Ca 0.00 1.35 0.03 0.00 -2.44 0.00 0.00 57.07 56.01 1t3a s TYR 170 Cb 0.00 -2.57 0.09 0.00 0.35 0.00 0.00 41.96 39.82 1t3a s TYR 170 CO 0.00 0.45 0.01 -1.64 -1.34 0.00 0.00 175.55 173.03 1t3a s MET 171 N -1.61 1.52 0.62 4.97 -1.94 -1.26 -0.46 119.30 121.14 1t3a s MET 171 Ca 0.37 -1.54 0.36 0.00 -1.71 0.00 0.00 55.69 53.17 1t3a s MET 171 Cb -0.18 -2.88 2.06 0.00 2.01 0.00 0.00 34.83 35.84 1t3a s MET 171 CO 0.21 -0.83 2.30 -1.00 -0.01 0.00 0.00 175.02 175.69 1t3a h PRO 172 N 7.76 0.00 0.00 2.03 0.13 -1.87 -0.37 132.00 139.67 1t3a h PRO 172 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1t3a h PRO 172 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1t3a h PRO 172 CO 0.49 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.13 1t3a n SER 173 N -3.55 0.00 -0.78 1.44 3.41 -1.26 -1.45 113.62 111.44 1t3a n SER 173 Ca -0.03 -0.61 0.09 0.00 -0.26 0.00 0.00 58.87 58.07 1t3a n SER 173 Cb 0.08 -0.06 0.10 0.00 -0.26 0.00 0.00 64.21 64.07 1t3a n SER 173 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1t3a n ASN 174 N -1.06 2.65 -0.97 4.04 5.03 -0.15 -1.89 115.26 122.92 1t3a n ASN 174 Ca 0.17 -1.80 0.04 0.00 0.87 0.00 0.00 54.58 53.86 1t3a n ASN 174 Cb 0.10 -0.04 0.07 0.00 -1.02 0.00 0.00 39.78 38.89 1t3a n ASN 174 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 1t3a n HIS 175 N 1.06 0.00 0.00 3.10 8.25 -0.80 -3.62 115.22 123.21 1t3a n HIS 175 Ca 0.12 -0.68 0.00 0.00 -0.26 0.00 0.00 57.72 56.90 1t3a n HIS 175 Cb 0.47 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.43 1t3a n HIS 175 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1t3a n GLY 176 N -0.15 2.87 0.22 -1.41 0.00 0.54 -4.83 105.19 102.43 1t3a n GLY 176 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 1t3a n GLY 176 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1t3a h PHE 177 N 0.00 0.95 -0.99 1.61 -1.00 -1.78 -3.36 116.94 112.37 1t3a h PHE 177 Ca 0.00 -0.38 0.11 0.00 2.81 0.00 0.00 57.97 60.51 1t3a h PHE 177 Cb 0.00 -0.16 -0.04 0.00 3.61 0.00 0.00 35.95 39.35 1t3a h PHE 177 CO 0.00 1.18 -0.25 0.41 -1.61 0.00 0.00 178.31 178.04 1t3a n GLY 178 N 0.49 -2.06 3.49 -1.45 0.00 -0.53 -0.84 105.19 104.29 1t3a n GLY 178 Ca -0.05 -1.39 -0.10 0.00 0.00 0.00 0.00 46.02 44.48 1t3a n GLY 178 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1t3a s SER 179 N -5.38 -0.48 0.13 1.61 1.04 -1.25 -4.36 113.70 105.01 1t3a s SER 179 Ca 0.00 -0.07 -0.32 0.00 0.48 0.00 0.00 55.95 56.03 1t3a s SER 179 Cb 0.00 0.56 -0.18 0.00 0.10 0.00 0.00 66.02 66.50 1t3a s SER 179 CO 0.00 -0.93 0.76 -0.38 0.98 0.00 0.00 173.24 173.67 1t3a n ILE 180 N -0.36 1.24 -3.72 -1.02 5.41 -0.18 -4.32 119.36 116.42 1t3a n ILE 180 Ca -0.14 -0.31 -0.36 0.00 1.00 0.00 0.00 62.75 62.95 1t3a n ILE 180 Cb 0.64 -0.07 -0.09 0.00 -0.71 0.00 0.00 39.64 39.41 1t3a n ILE 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1t3a s ALA 181 N -0.61 3.65 -0.18 -1.39 0.00 0.03 -2.10 121.76 121.16 1t3a s ALA 181 Ca 0.74 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.92 1t3a s ALA 181 Cb -1.04 -2.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 1t3a s ALA 181 CO 0.56 0.03 -0.10 0.42 0.00 0.00 0.00 175.76 176.68 1t3a s ILE 182 N 0.61 3.06 -0.15 0.00 1.09 0.32 -0.84 121.20 125.30 1t3a s ILE 182 Ca 0.08 -0.62 -0.03 0.00 -1.10 0.00 0.00 60.65 58.98 1t3a s ILE 182 Cb -0.12 -2.34 -0.02 0.00 -1.06 0.00 0.00 42.46 38.92 1t3a s ILE 182 CO 0.00 0.48 -0.06 -0.69 -0.10 0.00 0.00 174.94 174.57 1t3a s VAL 183 N 1.01 3.67 -0.39 2.92 1.01 0.02 -1.80 120.40 126.84 1t3a s VAL 183 Ca -0.01 -0.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1t3a s VAL 183 Cb -0.15 -2.60 0.01 0.00 0.00 0.00 0.00 36.38 33.64 1t3a s VAL 183 CO -0.01 0.50 0.30 -0.89 0.00 0.00 0.00 175.10 174.99 1t3a s THR 184 N 0.43 5.25 -0.18 3.92 2.01 0.37 0.15 115.64 127.59 1t3a s THR 184 Ca -0.05 -0.45 -0.00 0.00 0.31 0.00 0.00 61.69 61.49 1t3a s THR 184 Cb -0.15 -3.87 0.01 0.00 0.01 0.00 0.00 72.50 68.50 1t3a s THR 184 CO 0.03 -0.21 -0.15 0.12 -0.69 0.00 0.00 174.62 173.72 1t3a s PHE 185 N 1.75 2.82 -0.65 4.92 5.36 0.08 -1.69 117.98 130.57 1t3a s PHE 185 Ca 0.06 -1.27 0.05 0.00 -0.96 0.00 0.00 56.93 54.81 1t3a s PHE 185 Cb -0.18 -1.95 0.19 0.00 -0.34 0.00 0.00 43.02 40.73 1t3a s PHE 185 CO 0.11 -0.63 0.53 0.45 -1.46 0.00 0.00 175.22 174.21 1t3a n SER 186 N 4.46 2.69 0.27 6.13 2.88 -1.25 -3.35 113.62 125.45 1t3a n SER 186 Ca -0.20 -3.15 0.13 0.00 -1.33 0.00 0.00 58.87 54.32 1t3a n SER 186 Cb 0.51 -0.72 0.80 0.00 -0.75 0.00 0.00 64.21 64.05 1t3a n SER 186 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1t3a h PRO 187 N 5.15 0.00 -0.04 -1.46 0.13 -1.92 -3.07 132.00 130.78 1t3a h PRO 187 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1t3a h PRO 187 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1t3a h PRO 187 CO 0.69 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.85 1t3a n GLU 188 N -4.14 1.14 -4.02 0.86 1.02 -1.26 -4.68 120.64 109.56 1t3a n GLU 188 Ca -0.02 -0.21 -0.23 0.00 -0.02 0.00 0.00 57.16 56.68 1t3a n GLU 188 Cb 0.11 -1.22 -0.17 0.00 -0.02 0.00 0.00 31.44 30.15 1t3a n GLU 188 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1t3a s TYR 189 N -1.95 0.96 0.33 -0.32 2.02 -1.16 -0.33 117.35 116.90 1t3a s TYR 189 Ca 0.20 -0.35 0.04 0.00 -0.37 0.00 0.00 57.07 56.59 1t3a s TYR 189 Cb 0.10 -0.88 -0.01 0.00 -0.40 0.00 0.00 41.96 40.76 1t3a s TYR 189 CO 0.16 -0.32 0.13 0.45 -1.57 0.00 0.00 175.55 174.40 1t3a n SER 190 N 4.59 0.96 -4.47 2.29 2.88 -0.40 -4.94 113.62 114.53 1t3a n SER 190 Ca -0.16 -2.78 -0.24 0.00 -1.33 0.00 0.00 58.87 54.37 1t3a n SER 190 Cb 0.50 0.91 -0.10 0.00 -0.75 0.00 0.00 64.21 64.77 1t3a n SER 190 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1t3a s PHE 191 N -2.84 2.25 -0.00 0.66 -0.12 -1.26 0.14 117.98 116.81 1t3a s PHE 191 Ca 0.19 -0.37 -0.01 0.00 -0.05 0.00 0.00 56.93 56.69 1t3a s PHE 191 Cb 0.01 -1.02 -0.04 0.00 -0.63 0.00 0.00 43.02 41.34 1t3a s PHE 191 CO 0.13 0.67 0.09 0.50 -0.05 0.00 0.00 175.22 176.57 1t3a s ARG 192 N -3.53 3.11 0.04 1.99 3.52 -0.27 -1.21 118.95 122.59 1t3a s ARG 192 Ca 0.30 -0.47 -0.07 0.00 -0.13 0.00 0.00 55.73 55.36 1t3a s ARG 192 Cb -0.04 -2.88 -0.01 0.00 -1.56 0.00 0.00 34.95 30.46 1t3a s ARG 192 CO 0.14 0.65 0.13 -0.59 -0.81 0.00 0.00 175.30 174.82 1t3a s PHE 193 N -1.22 0.16 0.21 5.12 -0.12 0.34 -4.10 117.98 118.37 1t3a s PHE 193 Ca 0.24 -0.45 0.01 0.00 -0.05 0.00 0.00 56.93 56.68 1t3a s PHE 193 Cb -0.12 -0.11 -0.04 0.00 -0.63 0.00 0.00 43.02 42.12 1t3a s PHE 193 CO 0.15 -0.40 0.38 -0.80 -0.05 0.00 0.00 175.22 174.50 1t3a s ASN 194 N -2.18 6.35 0.00 1.98 0.02 -1.26 -0.21 114.94 119.64 1t3a s ASN 194 Ca -0.04 0.30 0.00 0.00 -1.02 0.00 0.00 52.86 52.10 1t3a s ASN 194 Cb -0.00 -1.97 0.00 0.00 0.02 0.00 0.00 41.25 39.30 1t3a s ASN 194 CO -0.05 -0.06 0.00 -0.90 0.02 0.00 0.00 177.10 176.11 1t3a n ASP 195 N -0.89 0.45 -0.27 -1.22 5.68 -0.42 -4.71 116.55 115.18 1t3a n ASP 195 Ca -0.06 -0.95 0.07 0.00 -0.50 0.00 0.00 54.79 53.35 1t3a n ASP 195 Cb 0.55 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.74 1t3a n ASP 195 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1t3a h ASN 196 N 0.00 0.18 -0.90 -1.12 7.08 -2.00 -2.42 115.58 116.40 1t3a h ASN 196 Ca 0.00 0.14 -0.50 0.00 -3.08 0.00 0.00 56.30 52.85 1t3a h ASN 196 Cb 0.00 0.15 -0.28 0.00 -2.08 0.00 0.00 38.32 36.10 1t3a h ASN 196 CO 0.00 0.02 0.56 -1.54 -2.08 0.00 0.00 177.43 174.39 1t3a n SER 197 N -5.08 4.30 -1.43 6.14 3.41 -1.26 -4.91 113.62 114.80 1t3a n SER 197 Ca 0.16 -3.67 -0.18 0.00 -0.26 0.00 0.00 58.87 54.92 1t3a n SER 197 Cb 0.49 -0.83 -0.07 0.00 -0.26 0.00 0.00 64.21 63.54 1t3a n SER 197 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1t3a n MET 198 N -1.10 -1.26 -2.56 4.33 2.81 -0.91 -4.98 117.12 113.46 1t3a n MET 198 Ca 0.56 1.11 -0.37 0.00 -1.81 0.00 0.00 57.70 57.20 1t3a n MET 198 Cb 1.39 -5.39 -0.04 0.00 -0.71 0.00 0.00 33.22 28.47 1t3a n MET 198 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1t3a s ASN 199 N -2.76 6.83 -0.12 7.83 0.02 -1.26 -4.78 114.94 120.70 1t3a s ASN 199 Ca 0.00 2.04 -0.04 0.00 -1.02 0.00 0.00 52.86 53.84 1t3a s ASN 199 Cb 0.00 -2.59 -0.03 0.00 0.02 0.00 0.00 41.25 38.65 1t3a s ASN 199 CO 0.00 -0.44 0.02 -1.61 0.02 0.00 0.00 177.10 175.09 1t3a s GLU 200 N -2.40 3.29 0.12 -0.60 2.02 -1.26 -1.30 118.70 118.57 1t3a s GLU 200 Ca 0.56 -0.39 0.05 0.00 0.02 0.00 0.00 54.97 55.22 1t3a s GLU 200 Cb -0.22 -2.92 -0.04 0.00 0.10 0.00 0.00 34.13 31.05 1t3a s GLU 200 CO 0.28 0.57 -0.13 -0.06 0.02 0.00 0.00 175.26 175.94 1t3a s PHE 201 N -0.50 1.33 -0.18 1.61 0.08 0.70 -1.06 117.98 119.96 1t3a s PHE 201 Ca 0.09 -0.58 -0.07 0.00 0.12 0.00 0.00 56.93 56.49 1t3a s PHE 201 Cb -0.12 -0.70 -0.04 0.00 -0.57 0.00 0.00 43.02 41.59 1t3a s PHE 201 CO 0.02 0.12 0.04 0.42 -0.10 0.00 0.00 175.22 175.72 1t3a s ILE 202 N -2.25 4.56 0.19 0.64 -1.09 -0.23 -0.50 121.20 122.52 1t3a s ILE 202 Ca 0.09 -0.12 -0.31 0.00 -2.23 0.00 0.00 60.65 58.08 1t3a s ILE 202 Cb -0.04 -3.05 -0.10 0.00 -1.58 0.00 0.00 42.46 37.69 1t3a s ILE 202 CO 0.02 0.46 1.54 -1.58 -1.23 0.00 0.00 174.94 174.15 1t3a s GLN 203 N 0.46 4.22 -0.05 2.79 2.00 -0.35 -4.88 119.66 123.85 1t3a s GLN 203 Ca 0.02 2.37 -0.30 0.00 -2.00 0.00 0.00 55.36 55.44 1t3a s GLN 203 Cb -0.13 -3.13 -0.04 0.00 0.80 0.00 0.00 33.01 30.51 1t3a s GLN 203 CO 0.01 -0.57 1.33 0.34 -0.50 0.00 0.00 175.29 175.91 1t3a s ASP 204 N 0.92 6.92 0.59 6.67 -1.08 -1.26 -4.67 116.67 124.75 1t3a s ASP 204 Ca 0.67 1.95 0.29 0.00 -0.52 0.00 0.00 52.55 54.94 1t3a s ASP 204 Cb -0.44 -2.55 1.76 0.00 -1.46 0.00 0.00 42.92 40.23 1t3a s ASP 204 CO 0.35 -0.70 2.20 1.55 0.52 0.00 0.00 175.17 179.09 1t3a h PRO 205 N 7.92 0.00 -0.32 4.34 0.13 -1.93 -0.94 132.00 141.21 1t3a h PRO 205 Ca -0.35 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.67 1t3a h PRO 205 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1t3a h PRO 205 CO 0.91 0.00 -0.28 0.00 -0.23 0.00 0.00 178.00 178.41 1t3a h ALA 206 N 1.91 0.93 -0.29 -0.56 0.00 -1.93 -0.54 119.26 118.78 1t3a h ALA 206 Ca 0.03 -0.38 -0.15 0.00 0.00 0.00 0.00 54.91 54.41 1t3a h ALA 206 Cb 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1t3a h ALA 206 CO -0.00 0.62 -0.44 1.25 0.00 0.00 0.00 179.25 180.68 1t3a h LEU 207 N 0.56 0.80 -0.52 0.00 5.85 -1.58 -1.33 115.31 119.08 1t3a h LEU 207 Ca 0.07 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 1t3a h LEU 207 Cb 0.76 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1t3a h LEU 207 CO 0.06 1.12 0.23 0.74 -0.34 0.00 0.00 178.44 180.26 1t3a h THR 208 N 0.60 1.21 -0.48 1.05 2.02 -1.10 -1.59 112.91 114.61 1t3a h THR 208 Ca 0.04 -0.61 -0.03 0.00 0.77 0.00 0.00 66.41 66.58 1t3a h THR 208 Cb 1.00 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 1t3a h THR 208 CO 0.09 0.24 0.18 0.25 0.37 0.00 0.00 175.52 176.65 1t3a h LEU 209 N 0.70 0.67 -1.21 2.58 5.85 -0.91 -2.54 115.31 120.45 1t3a h LEU 209 Ca 0.18 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1t3a h LEU 209 Cb 0.15 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1t3a h LEU 209 CO -0.02 0.67 0.54 0.24 -0.34 0.00 0.00 178.44 179.53 1t3a h MET 210 N 0.63 1.02 -0.23 1.25 2.86 -0.99 0.55 114.93 120.02 1t3a h MET 210 Ca 0.16 -0.06 0.04 0.00 -2.06 0.00 0.00 59.70 57.77 1t3a h MET 210 Cb 0.22 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 1t3a h MET 210 CO -0.01 0.68 0.02 1.25 1.06 0.00 0.00 176.91 179.90 1t3a h HIS 211 N 1.05 0.02 -0.11 -0.22 -0.00 -0.90 0.12 115.15 115.11 1t3a h HIS 211 Ca 0.31 0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.61 1t3a h HIS 211 Cb -0.03 0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.39 1t3a h HIS 211 CO -0.00 -0.02 -0.34 0.93 -0.00 0.00 0.00 177.93 178.51 1t3a h GLU 212 N 0.10 0.21 0.00 5.26 4.39 -0.98 -2.37 114.58 121.18 1t3a h GLU 212 Ca 0.11 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.62 1t3a h GLU 212 Cb 0.13 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1t3a h GLU 212 CO -0.17 0.53 -0.49 -0.07 -1.16 0.00 0.00 179.01 177.65 1t3a h LEU 213 N 0.19 0.00 -0.39 1.33 3.38 -0.03 -0.64 115.31 119.14 1t3a h LEU 213 Ca 0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 1t3a h LEU 213 Cb 0.69 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1t3a h LEU 213 CO 0.05 0.49 -0.27 0.40 0.09 0.00 0.00 178.44 179.20 1t3a h ILE 214 N 0.00 1.28 -0.56 1.22 2.04 -0.28 0.79 117.51 122.00 1t3a h ILE 214 Ca -0.00 -1.43 -0.03 0.00 1.00 0.00 0.00 64.86 64.39 1t3a h ILE 214 Cb 0.88 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 1t3a h ILE 214 CO 0.06 0.48 0.21 0.45 0.00 0.00 0.00 178.15 179.35 1t3a h HIS 215 N 0.69 0.86 -0.50 1.37 3.86 -1.20 -1.69 115.15 118.54 1t3a h HIS 215 Ca 0.08 -0.07 0.05 0.00 -1.16 0.00 0.00 60.37 59.26 1t3a h HIS 215 Cb 0.85 -0.26 -0.05 0.00 1.06 0.00 0.00 27.41 29.02 1t3a h HIS 215 CO 0.06 0.71 0.24 0.77 0.86 0.00 0.00 177.93 180.57 1t3a h SER 216 N 0.77 0.34 -0.38 2.45 0.02 -0.74 0.13 113.55 116.13 1t3a h SER 216 Ca 0.18 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1t3a h SER 216 Cb 0.22 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1t3a h SER 216 CO -0.01 0.23 0.25 0.25 -1.14 0.00 0.00 176.83 176.41 1t3a h LEU 217 N 0.48 0.43 -0.73 5.07 5.85 -0.51 0.17 115.31 126.07 1t3a h LEU 217 Ca 0.22 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.94 1t3a h LEU 217 Cb 0.15 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1t3a h LEU 217 CO -0.17 0.31 0.48 0.45 -0.34 0.00 0.00 178.44 179.17 1t3a h HIS 218 N 0.51 0.93 -0.15 1.25 3.86 -0.66 -1.00 115.15 119.89 1t3a h HIS 218 Ca 0.14 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 1t3a h HIS 218 Cb -0.05 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.10 1t3a h HIS 218 CO -0.05 0.59 0.06 0.78 0.86 0.00 0.00 177.93 180.17 1t3a h GLY 219 N 0.99 0.24 1.12 2.45 0.00 -0.28 -0.53 103.07 107.06 1t3a h GLY 219 Ca 0.27 -0.14 0.06 0.00 0.00 0.00 0.00 47.33 47.52 1t3a h GLY 219 CO -0.06 0.13 0.43 1.41 0.00 0.00 0.00 176.54 178.45 1t3a h LEU 220 N 0.08 0.57 -1.38 3.11 3.38 -0.34 0.28 115.31 121.01 1t3a h LEU 220 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1t3a h LEU 220 Cb 0.18 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1t3a h LEU 220 CO -0.00 0.37 0.00 -1.22 0.09 0.00 0.00 178.44 177.68 1t3a n TYR 221 N -4.48 0.53 -4.06 1.13 4.02 -0.41 -4.10 117.16 109.80 1t3a n TYR 221 Ca 0.09 -0.23 -0.33 0.00 -0.01 0.00 0.00 57.90 57.42 1t3a n TYR 221 Cb 0.23 -0.08 -0.00 0.00 -0.02 0.00 0.00 39.34 39.48 1t3a n TYR 221 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1t3a n GLY 222 N 0.78 -0.47 1.59 2.72 0.00 0.98 -4.50 105.19 106.28 1t3a n GLY 222 Ca 0.11 0.16 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 1t3a n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3a n ALA 223 N -4.51 4.57 1.11 4.61 0.00 -0.25 -0.34 120.51 125.71 1t3a n ALA 223 Ca 0.06 -2.83 0.12 0.00 0.00 0.00 0.00 53.44 50.79 1t3a n ALA 223 Cb 0.51 -1.03 0.17 0.00 0.00 0.00 0.00 19.45 19.09 1t3a n ALA 223 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1t3a n LYS 224 N -0.88 1.28 -0.13 0.00 5.02 -0.79 -4.47 118.16 118.19 1t3a n LYS 224 Ca 0.41 -0.97 -0.06 0.00 -2.02 0.00 0.00 58.31 55.67 1t3a n LYS 224 Cb 1.27 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.80 1t3a n LYS 224 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1t3a h GLY 225 N 4.85 -0.08 0.59 0.72 0.00 -1.71 -1.29 103.07 106.16 1t3a h GLY 225 Ca 0.00 0.35 -0.36 0.00 0.00 0.00 0.00 47.33 47.32 1t3a h GLY 225 CO 0.00 -0.21 -1.96 1.39 0.00 0.00 0.00 176.54 175.76 1t3a n ILE 226 N -5.41 1.78 0.23 2.60 2.08 -1.26 -3.90 119.36 115.48 1t3a n ILE 226 Ca 0.02 -0.63 0.07 0.00 0.56 0.00 0.00 62.75 62.76 1t3a n ILE 226 Cb 0.32 -1.75 0.55 0.00 -0.75 0.00 0.00 39.64 38.01 1t3a n ILE 226 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 1t3a h THR 227 N 0.03 1.03 -0.65 1.39 1.35 -1.77 -1.54 112.91 112.74 1t3a h THR 227 Ca -0.42 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 1t3a h THR 227 Cb 2.01 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.76 1t3a h THR 227 CO 0.08 0.17 0.00 0.35 -0.25 0.00 0.00 175.52 175.87 1t3a n THR 228 N -4.20 0.86 -0.10 6.82 -2.24 -0.49 -2.03 