#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a4t s MET 10 N 0.00 3.33 -0.01 1.64 -1.94 -1.26 -5.07 119.30 115.99 3a4t s MET 10 Ca 0.00 1.16 0.07 0.00 -1.71 0.00 0.00 55.69 55.21 3a4t s MET 10 Cb 0.00 -2.04 -0.02 0.00 2.01 0.00 0.00 34.83 34.79 3a4t s MET 10 CO 0.00 -0.80 -0.22 -0.65 -0.01 0.00 0.00 175.02 173.34 3a4t s GLN 11 N -4.17 1.78 0.10 2.03 -0.21 -1.26 -4.97 119.66 112.97 3a4t s GLN 11 Ca 0.63 -0.80 0.02 0.00 0.02 0.00 0.00 55.36 55.23 3a4t s GLN 11 Cb -0.15 -1.73 -0.04 0.00 1.00 0.00 0.00 33.01 32.08 3a4t s GLN 11 CO 0.38 0.47 -0.07 -0.06 -2.12 0.00 0.00 175.29 173.89 3a4t s PHE 12 N -0.53 0.95 0.03 0.91 0.40 -1.25 -0.86 117.98 117.64 3a4t s PHE 12 Ca 0.09 -0.85 0.04 0.00 -0.60 0.00 0.00 56.93 55.60 3a4t s PHE 12 Cb -0.09 -0.54 -0.02 0.00 0.51 0.00 0.00 43.02 42.89 3a4t s PHE 12 CO -0.01 -0.10 -0.12 0.96 0.70 0.00 0.00 175.22 176.66 3a4t s ILE 13 N -3.38 0.92 -0.22 0.64 -4.36 0.09 -2.55 121.20 112.33 3a4t s ILE 13 Ca 0.11 -0.87 -0.13 0.00 -0.26 0.00 0.00 60.65 59.50 3a4t s ILE 13 Cb 0.04 -0.85 -0.04 0.00 1.25 0.00 0.00 42.46 42.86 3a4t s ILE 13 CO -0.03 -0.01 0.28 -0.60 0.24 0.00 0.00 174.94 174.81 3a4t s ARG 14 N -1.00 4.11 0.17 0.37 3.52 0.10 -1.43 118.95 124.79 3a4t s ARG 14 Ca 0.00 -0.04 -0.30 0.00 -0.13 0.00 0.00 55.73 55.27 3a4t s ARG 14 Cb -0.07 -3.55 -0.07 0.00 -1.56 0.00 0.00 34.95 29.70 3a4t s ARG 14 CO 0.01 -0.00 1.04 0.08 -0.81 0.00 0.00 175.30 175.61 3a4t s VAL 15 N 1.23 4.08 -0.82 7.11 1.01 0.13 -1.17 120.40 131.98 3a4t s VAL 15 Ca 0.13 1.81 -0.18 0.00 0.00 0.00 0.00 61.98 63.74 3a4t s VAL 15 Cb -0.14 -4.16 0.14 0.00 0.00 0.00 0.00 36.38 32.22 3a4t s VAL 15 CO 0.06 0.32 0.96 0.21 0.00 0.00 0.00 175.10 176.66 3a4t s ASN 16 N -0.23 6.52 0.33 3.32 2.47 -0.46 -4.85 114.94 122.04 3a4t s ASN 16 Ca 0.47 -1.94 0.25 0.00 0.42 0.00 0.00 52.86 52.07 3a4t s ASN 16 Cb -0.27 -2.35 1.15 0.00 -1.45 0.00 0.00 41.25 38.33 3a4t s ASN 16 CO 0.33 -1.02 1.76 0.71 -3.72 0.00 0.00 177.10 175.15 3a4t h THR 17 N 5.67 0.00 -0.88 -5.21 1.35 -1.87 0.14 112.91 112.12 3a4t h THR 17 Ca 0.01 -0.18 0.20 0.00 -0.55 0.00 0.00 66.41 65.89 3a4t h THR 17 Cb 1.04 0.88 -0.06 0.00 -1.73 0.00 0.00 68.15 68.28 3a4t h THR 17 CO 1.05 0.00 0.58 -0.07 -0.25 0.00 0.00 175.52 176.83 3a4t h LEU 18 N 0.00 0.37 0.00 3.87 3.38 -1.88 -3.32 115.31 117.72 3a4t h LEU 18 Ca 0.00 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3a4t h LEU 18 Cb 0.26 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3a4t h LEU 18 CO 0.00 0.15 -1.15 0.29 0.09 0.00 0.00 178.44 177.82 3a4t n LYS 19 N -4.49 3.59 -3.68 1.13 5.02 -0.17 -5.09 118.16 114.48 3a4t