114.28 112.91 1t3a n THR 228 Ca -0.02 -0.88 -0.21 0.00 -2.27 0.00 0.00 64.05 60.67 1t3a n THR 228 Cb 0.24 0.46 -0.07 0.00 -2.10 0.00 0.00 70.33 68.87 1t3a n THR 228 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1t3a n LYS 229 N 1.43 0.44 -2.62 -0.78 4.81 -0.65 -4.96 118.16 115.84 1t3a n LYS 229 Ca 0.22 0.19 -0.40 0.00 -0.87 0.00 0.00 58.31 57.45 1t3a n LYS 229 Cb 0.56 -1.25 -0.05 0.00 0.02 0.00 0.00 35.03 34.31 1t3a n LYS 229 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1t3a s TYR 230 N -2.42 3.77 0.26 5.64 2.02 -0.76 -5.00 117.35 120.85 1t3a s TYR 230 Ca -0.29 1.78 0.02 0.00 -0.37 0.00 0.00 57.07 58.21 1t3a s TYR 230 Cb 0.10 -3.14 -0.04 0.00 -0.40 0.00 0.00 41.96 38.49 1t3a s TYR 230 CO 0.37 -0.08 0.17 0.95 -1.57 0.00 0.00 175.55 175.39 1t3a s THR 231 N -0.87 0.11 -0.08 -0.71 -4.23 -1.26 -1.85 115.64 106.75 1t3a s THR 231 Ca 0.44 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.99 1t3a s THR 231 Cb -0.28 -2.51 -0.02 0.00 1.34 0.00 0.00 72.50 71.03 1t3a s THR 231 CO 0.35 0.00 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.62 1t3a s ILE 232 N -3.83 2.65 -0.10 2.99 -1.09 0.34 -4.89 121.20 117.26 1t3a s ILE 232 Ca 0.39 -0.84 0.00 0.00 -2.23 0.00 0.00 60.65 57.97 1t3a s ILE 232 Cb 0.05 -2.04 -0.02 0.00 -1.58 0.00 0.00 42.46 38.87 1t3a s ILE 232 CO 0.17 0.56 -0.10 0.42 -1.23 0.00 0.00 174.94 174.76 1t3a s THR 233 N -0.13 3.39 0.00 2.92 -4.23 -1.26 -1.18 115.64 115.15 1t3a s THR 233 Ca -0.03 -0.57 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 1t3a s THR 233 Cb -0.14 -2.40 0.00 0.00 1.34 0.00 0.00 72.50 71.30 1t3a s THR 233 CO 0.04 0.55 0.00 0.61 -0.54 0.00 0.00 174.62 175.28 1t3a n GLY 245 N 2.91 0.82 3.32 3.99 0.00 -1.26 -5.28 105.19 109.70 1t3a n GLY 245 Ca -0.18 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 1t3a n GLY 245 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t3a s THR 246 N -2.10 2.69 0.63 2.61 2.01 -0.33 -5.06 115.64 116.09 1t3a s THR 246 Ca 0.00 -0.80 -0.18 0.00 0.31 0.00 0.00 61.69 61.02 1t3a s THR 246 Cb 0.00 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.40 1t3a s THR 246 CO 0.00 0.54 1.22 0.59 -0.69 0.00 0.00 174.62 176.28 1t3a n ASN 247 N 3.43 1.81 0.06 3.53 3.02 -1.26 -0.51 115.26 125.34 1t3a n ASN 247 Ca -0.18 0.83 0.11 0.00 -0.03 0.00 0.00 54.58 55.31 1t3a n ASN 247 Cb 0.53 -1.52 0.44 0.00 -0.61 0.00 0.00 39.78 38.62 1t3a n ASN 247 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1t3a n ILE 248 N -1.84 0.68 -0.36 2.41 -5.35 -0.77 -2.08 119.36 112.04 1t3a n ILE 248 Ca 0.15 0.10 0.01 0.00 -0.27 0.00 0.00 62.75 62.74 1t3a n ILE 248 Cb 0.48 -0.88 0.15 0.00 -1.74 0.00 0.00 39.64 37.64 1t3a n ILE 248 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1t3a h GLU 249 N 0.00 1.18 -0.11 6.28 4.57 -1.68 0.48 114.58 125.31 1t3a h GLU 249 Ca 0.00 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1t3a h GLU 249 Cb 0.42 -0.27 -0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1t3a h GLU 249 CO 0.00 0.78 0.05 0.93 -1.18 0.00 0.00 179.01 179.59 1t3a h GLU 250 N 1.22 0.15 -0.52 1.92 4.39 -1.72 -1.45 114.58 118.56 1t3a h GLU 250 Ca 0.40 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 60.03 1t3a h GLU 250 Cb 0.05 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 1t3a h GLU 250 CO -0.14 0.22 0.11 0.74 -1.16 0.00 0.00 179.01 178.77 1t3a h PHE 251 N 0.05 0.83 -0.16 4.33 -1.00 -1.50 -0.14 116.94 119.34 1t3a h PHE 251 Ca 0.04 -0.08 -0.11 0.00 2.81 0.00 0.00 57.97 60.63 1t3a h PHE 251 Cb 0.12 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 1t3a h PHE 251 CO -0.03 0.71 -0.36 -0.07 -1.61 0.00 0.00 178.31 176.94 1t3a h LEU 252 N 0.77 0.36 0.06 1.54 3.38 -0.74 -0.78 115.31 119.89 1t3a h LEU 252 Ca 0.17 -0.14 -0.25 0.00 0.09 0.00 0.00 57.88 57.74 1t3a h LEU 252 Cb 0.31 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1t3a h LEU 252 CO 0.00 0.70 -1.24 0.74 0.09 0.00 0.00 178.44 178.73 1t3a h THR 253 N 0.29 1.46 -0.02 0.22 2.02 -0.92 -3.33 112.91 112.63 1t3a h THR 253 Ca 0.03 -3.14 -0.18 0.00 0.77 0.00 0.00 66.41 63.90 1t3a h THR 253 Cb 0.78 2.81 0.01 0.00 -1.74 0.00 0.00 68.15 70.01 1t3a h THR 253 CO 0.06 0.87 -0.68 0.15 0.37 0.00 0.00 175.52 176.29 1t3a h PHE 254 N 0.03 0.73 -0.04 3.16 3.57 -0.98 0.12 116.94 123.53 1t3a h PHE 254 Ca -0.12 -0.38 0.00 0.00 3.53 0.00 0.00 57.97 61.00 1t3a h PHE 254 Cb 1.90 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 40.55 1t3a h PHE 254 CO 0.03 1.20 0.00 0.41 -2.23 0.00 0.00 178.31 177.71 1t3a n GLY 255 N 0.99 -0.23 7.00 2.40 0.00 -0.30 -0.73 105.19 114.32 1t3a n GLY 255 Ca -0.10 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1t3a n GLY 255 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t3a n GLY 256 N 0.00 1.49 0.32 -0.02 0.00 -1.26 -2.36 105.19 103.36 1t3a n GLY 256 Ca 0.00 -0.61 0.20 0.00 0.00 0.00 0.00 46.02 45.61 1t3a n GLY 256 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1t3a h THR 257 N 0.00 0.11 0.00 2.61 1.35 -1.95 -2.59 112.91 112.44 1t3a h THR 257 Ca 0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1t3a h THR 257 Cb 0.00 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 1t3a h THR 257 CO 0.00 0.01 0.00 0.44 -0.25 0.00 0.00 175.52 175.72 1t3a h ASP 258 N 0.00 0.00 1.38 5.36 5.19 -1.76 -1.95 116.42 124.63 1t3a h ASP 258 Ca -0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 1t3a h ASP 258 Cb 0.13 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.63 1t3a h ASP 258 CO 0.00 0.00 -0.10 -0.07 -3.12 0.00 0.00 179.24 175.95 1t3a h LEU 259 N 0.00 0.00 -1.50 1.55 3.38 -1.60 -2.96 115.31 114.18 1t3a h LEU 259 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1t3a h LEU 259 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1t3a h LEU 259 CO 0.00 0.10 -0.26 0.78 0.09 0.00 0.00 178.44 179.15 1t3a h ASN 260 N 0.00 0.00 -0.32 -0.43 2.35 -1.58 -2.82 115.58 112.79 1t3a h ASN 260 Ca -0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1t3a h ASN 260 Cb 0.81 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.16 1t3a h ASN 260 CO 0.01 0.26 0.11 0.40 -1.65 0.00 0.00 177.43 176.55 1t3a h ILE 261 N 0.00 1.17 -3.06 2.81 5.03 -1.68 -3.42 117.51 118.36 1t3a h ILE 261 Ca -0.00 -0.59 -0.57 0.00 -0.12 0.00 0.00 64.86 63.58 1t3a h ILE 261 Cb 0.50 0.76 -0.04 0.00 -3.03 0.00 0.00 36.82 35.01 1t3a h ILE 261 CO 0.03 0.22 0.77 -0.63 -0.68 0.00 0.00 178.15 177.86 1t3a s ILE 262 N -5.17 4.46 0.74 -0.67 1.09 -1.06 -5.03 121.20 115.56 1t3a s ILE 262 Ca -0.08 1.76 -0.11 0.00 -1.10 0.00 0.00 60.65 61.13 1t3a s ILE 262 Cb 0.16 -4.14 0.04 0.00 -1.06 0.00 0.00 42.46 37.46 1t3a s ILE 262 CO 0.76 -0.09 1.08 0.42 -0.10 0.00 0.00 174.94 177.00 1t3a s THR 263 N 2.85 3.61 0.09 2.92 -4.23 -1.26 -4.88 115.64 114.73 1t3a s THR 263 Ca 0.51 0.52 0.32 0.00 -1.18 0.00 0.00 61.69 61.87 1t3a s THR 263 Cb -0.20 -3.17 0.37 0.00 1.34 0.00 0.00 72.50 70.84 1t3a s THR 263 CO 0.15 -0.68 1.96 0.77 -0.54 0.00 0.00 174.62 176.27 1t3a h SER 264 N -0.94 0.00 -0.20 3.99 4.64 -1.96 -1.67 113.55 117.40 1t3a h SER 264 Ca -0.44 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.74 1t3a h SER 264 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1t3a h SER 264 CO 0.55 0.02 -0.41 0.00 -0.87 0.00 0.00 176.83 176.13 1t3a h ALA 265 N 1.98 0.32 -0.40 5.18 0.00 -1.99 -1.15 119.26 123.20 1t3a h ALA 265 Ca -0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 1t3a h ALA 265 Cb 0.55 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1t3a h ALA 265 CO 0.00 0.43 -0.09 1.96 0.00 0.00 0.00 179.25 181.55 1t3a h GLN 266 N 0.32 0.76 -0.84 0.00 4.20 -1.83 -1.84 115.11 115.88 1t3a h GLN 266 Ca 0.01 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.42 1t3a h GLN 266 Cb 1.01 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.71 1t3a h GLN 266 CO 0.09 0.90 0.50 0.77 -0.67 0.00 0.00 178.83 180.42 1t3a h SER 267 N 0.58 1.01 -0.65 1.46 0.02 -1.29 -1.13 113.55 113.55 1t3a h SER 267 Ca 0.10 -0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 1t3a h SER 267 Cb 0.61 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 1t3a h SER 267 CO 0.04 0.78 0.16 -1.13 -1.14 0.00 0.00 176.83 175.54 1t3a h ASN 268 N 1.16 0.98 -0.65 3.07 -0.73 -1.02 -2.08 115.58 116.33 1t3a h ASN 268 Ca 0.30 -0.23 0.02 0.00 1.87 0.00 0.00 56.30 58.26 1t3a h ASN 268 Cb -0.04 -0.26 -0.04 0.00 0.27 0.00 0.00 38.32 38.25 1t3a h ASN 268 CO -0.06 0.96 0.41 0.44 -0.37 0.00 0.00 177.43 178.81 1t3a h ASP 269 N 0.96 0.68 0.09 1.15 3.45 -0.44 0.73 116.42 123.04 1t3a h ASP 269 Ca 0.20 -0.01 0.01 0.00 0.43 0.00 0.00 57.03 57.67 1t3a h ASP 269 Cb 0.36 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.96 1t3a h ASP 269 CO 0.00 0.48 -0.16 0.40 -1.57 0.00 0.00 179.24 178.40 1t3a h ILE 270 N 0.82 0.64 0.68 0.35 1.08 -0.88 -0.75 117.51 119.44 1t3a h ILE 270 Ca 0.25 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.69 1t3a h ILE 270 Cb -0.02 0.64 -0.01 0.00 -3.07 0.00 0.00 36.82 34.35 1t3a h ILE 270 CO -0.09 0.00 -0.50 0.22 -0.69 0.00 0.00 178.15 177.10 1t3a h TYR 271 N -0.31 -1.35 -0.43 1.37 3.20 -0.97 -1.72 116.97 116.77 1t3a h TYR 271 Ca 0.02 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.97 1t3a h TYR 271 Cb 0.33 0.50 -0.07 0.00 1.54 0.00 0.00 36.73 39.03 1t3a h TYR 271 CO -0.17 -0.71 0.03 1.15 -1.64 0.00 0.00 178.16 176.83 1t3a h THR 272 N -1.13 0.71 -0.33 1.81 2.02 -0.83 -1.03 112.91 114.13 1t3a h THR 272 Ca -0.09 -0.05 -0.10 0.00 0.77 0.00 0.00 66.41 66.94 1t3a h THR 272 Cb 0.93 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 1t3a h THR 272 CO 0.04 0.03 -0.21 0.78 0.37 0.00 0.00 175.52 176.52 1t3a h ASN 273 N 0.15 0.63 -0.26 4.18 2.35 -1.13 -2.14 115.58 119.37 1t3a h ASN 273 Ca 0.21 -0.21 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 1t3a h ASN 273 Cb 0.29 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1t3a h ASN 273 CO -0.33 0.84 -0.52 0.25 -1.65 0.00 0.00 177.43 176.03 1t3a h LEU 274 N 0.55 0.90 -0.80 1.61 5.85 -0.97 -1.82 115.31 120.64 1t3a h LEU 274 Ca 0.08 -0.54 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 1t3a h LEU 274 Cb 0.67 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 1t3a h LEU 274 CO 0.05 1.28 0.49 0.25 -0.34 0.00 0.00 178.44 180.16 1t3a h LEU 275 N 0.56 0.97 -0.84 2.25 5.85 -1.10 -0.80 115.31 122.19 1t3a h LEU 275 Ca 0.01 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.57 1t3a h LEU 275 Cb 1.13 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.90 1t3a h LEU 275 CO 0.12 0.75 -0.18 0.00 -0.34 0.00 0.00 178.44 178.78 1t3a h ALA 276 N 1.26 1.01 -0.74 1.25 0.00 -1.34 -1.93 119.26 118.78 1t3a h ALA 276 Ca 0.29 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1t3a h ALA 276 Cb -0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1t3a h ALA 276 CO -0.05 0.59 0.25 -0.44 0.00 0.00 0.00 179.25 179.59 1t3a h ASP 277 N 0.60 1.06 0.65 0.00 3.32 -0.46 -2.32 116.42 119.28 1t3a h ASP 277 Ca 0.09 -0.20 -0.13 0.00 0.02 0.00 0.00 57.03 56.82 1t3a h ASP 277 Cb 0.64 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 1t3a h ASP 277 CO 0.05 0.98 -0.62 1.88 -1.72 0.00 0.00 179.24 179.80 1t3a h TYR 278 N 1.09 0.00 -0.49 4.55 -1.99 -0.93 -1.89 116.97 117.30 1t3a h TYR 278 Ca 0.24 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.84 1t3a h TYR 278 Cb 0.28 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.00 1t3a h TYR 278 CO 0.02 0.62 -0.21 0.87 -0.00 0.00 0.00 178.16 179.47 1t3a h LYS 279 N 0.00 1.01 -0.52 4.88 1.57 -1.12 0.33 116.57 122.72 1t3a h LYS 279 Ca -0.01 -0.43 -0.04 0.00 -1.87 0.00 0.00 60.65 58.31 1t3a h LYS 279 Cb 1.11 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.36 1t3a h LYS 279 CO 0.08 1.11 0.18 -0.22 -0.57 0.00 0.00 179.45 180.03 1t3a h LYS 280 N 0.87 0.80 -0.81 3.15 1.63 -1.30 -1.64 116.57 119.28 1t3a h LYS 280 Ca 0.11 -0.16 -0.04 0.00 -0.85 0.00 0.00 60.65 59.71 1t3a h LYS 280 Cb 0.79 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 32.26 1t3a h LYS 280 CO 0.07 0.73 0.36 0.82 -3.45 0.00 0.00 179.45 177.98 1t3a h ILE 281 N 0.71 1.26 -0.43 2.00 2.04 -1.05 0.27 117.51 122.31 1t3a h ILE 281 Ca 0.17 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 1t3a h ILE 281 Cb 0.25 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 1t3a h ILE 281 CO -0.01 0.32 0.19 0.00 0.00 0.00 0.00 178.15 178.66 1t3a h ALA 282 N 1.23 0.56 -0.23 1.87 0.00 -0.48 0.28 119.26 122.49 1t3a h ALA 282 Ca 0.28 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1t3a h ALA 282 Cb 0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1t3a h ALA 282 CO -0.03 0.14 -0.30 0.66 0.00 0.00 0.00 179.25 179.73 1t3a h SER 283 N 0.56 0.47 -0.36 0.00 4.64 -1.05 -1.49 113.55 116.31 1t3a h SER 283 Ca 0.15 -0.17 -0.06 0.00 -0.47 0.00 0.00 61.79 61.23 1t3a h SER 283 Cb 0.15 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1t3a h SER 283 CO -0.02 0.75 -0.03 0.50 -0.87 0.00 0.00 176.83 177.17 1t3a h LYS 284 N 0.40 0.66 -0.25 4.77 3.64 -0.49 -2.87 116.57 122.43 1t3a h LYS 284 Ca 0.05 -0.22 -0.04 0.00 -1.27 0.00 0.00 60.65 59.17 1t3a h LYS 284 Cb 0.72 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 1t3a h LYS 284 CO 0.06 0.78 -0.03 1.25 -2.27 0.00 0.00 179.45 179.24 1t3a h LEU 285 N 0.46 0.35 -2.32 5.20 5.85 -0.13 -2.07 115.31 122.65 1t3a h LEU 285 Ca 0.10 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1t3a h LEU 285 Cb 0.50 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 1t3a h LEU 285 CO 0.02 0.43 -0.03 0.28 -0.34 0.00 0.00 178.44 178.80 1t3a h SER 286 N 0.36 0.00 0.08 1.25 0.02 -1.05 -2.52 113.55 111.69 1t3a h SER 286 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1t3a h SER 286 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1t3a h SER 286 CO 0.01 0.03 -0.25 0.29 -1.14 0.00 0.00 176.83 175.78 1t3a n LYS 287 N -3.33 1.28 -1.70 3.45 5.02 -0.78 -4.93 118.16 117.17 1t3a n LYS 287 Ca -0.02 -0.91 -0.44 0.00 -2.02 0.00 0.00 58.31 54.93 1t3a n LYS 287 Cb 0.17 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.67 1t3a n LYS 287 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1t3a n VAL 288 N -0.06 0.92 -1.57 -0.18 0.31 -0.95 -3.77 118.33 113.02 1t3a n VAL 288 Ca 0.13 -0.23 -0.41 0.00 -0.01 0.00 0.00 64.34 63.82 1t3a n VAL 288 Cb 0.42 -1.67 0.02 0.00 -0.91 0.00 0.00 33.84 31.70 1t3a n VAL 288 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1t3a n GLN 289 N 2.17 1.10 -0.40 5.55 -0.06 -0.14 -4.92 117.38 120.69 1t3a n GLN 289 Ca 0.11 0.40 0.08 0.00 -2.00 0.00 0.00 57.00 55.59 1t3a n GLN 289 Cb 0.33 -1.93 0.27 0.00 -4.06 0.00 0.00 30.24 24.85 1t3a n GLN 289 CO 0.00 0.00 0.00 1.33 -0.20 0.00 0.00 177.06 178.19 1t3a n VAL 290 N -0.76 1.47 -0.05 1.69 0.24 -1.26 -4.55 118.33 115.11 1t3a n VAL 290 Ca 0.10 -1.20 -0.05 0.00 -2.04 0.00 0.00 64.34 61.15 1t3a n VAL 290 Cb 0.40 0.26 0.15 0.00 -1.47 0.00 0.00 33.84 33.18 1t3a n VAL 290 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1t3a h SER 291 N 3.07 0.67 -3.67 -1.34 0.87 -1.98 -3.40 113.55 107.76 1t3a h SER 291 Ca 0.00 -0.22 -0.68 0.00 -1.23 0.00 0.00 61.79 59.66 1t3a h SER 291 Cb 1.12 -0.18 -0.31 0.00 -0.44 0.00 0.00 62.40 62.59 1t3a h SER 291 CO 0.11 0.86 -0.70 0.21 -0.53 0.00 0.00 176.83 176.78 1t3a s ASN 292 N -6.75 4.79 0.28 6.23 3.84 -1.26 -4.99 114.94 117.07 1t3a s ASN 292 Ca -0.08 -1.08 0.11 0.00 0.21 0.00 0.00 52.86 52.01 1t3a s ASN 292 Cb 0.14 -1.73 0.36 0.00 -0.55 0.00 0.00 41.25 39.47 1t3a s ASN 292 CO 0.81 -0.22 1.62 1.55 -2.79 0.00 0.00 177.10 178.07 1t3a h PRO 293 N 8.05 0.00 0.00 0.43 0.13 -1.94 -3.15 132.00 135.52 1t3a h PRO 293 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1t3a h PRO 293 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1t3a h PRO 293 CO 0.56 0.61 0.00 1.28 -0.23 0.00 0.00 178.00 180.22 1t3a n LEU 294 N -3.79 0.00 -0.16 1.56 4.77 -1.26 -1.30 117.00 116.82 1t3a n LEU 294 Ca -0.01 0.28 0.13 0.00 -0.03 0.00 0.00 56.01 56.38 1t3a n LEU 294 Cb 0.61 -0.28 0.37 0.00 -2.33 0.00 0.00 43.42 41.79 1t3a n LEU 294 CO 0.42 -0.23 0.63 -0.11 -1.33 0.00 0.00 177.39 176.76 1t3a n LEU 295 N -1.28 0.79 -0.34 2.23 0.00 -1.19 -4.29 117.00 112.92 1t3a n LEU 295 Ca 0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 56.01 55.88 1t3a n LEU 295 Cb 0.04 -0.17 0.13 0.00 0.00 0.00 0.00 43.42 43.42 1t3a n LEU 295 CO 0.04 0.16 1.26 0.78 0.00 0.00 0.00 177.39 179.63 1t3a h ASN 296 N 0.76 1.09 -0.49 1.96 -0.26 -1.42 -2.78 115.58 114.45 1t3a h ASN 296 Ca 0.00 -0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 55.68 1t3a h ASN 296 Cb 0.49 -0.27 -0.03 0.00 -1.06 0.00 0.00 38.32 37.45 1t3a h ASN 296 CO 0.00 0.81 0.25 -0.65 -1.06 0.00 0.00 177.43 176.78 1t3a h PRO 297 N 1.28 0.73 -0.08 0.81 0.11 -1.82 -1.31 132.00 131.71 1t3a h PRO 297 Ca 0.34 -0.09 -0.11 0.00 0.11 0.00 0.00 66.00 66.26 1t3a h PRO 297 Cb -0.11 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 30.84 1t3a h PRO 297 CO -0.07 0.56 -0.43 -0.92 -0.21 0.00 0.00 178.00 176.93 1t3a h TYR 298 N 0.73 0.21 -0.43 0.65 5.03 -1.79 -2.19 116.97 119.17 1t3a h TYR 298 Ca 0.18 -0.06 -0.02 0.00 2.58 0.00 0.00 58.73 61.41 1t3a h TYR 298 Cb 0.08 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.29 1t3a h TYR 298 CO 0.01 0.58 0.18 0.87 -1.32 0.00 0.00 178.16 178.48 1t3a h LYS 299 N 0.15 0.64 -0.83 1.82 1.57 -1.07 -2.55 116.57 116.29 1t3a h LYS 299 Ca 0.01 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1t3a h LYS 299 Cb 0.83 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.99 1t3a h LYS 299 CO 0.06 0.59 0.55 -0.44 -0.57 0.00 0.00 179.45 179.64 1t3a h ASP 300 N 0.55 0.92 -0.19 0.86 3.32 -0.96 -0.91 116.42 120.01 1t3a h ASP 300 Ca 0.14 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.20 1t3a h ASP 300 Cb 0.18 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1t3a h ASP 300 CO -0.01 0.65 0.04 0.58 -1.72 0.00 0.00 179.24 178.77 1t3a h VAL 301 N 1.07 0.92 0.00 -1.35 2.07 -1.00 -1.25 116.25 116.71 1t3a h VAL 301 Ca 0.32 -0.04 -0.10 0.00 0.82 0.00 0.00 66.70 67.70 1t3a h VAL 301 Cb -0.04 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1t3a h VAL 301 CO -0.08 0.02 -0.47 -0.26 0.02 0.00 0.00 177.57 176.80 1t3a h PHE 302 N 0.12 0.00 -0.29 1.57 0.04 -1.16 -0.20 116.94 117.02 1t3a h PHE 302 Ca 0.09 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 1t3a h PHE 302 Cb 0.08 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1t3a h PHE 302 CO -0.14 0.47 0.13 1.49 -0.60 0.00 0.00 178.31 179.66 1t3a h GLU 303 N 0.00 0.43 -0.22 1.51 4.81 -0.63 -1.83 114.58 118.65 1t3a h GLU 303 Ca -0.00 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.00 1t3a h GLU 303 Cb 0.95 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.26 1t3a h GLU 303 CO 0.06 0.43 -0.45 0.00 -0.73 0.00 0.00 179.01 178.32 1t3a h ALA 304 N 0.98 0.35 -0.52 2.92 0.00 -1.07 -0.62 119.26 121.28 1t3a h ALA 304 Ca 0.10 -0.47 0.02 0.00 0.00 0.00 0.00 54.91 54.56 1t3a h ALA 304 Cb 0.15 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1t3a h ALA 304 CO -0.01 0.48 0.31 -0.22 0.00 0.00 0.00 179.25 179.82 1t3a h LYS 305 N 0.39 0.60 -0.52 0.00 3.64 -0.95 -2.97 116.57 116.77 1t3a h LYS 305 Ca 0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1t3a h LYS 305 Cb 1.05 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1t3a h LYS 305 CO 0.10 0.40 0.00 0.66 -2.27 0.00 0.00 179.45 178.34 1t3a n TYR 306 N -4.79 0.69 -3.41 1.91 4.02 -0.70 -4.96 117.16 109.92 1t3a n TYR 306 Ca 0.04 -0.35 -0.17 0.00 -0.01 0.00 0.00 57.90 57.41 1t3a n TYR 306 Cb 0.08 0.00 0.09 0.00 -0.02 0.00 0.00 39.34 39.48 1t3a n TYR 306 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1t3a n GLY 307 N 1.35 -0.38 3.90 2.72 0.00 -1.01 -4.78 105.19 106.98 1t3a n GLY 307 Ca 0.18 0.11 -0.28 0.00 0.00 0.00 0.00 46.02 46.03 1t3a n GLY 307 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t3a s LEU 308 N -6.29 4.22 0.05 0.99 1.43 -0.27 -1.55 118.68 117.27 1t3a s LEU 308 Ca 0.02 0.15 0.07 0.00 -1.03 0.00 0.00 54.13 53.33 1t3a s LEU 308 Cb -0.00 -2.82 -0.03 0.00 0.03 0.00 0.00 46.19 43.36 1t3a s LEU 308 CO 0.72 0.11 -0.15 -1.81 0.23 0.00 0.00 176.35 175.45 1t3a s ASP 309 N -2.87 4.04 -0.16 2.29 1.01 -0.35 -4.81 116.67 115.83 1t3a s ASP 309 Ca 0.34 -0.39 -0.01 0.00 0.71 0.00 0.00 52.55 53.20 1t3a s ASP 309 Cb -0.12 -0.72 -0.01 0.00 1.01 0.00 0.00 42.92 43.09 1t3a s ASP 309 CO 0.27 0.24 -0.12 -0.75 0.21 0.00 0.00 175.17 175.02 1t3a s LYS 310 N -1.63 3.31 0.86 8.23 2.20 -1.26 -1.13 119.74 130.31 1t3a s LYS 310 Ca 0.16 -0.70 -0.09 0.00 -0.36 0.00 0.00 55.97 54.99 1t3a s LYS 310 Cb -0.11 -2.72 0.17 0.00 -1.51 0.00 0.00 37.83 33.66 1t3a s LYS 310 CO 0.07 0.02 1.18 0.16 -0.36 0.00 0.00 175.35 176.42 1t3a s ASP 311 N 0.85 3.64 0.63 1.43 1.47 -0.42 -4.90 116.67 119.37 1t3a s ASP 311 Ca -0.04 -0.06 0.34 0.00 1.18 0.00 0.00 52.55 53.97 1t3a s ASP 311 Cb -0.15 -0.11 1.87 0.00 -0.34 0.00 0.00 42.92 44.18 1t3a s ASP 311 CO 0.00 -2.36 2.12 0.00 0.68 0.00 0.00 175.17 175.61 1t3a h ALA 312 N -1.14 1.45 -0.23 2.11 0.00 -2.00 0.60 119.26 120.04 1t3a h ALA 312 Ca -0.40 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1t3a h ALA 312 Cb 1.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1t3a h ALA 312 CO 0.38 -0.23 0.00 0.43 0.00 0.00 0.00 179.25 179.83 1t3a n SER 313 N -3.33 2.59 0.00 0.00 7.64 -1.26 -4.93 113.62 114.32 1t3a n SER 313 Ca -0.01 -1.86 0.00 0.00 1.01 0.00 0.00 58.87 58.02 1t3a n SER 313 Cb 0.28 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1t3a n SER 313 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t3a n GLY 314 N 1.32 0.57 3.75 0.23 0.00 0.20 -5.03 105.19 106.23 1t3a n GLY 314 Ca 0.17 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1t3a n GLY 314 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t3a s ILE 315 N -2.00 5.07 0.19 -0.61 -1.09 -1.26 -4.81 121.20 116.69 1t3a s ILE 315 Ca 0.00 1.06 -0.11 0.00 -2.23 0.00 0.00 60.65 59.37 1t3a s ILE 315 Cb 0.00 -3.85 -0.07 0.00 -1.58 0.00 0.00 42.46 36.96 1t3a s ILE 315 CO 0.00 0.39 0.54 -0.31 -1.23 0.00 0.00 174.94 174.32 1t3a s TYR 316 N 0.13 3.50 0.05 3.97 2.02 -1.26 -1.30 117.35 124.46 1t3a s TYR 316 Ca 0.28 0.93 -0.07 0.00 -0.37 0.00 0.00 57.07 57.84 1t3a s TYR 316 Cb -0.16 -2.29 -0.01 0.00 -0.40 0.00 0.00 41.96 39.10 1t3a s TYR 316 CO 0.13 0.34 0.13 -1.54 -1.57 0.00 0.00 175.55 173.05 1t3a s SER 317 N -2.10 0.15 -0.00 2.29 1.04 -0.28 -4.33 113.70 110.47 1t3a s SER 317 Ca 0.43 -0.54 -0.30 0.00 0.48 0.00 0.00 55.95 56.02 1t3a s SER 317 Cb -0.13 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 1t3a s SER 317 CO 0.20 -0.57 1.07 -0.69 0.98 0.00 0.00 173.24 174.24 1t3a s VAL 318 N -2.92 4.55 -0.36 5.02 1.01 -1.26 -1.21 120.40 125.23 1t3a s VAL 318 Ca -0.02 1.83 -0.19 0.00 0.00 0.00 0.00 61.98 63.60 1t3a s VAL 318 Cb 0.01 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1t3a s VAL 318 CO -0.06 0.11 0.56 0.21 0.00 0.00 0.00 175.10 175.92 1t3a s ASN 319 N 1.09 6.35 0.32 3.32 3.84 -0.59 -4.89 114.94 124.38 1t3a s ASN 319 Ca 0.54 -0.01 0.04 0.00 0.21 0.00 0.00 52.86 53.65 1t3a s ASN 319 Cb -0.24 -2.29 0.67 0.00 -0.55 0.00 0.00 41.25 38.84 1t3a s ASN 319 CO 0.26 -0.54 1.88 0.40 -2.79 0.00 0.00 177.10 176.31 1t3a h ILE 320 N 5.66 0.93 0.12 -5.21 1.08 -1.94 0.94 117.51 119.09 1t3a h ILE 320 Ca -0.27 -0.30 -0.01 0.00 -0.39 0.00 0.00 64.86 63.90 1t3a h ILE 320 Cb 1.12 -0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.86 1t3a h ILE 320 CO 0.80 0.16 -0.06 0.78 -0.69 0.00 0.00 178.15 179.14 1t3a h ASN 321 N 0.87 -0.14 -0.88 1.72 2.35 -1.95 -0.29 115.58 117.25 1t3a h ASN 321 Ca 0.44 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 1t3a h ASN 321 Cb 0.49 0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.85 1t3a h ASN 321 CO -0.20 -0.00 0.56 0.11 -1.65 0.00 0.00 177.43 176.24 1t3a h LYS 322 N -0.27 1.18 -0.55 0.81 1.57 -1.71 -1.97 116.57 115.64 1t3a h LYS 322 Ca -0.02 -0.09 0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1t3a h LYS 322 Cb 0.22 -0.26 -0.04 0.00 0.08 0.00 0.00 32.23 32.23 1t3a h LYS 322 CO 0.03 0.81 0.30 0.35 -0.57 0.00 0.00 179.45 180.37 1t3a h PHE 323 N 1.21 0.56 -0.93 -1.35 3.57 -0.51 -0.32 116.94 119.16 1t3a h PHE 323 Ca 0.32 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.85 1t3a h PHE 323 Cb -0.09 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.43 1t3a h PHE 323 CO -0.00 0.29 0.62 -0.91 -2.23 0.00 0.00 178.31 176.07 1t3a h ASN 324 N 0.58 1.06 -0.65 