n LYS 19 Ca 0.18 -0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.33 3a4t n LYS 19 Cb 0.70 -1.06 -0.07 0.00 -0.02 0.00 0.00 35.03 34.58 3a4t n LYS 19 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 3a4t s ILE 20 N -2.05 0.05 0.14 -0.18 2.07 0.31 -5.06 121.20 116.46 3a4t s ILE 20 Ca -0.01 -0.37 -0.25 0.00 -1.41 0.00 0.00 60.65 58.60 3a4t s ILE 20 Cb 0.01 -0.81 -0.07 0.00 0.13 0.00 0.00 42.46 41.71 3a4t s ILE 20 CO 0.09 -0.21 0.78 0.20 -1.91 0.00 0.00 174.94 173.90 3a4t s ASN 21 N -1.53 7.36 0.31 4.50 0.02 -1.26 -3.41 114.94 120.93 3a4t s ASN 21 Ca -0.10 1.61 0.08 0.00 -1.02 0.00 0.00 52.86 53.43 3a4t s ASN 21 Cb -0.03 -2.50 0.87 0.00 0.02 0.00 0.00 41.25 39.62 3a4t s ASN 21 CO 0.03 0.15 1.69 -0.65 0.02 0.00 0.00 177.10 178.34 3a4t h PRO 22 N 4.68 0.39 0.03 -0.60 0.11 -1.94 -2.30 132.00 132.36 3a4t h PRO 22 Ca -0.46 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 65.39 3a4t h PRO 22 Cb 1.21 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 3a4t h PRO 22 CO 0.67 0.26 -1.13 0.93 -0.21 0.00 0.00 178.00 178.52 3a4t h GLU 23 N 0.40 0.05 -0.24 1.05 4.39 -1.94 -1.17 114.58 117.12 3a4t h GLU 23 Ca 0.63 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 60.22 3a4t h GLU 23 Cb 1.28 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.96 3a4t h GLU 23 CO -0.56 0.99 0.09 0.28 -1.16 0.00 0.00 179.01 178.65 3a4t h VAL 24 N 0.01 1.18 -0.35 3.13 2.07 -1.84 -2.42 116.25 118.04 3a4t h VAL 24 Ca -0.07 -0.57 -0.06 0.00 0.82 0.00 0.00 66.70 66.82 3a4t h VAL 24 Cb 1.84 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 3a4t h VAL 24 CO 0.14 0.19 -0.01 0.25 0.02 0.00 0.00 177.57 178.15 3a4t h LEU 25 N 0.23 0.62 -0.18 2.57 5.85 -1.49 -2.06 115.31 120.85 3a4t h LEU 25 Ca 0.08 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.51 3a4t h LEU 25 Cb 0.21 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 3a4t h LEU 25 CO -0.00 0.79 0.02 0.50 -0.34 0.00 0.00 178.44 179.40 3a4t h LYS 26 N 0.43 0.08 -0.71 1.25 3.64 -1.21 -0.23 116.57 119.82 3a4t h LYS 26 Ca 0.10 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3a4t h LYS 26 Cb 0.48 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 3a4t h LYS 26 CO 0.02 0.05 0.46 -0.22 -2.27 0.00 0.00 179.45 177.50 3a4t h LYS 27 N 0.08 0.95 -0.62 1.90 1.63 -1.46 -0.93 116.57 118.12 3a4t h LYS 27 Ca 0.08 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.74 3a4t h LYS 27 Cb 0.09 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 31.48 3a4t h LYS 27 CO -0.12 0.64 0.09 -0.09 -3.45 0.00 0.00 179.45 176.52 3a4t h ARG 28 N 0.97 1.03 -0.08 1.90 2.43 -0.73 -1.75 114.38 118.15 