0.41 2.35 -0.43 0.13 115.58 119.04 1t3a h ASN 324 Ca 0.23 -0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.89 1t3a h ASN 324 Cb 0.10 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 1t3a h ASN 324 CO -0.14 0.77 0.16 0.44 -1.65 0.00 0.00 177.43 177.01 1t3a h ASP 325 N 1.26 0.99 -0.26 5.81 3.32 -0.65 -0.37 116.42 126.51 1t3a h ASP 325 Ca 0.34 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 1t3a h ASP 325 Cb -0.15 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.13 1t3a h ASP 325 CO -0.07 0.97 0.08 0.40 -1.72 0.00 0.00 179.24 178.89 1t3a h ILE 326 N 0.97 1.20 -0.51 0.35 2.04 -0.41 0.79 117.51 121.94 1t3a h ILE 326 Ca 0.20 -0.63 0.03 0.00 1.00 0.00 0.00 64.86 65.46 1t3a h ILE 326 Cb 0.36 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 1t3a h ILE 326 CO 0.00 0.21 0.29 0.15 0.00 0.00 0.00 178.15 178.80 1t3a h PHE 327 N 0.26 0.54 -0.56 1.37 3.57 -0.57 -0.24 116.94 121.31 1t3a h PHE 327 Ca 0.09 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.62 1t3a h PHE 327 Cb 0.24 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 1t3a h PHE 327 CO 0.00 0.30 0.35 -0.22 -2.23 0.00 0.00 178.31 176.51 1t3a h LYS 328 N 0.57 0.69 -0.70 1.11 3.64 -0.82 -2.78 116.57 118.29 1t3a h LYS 328 Ca 0.21 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1t3a h LYS 328 Cb 0.06 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.69 1t3a h LYS 328 CO -0.11 0.46 0.39 -0.22 -2.27 0.00 0.00 179.45 177.70 1t3a h LYS 329 N 0.71 0.97 -0.59 1.90 3.64 -0.09 -1.94 116.57 121.16 1t3a h LYS 329 Ca 0.21 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1t3a h LYS 329 Cb -0.03 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.57 1t3a h LYS 329 CO -0.07 0.71 0.25 -0.07 -2.27 0.00 0.00 179.45 178.00 1t3a h LEU 330 N 0.96 0.81 -2.53 5.20 3.38 -0.80 -3.25 115.31 119.08 1t3a h LEU 330 Ca 0.25 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1t3a h LEU 330 Cb 0.02 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1t3a h LEU 330 CO -0.04 0.75 0.00 -1.22 0.09 0.00 0.00 178.44 178.02 1t3a n TYR 331 N -4.48 0.67 0.54 1.13 4.01 -1.09 -4.11 117.16 113.82 1t3a n TYR 331 Ca 0.03 -0.37 0.12 0.00 -0.16 0.00 0.00 57.90 57.53 1t3a n TYR 331 Cb 0.16 -0.00 0.25 0.00 -0.31 0.00 0.00 39.34 39.43 1t3a n TYR 331 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1t3a h SER 332 N 4.10 0.00 -3.45 7.72 0.02 -1.38 -3.43 113.55 117.13 1t3a h SER 332 Ca 0.00 -0.11 -0.61 0.00 -0.84 0.00 0.00 61.79 60.24 1t3a h SER 332 Cb 0.95 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.38 1t3a h SER 332 CO 0.00 0.05 0.34 -0.36 -1.14 0.00 0.00 176.83 175.72 1t3a s PHE 333 N -3.16 3.21 0.07 3.45 0.08 -1.26 -4.95 117.98 115.42 1t3a s PHE 333 Ca 0.08 0.77 -0.03 0.00 0.12 0.00 0.00 56.93 57.86 1t3a s PHE 333 Cb 0.12 -3.16 -0.03 0.00 -0.57 0.00 0.00 43.02 39.39 1t3a s PHE 333 CO 0.68 -0.54 0.04 0.95 -0.10 0.00 0.00 175.22 176.25 1t3a s THR 334 N 2.87 0.19 0.16 0.64 -4.23 -1.26 -4.79 115.64 109.22 1t3a s THR 334 Ca 0.31 -1.63 -0.12 0.00 -1.18 0.00 0.00 61.69 59.07 1t3a s THR 334 Cb -0.14 -1.50 0.05 0.00 1.34 0.00 0.00 72.50 72.25 1t3a s THR 334 CO 0.12 -0.87 1.66 -0.08 -0.54 0.00 0.00 174.62 174.91 1t3a h GLU 335 N 3.02 0.89 0.20 3.99 4.81 -0.47 -2.18 114.58 124.85 1t3a h GLU 335 Ca -0.34 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 58.66 1t3a h GLU 335 Cb 1.16 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1t3a h GLU 335 CO 0.63 0.85 -0.13 0.35 -0.73 0.00 0.00 179.01 179.98 1t3a h PHE 336 N 0.79 -0.34 -0.19 0.92 3.57 -1.19 -0.95 116.94 119.55 1t3a h PHE 336 Ca 0.17 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.57 1t3a h PHE 336 Cb 0.38 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1t3a h PHE 336 CO 0.03 -0.21 -0.31 -0.44 -2.23 0.00 0.00 178.31 175.15 1t3a h ASP 337 N -0.33 0.37 0.22 0.41 3.32 -1.81 -2.63 116.42 115.97 1t3a h ASP 337 Ca -0.02 -0.13 -0.16 0.00 0.02 0.00 0.00 57.03 56.74 1t3a h ASP 337 Cb 0.28 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1t3a h ASP 337 CO 0.01 0.67 -0.63 -0.07 -1.72 0.00 0.00 179.24 177.51 1t3a h LEU 338 N 0.32 0.45 -1.06 1.55 3.38 -1.30 -2.44 115.31 116.20 1t3a h LEU 338 Ca 0.04 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1t3a h LEU 338 Cb 0.71 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 1t3a h LEU 338 CO 0.05 0.96 0.59 0.00 0.09 0.00 0.00 178.44 180.13 1t3a h ALA 339 N 1.04 1.31 -0.30 1.53 0.00 -0.86 0.71 119.26 122.68 1t3a h ALA 339 Ca -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1t3a h ALA 339 Cb 1.17 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1t3a h ALA 339 CO 0.11 0.62 0.11 1.15 0.00 0.00 0.00 179.25 181.23 1t3a h THR 340 N 1.25 1.19 0.00 0.00 2.02 -1.27 0.48 112.91 116.58 1t3a h THR 340 Ca 0.33 -0.61 -0.09 0.00 0.77 0.00 0.00 66.41 66.81 1t3a h THR 340 Cb -0.11 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1t3a h THR 340 CO -0.07 0.21 -0.44 0.11 0.37 0.00 0.00 175.52 175.69 1t3a h LYS 341 N 0.34 0.00 -0.01 6.66 1.57 -0.94 -2.83 116.57 121.35 1t3a h LYS 341 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1t3a h LYS 341 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1t3a h LYS 341 CO -0.01 0.44 -0.27 1.19 -0.57 0.00 0.00 179.45 180.24 1t3a n PHE 342 N -3.78 0.00 -3.43 -1.35 3.72 0.20 -4.97 117.46 107.85 1t3a n PHE 342 Ca -0.01 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.19 1t3a n PHE 342 Cb 0.50 -0.08 0.06 0.00 -0.94 0.00 0.00 39.48 39.02 1t3a n PHE 342 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1t3a n GLN 343 N -0.42 -2.87 -4.80 -1.08 6.02 -0.03 -5.01 117.38 109.20 1t3a n GLN 343 Ca 0.12 0.74 -0.25 0.00 -0.01 0.00 0.00 57.00 57.60 1t3a n GLN 343 Cb 0.38 -5.36 -0.15 0.00 1.02 0.00 0.00 30.24 26.12 1t3a n GLN 343 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1t3a s VAL 344 N -3.44 1.44 0.18 5.09 1.01 -0.14 -4.97 120.40 119.58 1t3a s VAL 344 Ca 0.35 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 1t3a s VAL 344 Cb -0.07 -1.21 -0.09 0.00 0.00 0.00 0.00 36.38 35.01 1t3a s VAL 344 CO 0.78 0.35 1.38 -0.75 0.00 0.00 0.00 175.10 176.86 1t3a s LYS 345 N -0.59 4.33 0.09 2.72 2.47 -1.26 -4.53 119.74 122.98 1t3a s LYS 345 Ca 0.07 2.14 0.09 0.00 -1.56 0.00 0.00 55.97 56.71 1t3a s LYS 345 Cb -0.07 -3.19 -0.03 0.00 -1.46 0.00 0.00 37.83 33.08 1t3a s LYS 345 CO -0.00 -0.37 -0.24 0.00 0.16 0.00 0.00 175.35 174.90 1t3a s ARG 347 N -1.72 2.16 0.08 0.00 1.70 -1.26 -4.98 118.95 114.92 1t3a s ARG 347 Ca 0.10 0.43 -0.22 0.00 -0.47 0.00 0.00 55.73 55.57 1t3a s ARG 347 Cb -0.10 -1.94 -0.14 0.00 -0.57 0.00 0.00 34.95 32.20 1t3a s ARG 347 CO 0.04 -1.52 1.64 0.37 -1.08 0.00 0.00 175.30 174.75 1t3a h GLN 348 N -1.01 0.09 -3.93 3.89 5.75 -1.99 -3.46 115.11 114.45 1t3a h GLN 348 Ca -0.47 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 57.91 1t3a h GLN 348 Cb 1.28 -0.02 -0.16 0.00 1.07 0.00 0.00 27.48 29.66 1t3a h GLN 348 CO 0.62 0.17 -0.53 -0.08 -2.65 0.00 0.00 178.83 176.37 1t3a s THR 349 N -5.74 0.16 0.24 2.39 -1.32 -1.26 -4.53 115.64 105.57 1t3a s THR 349 Ca -0.14 -1.32 -0.04 0.00 -1.21 0.00 0.00 61.69 58.99 1t3a s THR 349 Cb 0.06 -1.19 0.09 0.00 -1.51 0.00 0.00 72.50 69.94 1t3a s THR 349 CO 0.68 -0.73 1.71 0.22 -2.21 0.00 0.00 174.62 174.29 1t3a h TYR 350 N 3.27 0.90 -3.90 9.09 3.20 -1.91 -3.44 116.97 124.16 1t3a h TYR 350 Ca -0.33 -0.15 -0.52 0.00 3.14 0.00 0.00 58.73 60.87 1t3a h TYR 350 Cb 1.18 -0.24 0.06 0.00 1.54 0.00 0.00 36.73 39.27 1t3a h TYR 350 CO 0.51 0.85 0.59 0.42 -1.64 0.00 0.00 178.16 178.89 1t3a s ILE 351 N -4.89 2.83 0.00 1.81 -1.09 -1.26 -4.96 121.20 113.64 1t3a s ILE 351 Ca -0.10 0.78 0.00 0.00 -2.23 0.00 0.00 60.65 59.11 1t3a s ILE 351 Cb 0.14 -3.48 0.00 0.00 -1.58 0.00 0.00 42.46 37.54 1t3a s ILE 351 CO 0.82 0.15 0.00 0.61 -1.23 0.00 0.00 174.94 175.29 1t3a n GLY 352 N 0.77 3.31 3.51 6.18 0.00 -1.26 -5.08 105.19 112.62 1t3a n GLY 352 Ca 0.02 -1.77 -0.34 0.00 0.00 0.00 0.00 46.02 43.93 1t3a n GLY 352 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1t3a s GLN 353 N -2.19 3.35 -0.03 1.61 0.74 -1.26 -5.10 119.66 116.78 1t3a s GLN 353 Ca 0.00 -0.54 0.06 0.00 0.05 0.00 0.00 55.36 54.92 1t3a s GLN 353 Cb 0.00 -2.78 -0.01 0.00 1.10 0.00 0.00 33.01 31.32 1t3a s GLN 353 CO 0.00 0.38 -0.19 0.71 -0.55 0.00 0.00 175.29 175.63 1t3a s TYR 354 N -0.02 1.81 0.10 1.67 2.02 -1.26 -5.08 117.35 116.58 1t3a s TYR 354 Ca 0.00 -0.40 -0.30 0.00 -0.37 0.00 0.00 57.07 56.00 1t3a s TYR 354 Cb -0.13 -1.18 -0.06 0.00 -0.40 0.00 0.00 41.96 40.19 1t3a s TYR 354 CO 0.03 -0.08 1.19 0.21 -1.57 0.00 0.00 175.55 175.33 1t3a s LYS 355 N -0.31 4.46 0.24 -0.62 2.20 -1.26 -4.83 119.74 119.62 1t3a s LYS 355 Ca 0.04 1.79 -0.06 0.00 -0.36 0.00 0.00 55.97 57.38 1t3a s LYS 355 Cb -0.09 -3.32 -0.06 0.00 -1.51 0.00 0.00 37.83 32.86 1t3a s LYS 355 CO 0.00 -0.19 0.50 0.71 -0.36 0.00 0.00 175.35 176.01 1t3a s TYR 356 N 0.71 3.46 0.02 4.03 1.51 -1.26 -1.12 117.35 124.71 1t3a s TYR 356 Ca 0.57 0.65 -0.00 0.00 -1.01 0.00 0.00 57.07 57.27 1t3a s TYR 356 Cb -0.30 -2.10 -0.02 0.00 -0.11 0.00 0.00 41.96 39.43 1t3a s TYR 356 CO 0.31 0.26 -0.03 -0.06 -1.11 0.00 0.00 175.55 174.93 1t3a s PHE 357 N -1.92 0.30 0.10 2.71 0.08 0.12 -4.95 117.98 114.42 1t3a s PHE 357 Ca 0.44 -0.61 -0.28 0.00 0.12 0.00 0.00 56.93 56.60 1t3a s PHE 357 Cb -0.11 -0.22 -0.06 0.00 -0.57 0.00 0.00 43.02 42.06 1t3a s PHE 357 CO 0.27 -0.22 0.87 0.21 -0.10 0.00 0.00 175.22 176.25 1t3a s LYS 358 N -1.83 4.62 0.04 0.44 2.20 -1.26 -1.28 119.74 122.68 1t3a s LYS 358 Ca -0.13 1.29 -0.20 0.00 -0.36 0.00 0.00 55.97 56.57 1t3a s LYS 358 Cb -0.07 -3.36 -0.06 0.00 -1.51 0.00 0.00 37.83 32.83 1t3a s LYS 358 CO -0.02 0.28 0.58 -0.51 -0.36 0.00 0.00 175.35 175.32 1t3a s LEU 359 N -0.18 4.48 0.61 5.43 1.43 0.55 -1.71 118.68 129.30 1t3a s LEU 359 Ca 0.43 1.22 -0.18 0.00 -1.03 0.00 0.00 54.13 54.57 1t3a s LEU 359 Cb -0.22 -2.91 -0.03 0.00 0.03 0.00 0.00 46.19 43.06 1t3a s LEU 359 CO 0.27 0.20 1.22 -0.44 0.23 0.00 0.00 176.35 177.83 1t3a s SER 360 N -0.72 5.03 -0.26 2.29 0.01 0.20 -4.65 113.70 115.61 1t3a s SER 360 Ca 0.30 2.42 -0.08 0.00 1.31 0.00 0.00 55.95 59.89 1t3a s SER 360 Cb -0.19 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.38 1t3a s SER 360 CO 0.18 -1.70 0.70 -3.20 0.41 0.00 0.00 173.24 169.63 1t3a n ASN 361 N -1.73 0.08 0.28 2.44 5.15 -1.26 -4.79 115.26 115.43 1t3a n ASN 361 Ca 0.14 0.05 0.19 0.00 -0.60 0.00 0.00 54.58 54.36 1t3a n ASN 361 Cb 0.49 -0.24 0.88 0.00 -0.53 0.00 0.00 39.78 40.38 1t3a n ASN 361 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1t3a h LEU 362 N 3.12 0.00 -0.36 1.20 3.38 -1.94 -1.91 115.31 118.79 1t3a h LEU 362 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1t3a h LEU 362 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1t3a h LEU 362 CO 0.36 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.07 1t3a n LEU 363 N -2.93 0.54 -4.42 1.67 4.77 -1.26 -4.67 117.00 110.70 1t3a n LEU 363 Ca -0.01 -0.22 -0.44 0.00 -0.03 0.00 0.00 56.01 55.31 1t3a n LEU 363 Cb 0.18 -0.03 -0.07 0.00 -2.33 0.00 0.00 43.42 41.18 1t3a n LEU 363 CO 0.22 0.11 0.25 0.21 -1.33 0.00 0.00 177.39 176.84 1t3a s ASN 364 N -1.67 6.20 0.30 -1.43 3.84 -0.72 -4.94 114.94 116.52 1t3a s ASN 364 Ca 0.33 -1.08 0.22 0.00 0.21 0.00 0.00 52.86 52.54 1t3a s ASN 364 Cb 0.16 -2.26 1.10 0.00 -0.55 0.00 0.00 41.25 39.70 1t3a s ASN 364 CO 0.26 -0.83 1.68 0.47 -2.79 0.00 0.00 177.10 175.89 1t3a n ASP 365 N 5.88 0.61 0.17 -4.21 8.00 -1.25 -0.84 116.55 124.91 1t3a n ASP 365 Ca -0.09 0.72 0.13 0.00 0.71 0.00 0.00 54.79 56.27 1t3a n ASP 365 Cb 0.45 -0.83 0.44 0.00 -0.02 0.00 0.00 41.12 41.16 1t3a n ASP 365 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1t3a h SER 366 N 0.00 0.00 0.00 -2.24 0.02 -1.96 -3.36 113.55 106.01 1t3a h SER 366 Ca 0.00 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 1t3a h SER 366 Cb 0.15 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1t3a h SER 366 CO 0.00 0.00 -1.74 -0.38 -1.14 0.00 0.00 176.83 173.57 1t3a n ILE 367 N -2.57 0.74 -3.69 3.27 5.41 -0.02 -5.02 119.36 117.48 1t3a n ILE 367 Ca 0.03 -0.24 -0.14 0.00 1.00 0.00 0.00 62.75 63.40 1t3a n ILE 367 Cb 0.37 -1.29 -0.14 0.00 -0.71 0.00 0.00 39.64 37.87 1t3a n ILE 367 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 1t3a s TYR 368 N -2.25 -0.29 0.35 1.39 5.04 -0.22 -4.34 117.35 117.02 1t3a s TYR 368 Ca -0.18 0.75 0.04 0.00 -2.44 0.00 0.00 57.07 55.24 1t3a s TYR 368 Cb 0.06 -0.11 -0.05 0.00 0.35 0.00 0.00 41.96 42.21 1t3a s TYR 368 CO 0.27 -0.28 0.07 0.54 -1.34 0.00 0.00 175.55 174.81 1t3a s ASN 369 N 2.03 2.49 0.12 4.32 2.20 -0.62 -3.77 114.94 121.70 1t3a s ASN 369 Ca -0.01 -1.44 -0.24 0.00 -0.94 0.00 0.00 52.86 50.22 1t3a s ASN 369 Cb -0.12 0.05 -0.07 0.00 -2.00 0.00 0.00 41.25 39.12 1t3a s ASN 369 CO -0.07 -0.68 1.67 0.40 -2.94 0.00 0.00 177.10 175.47 1t3a h ILE 370 N 2.03 0.58 0.00 0.54 1.08 -1.90 0.48 117.51 120.31 1t3a h ILE 370 Ca -0.40 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 63.95 1t3a h ILE 370 Cb 1.25 0.58 -0.02 0.00 -3.07 0.00 0.00 36.82 35.56 1t3a h ILE 370 CO 0.67 0.00 -0.68 0.77 -0.69 0.00 0.00 178.15 178.22 1t3a h SER 371 N -0.29 0.00 0.00 1.72 4.64 -1.93 -3.39 113.55 114.29 1t3a h SER 371 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1t3a h SER 371 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1t3a h SER 371 CO -0.16 0.54 0.00 -0.62 -0.87 0.00 0.00 176.83 175.73 1t3a n GLU 372 N -3.17 6.17 0.00 4.77 1.02 -1.24 -5.09 120.64 123.09 1t3a n GLU 372 Ca -0.00 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1t3a n GLU 372 Cb 0.76 -0.54 0.00 0.00 -0.02 0.00 0.00 31.44 31.64 1t3a n GLU 372 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1t3a n GLY 373 N 0.89 2.74 0.18 0.62 0.00 0.16 -1.78 105.19 108.00 1t3a n GLY 373 Ca 0.00 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.88 1t3a n GLY 373 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1t3a h TYR 374 N 0.00 0.00 -0.61 1.61 0.05 -1.85 -1.65 116.97 114.52 1t3a h TYR 374 Ca 0.00 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 58.18 1t3a h TYR 374 Cb 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 37.66 1t3a h TYR 374 CO 0.00 0.00 2.14 0.09 -1.05 0.00 0.00 178.16 179.34 1t3a n ASN 375 N -2.87 7.62 -4.69 3.88 5.03 -0.73 -4.40 115.26 119.09 1t3a n ASN 375 Ca 0.03 -2.88 -0.42 0.00 0.87 0.00 0.00 54.58 52.18 1t3a n ASN 375 Cb 0.52 -1.41 -0.03 0.00 -1.02 0.00 0.00 39.78 37.84 1t3a n ASN 375 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1t3a s ILE 376 N 0.02 3.66 0.00 2.41 1.01 -1.26 -3.75 121.20 123.29 1t3a s ILE 376 Ca 0.62 1.06 0.00 0.00 0.00 0.00 0.00 60.65 62.33 1t3a s ILE 376 Cb 0.24 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 39.02 1t3a s ILE 376 CO -0.09 0.01 0.00 0.59 0.00 0.00 0.00 174.94 175.45 1t3a n ASN 377 N 5.22 0.00 0.31 3.58 3.02 -1.26 -1.39 115.26 124.73 1t3a n ASN 377 Ca 0.13 0.00 0.19 0.00 -0.03 0.00 0.00 54.58 54.87 1t3a n ASN 377 Cb 0.43 0.00 0.98 0.00 -0.61 0.00 0.00 39.78 40.58 1t3a n ASN 377 CO 0.00 0.00 0.00 -1.13 -2.62 0.00 0.00 177.26 173.51 1t3a h ASN 378 N 0.00 0.00 0.27 6.41 -1.24 -2.01 -2.35 115.58 116.66 1t3a h ASN 378 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1t3a h ASN 378 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 1t3a h ASN 378 CO 0.00 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.32 1t3a n LEU 379 N -3.19 0.00 0.19 0.34 4.77 -0.49 -2.77 117.00 115.85 1t3a n LEU 379 Ca -0.01 0.37 0.03 0.00 -0.03 0.00 0.00 56.01 56.37 1t3a n LEU 379 Cb 0.25 -0.37 0.42 0.00 -2.33 0.00 0.00 43.42 41.39 1t3a n LEU 379 CO 0.19 -0.24 0.82 0.07 -1.33 0.00 0.00 177.39 176.91 1t3a h LYS 380 N 0.00 0.04 -6.26 3.23 2.10 -1.50 -1.45 116.57 112.72 1t3a h LYS 380 Ca 0.00 -0.01 -0.55 0.00 -2.00 0.00 0.00 60.65 58.09 1t3a h LYS 380 Cb 0.13 -0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.47 1t3a h LYS 380 CO 0.00 0.30 1.30 0.28 -2.00 0.00 0.00 179.45 179.33 1t3a n VAL 381 N -4.22 0.66 -1.86 0.07 0.31 -1.11 -1.49 118.33 110.70 1t3a n VAL 381 Ca -0.02 -0.22 -0.20 0.00 -0.01 0.00 0.00 64.34 63.90 1t3a n VAL 381 Cb 0.32 -2.37 -0.06 0.00 -0.91 0.00 0.00 33.84 30.82 1t3a n VAL 381 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1t3a n ASN 382 N 8.54 -5.31 -3.92 4.52 3.02 -1.26 -2.21 115.26 118.64 1t3a n ASN 382 Ca 0.23 0.32 -0.30 0.00 -0.03 0.00 0.00 54.58 54.80 1t3a n ASN 382 Cb 0.41 -4.61 0.02 0.00 -0.61 0.00 0.00 39.78 34.99 1t3a n ASN 382 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1t3a n PHE 383 N -2.85 -2.21 0.24 3.10 3.72 -0.55 -4.83 117.46 114.08 1t3a n PHE 383 Ca -0.21 0.89 0.08 0.00 -0.05 0.00 0.00 57.45 58.16 1t3a n PHE 383 Cb 0.65 -3.94 0.59 0.00 -0.94 0.00 0.00 39.48 35.85 1t3a n PHE 383 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1t3a h ARG 384 N -2.02 0.00 -0.80 -1.08 2.43 -0.81 -2.01 114.38 110.09 1t3a h ARG 384 Ca -0.59 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 58.71 1t3a h ARG 384 Cb 1.38 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.87 1t3a h ARG 384 CO 0.67 0.12 0.52 0.78 -1.51 0.00 0.00 179.97 180.55 1t3a h GLY 385 N 0.42 0.96 0.06 2.80 0.00 -1.57 -0.71 103.07 105.03 1t3a h GLY 385 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1t3a h GLY 385 CO 0.02 0.11 -0.33 -1.06 0.00 0.00 0.00 176.54 175.28 1t3a n GLN 386 N -4.51 0.83 -2.01 4.80 6.02 -0.77 -4.70 117.38 117.04 1t3a n GLN 386 Ca 0.15 -0.54 -0.43 0.00 -0.01 0.00 0.00 57.00 56.17 1t3a n GLN 386 Cb 0.44 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.18 1t3a n GLN 386 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1t3a s ASN 387 N -2.54 6.27 0.52 1.08 3.84 -0.27 -1.07 114.94 122.76 1t3a s ASN 387 Ca 0.22 1.76 0.18 0.00 0.21 0.00 0.00 52.86 55.23 1t3a s ASN 387 Cb 0.19 -2.53 1.29 0.00 -0.55 0.00 0.00 41.25 39.65 1t3a s ASN 387 CO 0.55 -1.32 2.13 0.00 -2.79 0.00 0.00 177.10 175.67 1t3a h ALA 388 N 11.24 1.87 0.01 1.71 0.00 -1.38 0.12 119.26 132.84 1t3a h ALA 388 Ca -0.36 -0.03 -0.32 0.00 0.00 0.00 0.00 54.91 54.19 1t3a h ALA 388 Cb 1.17 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1t3a h ALA 388 CO 0.99 0.04 -1.95 0.09 0.00 0.00 0.00 179.25 178.42 1t3a n ASN 389 N -4.40 0.80 0.07 0.00 4.13 -1.26 -3.37 115.26 111.24 1t3a n ASN 389 Ca -0.03 0.26 0.01 0.00 1.68 0.00 0.00 54.58 56.50 1t3a n ASN 389 Cb 0.12 0.13 -0.04 0.00 -1.54 0.00 0.00 39.78 38.45 1t3a n ASN 389 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1t3a h LEU 390 N 0.01 0.00 -5.74 3.41 3.38 -1.84 -3.38 115.31 111.15 1t3a h LEU 390 Ca -0.38 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.07 1t3a h LEU 390 Cb 2.08 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 42.42 1t3a h LEU 390 CO 0.06 0.53 -0.99 -3.20 0.09 0.00 0.00 178.44 174.93 1t3a n ASN 391 N -3.01 2.17 0.26 -0.43 5.15 0.41 -4.95 115.26 114.87 1t3a n ASN 391 Ca -0.05 -3.26 0.15 0.00 -0.60 0.00 0.00 54.58 50.82 1t3a n ASN 391 Cb 0.79 -0.60 0.79 0.00 -0.53 0.00 0.00 39.78 40.24 1t3a n ASN 391 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1t3a h PRO 392 N 3.01 0.00 0.00 1.20 0.13 -1.72 -2.87 132.00 131.74 1t3a h PRO 392 Ca 0.11 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1t3a h PRO 392 Cb 0.80 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.93 1t3a h PRO 392 CO 0.62 0.00 -0.00 0.07 -0.23 0.00 0.00 178.00 178.45 1t3a h ARG 393 N 0.00 0.00 0.00 0.86 0.11 -1.92 -2.56 114.38 110.87 1t3a h ARG 393 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1t3a h ARG 393 Cb 0.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.39 1t3a h ARG 393 CO 0.00 0.00 0.00 -0.84 0.10 0.00 0.00 179.97 179.23 1t3a h ILE 394 N 0.00 0.00 -3.66 0.08 3.07 -1.86 -3.43 117.51 111.71 1t3a h ILE 394 Ca -0.00 -0.41 -0.67 0.00 1.55 0.00 0.00 64.86 65.33 1t3a h ILE 394 Cb 0.05 1.29 -0.18 0.00 -0.27 0.00 0.00 36.82 37.71 1t3a h ILE 394 CO 0.00 0.00 -0.73 -0.63 -1.05 0.00 0.00 178.15 175.74 1t3a s ILE 395 N -3.47 3.45 0.00 0.16 -1.09 -0.97 -0.63 121.20 118.66 1t3a s ILE 395 Ca 0.03 -0.95 0.04 0.00 -2.23 0.00 0.00 60.65 57.55 1t3a s ILE 395 Cb 0.09 -2.52 -0.01 0.00 -1.58 0.00 0.00 42.46 38.44 1t3a s ILE 395 CO 0.48 0.32 -0.14 -0.89 -1.23 0.00 0.00 174.94 173.49 1t3a s THR 396 N -1.03 1.10 0.62 2.92 2.01 -0.69 -4.66 115.64 115.90 1t3a s THR 396 Ca 0.18 -0.69 -0.19 0.00 0.31 0.00 0.00 61.69 61.30 1t3a s THR 396 Cb -0.11 -0.94 -0.02 0.00 0.01 0.00 0.00 72.50 71.44 1t3a s THR 396 CO 0.09 0.24 1.29 -2.84 -0.69 0.00 0.00 174.62 172.71 1t3a s PRO 397 N -0.51 2.73 -0.45 4.92 0.02 -1.26 -3.99 135.00 136.46 1t3a s PRO 397 Ca 0.05 2.06 -0.16 0.00 0.02 0.00 0.00 61.00 62.96 1t3a s PRO 397 Cb -0.06 -1.94 0.04 0.00 0.02 0.00 0.00 34.50 32.56 1t3a s PRO 397 CO -0.00 -1.46 0.42 0.42 -0.33 0.00 0.00 177.00 176.05 1t3a s ILE 398 N -1.40 5.14 0.18 2.83 1.01 -1.26 -4.94 121.20 122.76 1t3a s ILE 398 Ca 0.80 -0.68 -0.33 0.00 0.00 0.00 0.00 60.65 60.44 1t3a s ILE 398 Cb -0.37 -4.08 -0.15 0.00 0.01 0.00 0.00 42.46 37.87 1t3a s ILE 398 CO 0.40 -0.51 1.33 0.41 0.00 0.00 0.00 174.94 176.57 1t3a n THR 399 N 5.32 0.67 0.00 2.92 -1.04 -1.26 -1.48 114.28 119.42 1t3a n THR 399 Ca -0.10 -0.17 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1t3a n THR 399 Cb 0.46 -1.15 0.00 0.00 -1.82 0.00 0.00 70.33 67.81 1t3a n THR 399 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1t3a n GLY 400 N 2.32 3.04 3.69 3.41 0.00 -1.26 -5.00 105.19 111.39 1t3a n GLY 400 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1t3a n GLY 400 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1t3a s ARG 401 N -0.40 4.15 0.00 1.61 3.52 -0.55 -1.87 118.95 125.42 1t3a s ARG 401 Ca 0.00 2.52 0.00 0.00 -0.13 0.00 0.00 55.73 58.12 1t3a s ARG 401 Cb 0.00 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.78 1t3a s ARG 401 CO 0.00 -0.81 0.00 0.41 -0.81 0.00 0.00 175.30 174.09 1t3a n GLY 402 N 4.17 0.56 0.19 8.12 0.00 -1.26 -4.91 105.19 112.06 1t3a n GLY 402 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 1t3a n GLY 402 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1t3a h LEU 403 N 0.00 0.42 -0.53 0.99 3.38 -1.69 -1.93 115.31 115.95 1t3a h LEU 403 Ca 0.00 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1t3a h LEU 403 Cb 0.13 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1t3a h LEU 403 CO 0.00 0.30 0.32 -0.37 0.09 0.00 0.00 178.44 178.77 1t3a h VAL 404 N 0.53 1.06 -0.53 1.22 -1.51 -1.87 0.21 116.25 115.36 1t3a h VAL 404 Ca 0.19 -0.22 0.03 0.00 -1.23 0.00 0.00 66.70 65.47 1t3a h VAL 404 Cb 0.03 0.37 -0.04 0.00 -2.13 0.00 0.00 31.29 29.53 1t3a h VAL 404 CO -0.09 0.11 0.30 0.50 -1.23 0.00 0.00 177.57 177.16 1t3a h LYS 405 N 0.63 0.57 -0.32 5.19 3.64 -1.90 -0.74 116.57 123.64 1t3a h LYS 405 Ca 0.21 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1t3a h LYS 405 Cb 0.02 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1t3a h LYS 405 CO -0.09 0.38 -0.09 0.87 -2.27 0.00 0.00 179.45 178.25 1t3a h LYS 406 N 0.59 0.54 -3.57 1.90 6.56 -0.79 -3.26 116.57 118.54 1t3a h LYS 406 Ca 0.22 -0.15 -0.73 0.00 -1.06 0.00 0.00 60.65 58.94 1t3a h LYS 406 Cb 0.07 -0.06 -0.08 0.00 -0.57 0.00 0.00 32.23 31.59 1t3a h LYS 406 CO -0.12 0.63 2.75 -0.89 -2.06 0.00 0.00 179.45 179.76 1t3a n ILE 407 N -4.22 4.04 -2.57 1.86 5.41 0.69 -2.59 119.36 121.98 1t3a n ILE 407 Ca 0.01 -3.59 -0.02 0.00 1.00 0.00 0.00 62.75 60.15 1t3a n ILE 407 Cb 0.31 -2.47 0.09 0.00 -0.71 0.00 0.00 39.64 36.85 1t3a n ILE 407 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1t3a n ILE 408 N 3.96 0.00 -1.35 1.39 5.41 -1.23 -4.87 119.36 122.67 1t3a n ILE 408 Ca 0.52 -0.71 0.00 0.00 1.00 0.00 0.00 62.75 63.55 1t3a n ILE 408 Cb 0.35 0.85 0.00 0.00 -0.71 0.00 0.00 39.64 40.12 1t3a n ILE 408 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1t3a n ARG 409 N -1.11 -2.75 -1.41 0.38 5.12 -1.07 -5.12 116.66 110.71 1t3a n ARG 409 Ca -0.15 2.20 0.00 0.00 -1.93 0.00 0.00 57.85 57.98 1t3a n ARG 409 Cb 0.78 -2.21 0.00 0.00 -1.16 0.00 0.00 32.46 29.87 1t3a n ARG 409 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1t3a n PHE 410 N 0.94 -0.04 -1.09 -1.55 3.72 -1.13 -4.93 117.46 113.38 1t3a n PHE 410 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1t3a n PHE 410 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1t3a n PHE 410 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71