3a4t h ARG 28 Ca 0.26 -0.28 -0.19 0.00 -0.81 0.00 0.00 59.98 58.96 3a4t h ARG 28 Cb -0.09 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.34 3a4t h ARG 28 CO -0.05 0.96 -0.76 -0.07 -1.51 0.00 0.00 179.97 178.54 3a4t h LEU 29 N 0.93 0.54 -1.02 3.80 3.38 -0.89 -2.98 115.31 119.07 3a4t h LEU 29 Ca 0.19 -0.36 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 3a4t h LEU 29 Cb 0.44 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3a4t h LEU 29 CO 0.01 1.11 -0.38 -0.33 0.09 0.00 0.00 178.44 178.95 3a4t h GLU 30 N 0.30 0.21 0.00 1.13 5.08 -1.08 -1.22 114.58 119.00 3a4t h GLU 30 Ca -0.04 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3a4t h GLU 30 Cb 1.35 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.59 3a4t h GLU 30 CO 0.13 0.56 0.00 -0.91 -1.00 0.00 0.00 179.01 177.80 3a4t h ASN 31 N 0.18 0.00 -0.53 1.42 2.35 -1.26 -2.19 115.58 115.55 3a4t h ASN 31 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3a4t h ASN 31 Cb 0.75 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.12 3a4t h ASN 31 CO 0.06 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.13 3a4t n LYS 32 N -2.54 3.13 -0.26 0.81 5.02 -0.56 -4.92 118.16 118.83 3a4t n LYS 32 Ca 0.02 -2.28 0.00 0.00 -2.02 0.00 0.00 58.31 54.03 3a4t n LYS 32 Cb 0.28 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 3a4t n LYS 32 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a4t n GLY 33 N 1.01 0.71 3.73 0.72 0.00 -0.82 -4.77 105.19 105.77 3a4t n GLY 33 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 3a4t n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a4t s VAL 34 N -2.36 4.25 -0.25 1.61 1.01 -0.59 -4.41 120.40 119.67 3a4t s VAL 34 Ca 0.00 1.81 -0.09 0.00 0.00 0.00 0.00 61.98 63.70 3a4t s VAL 34 Cb 0.00 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 3a4t s VAL 34 CO 0.00 0.25 0.12 -0.69 0.00 0.00 0.00 175.10 174.77 3a4t s VAL 35 N 0.22 4.77 0.04 2.92 1.01 0.11 -3.99 120.40 125.47 3a4t s VAL 35 Ca 0.50 -0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.54 3a4t s VAL 35 Cb -0.26 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 3a4t s VAL 35 CO 0.31 0.32 -0.19 -0.76 0.00 0.00 0.00 175.10 174.78 3a4t s LEU 36 N 1.49 2.54 -0.05 3.92 1.43 -1.26 -0.97 118.68 125.78 3a4t s LEU 36 Ca 0.06 -0.44 0.06 0.00 -1.03 0.00 0.00 54.13 52.78 3a4t s LEU 36 Cb -0.15 -1.48 -0.01 0.00 0.03 0.00 0.00 46.19 44.58 3a4t s LEU 36 CO 0.06 0.26 -0.23 -0.70 0.23 0.00 0.00 176.35 175.97 3a4t s GLU 37 N -1.36 2.31 1.00 1.70 2.56 0.15 -4.92 118.70 120.14 3a4t s GLU 37 Ca 0.14 -0.83 -0.21 0.00 0.00 0.00 0.00 54.97 54.08 3a4t s GLU 37 Cb -0.10 -1.98 -0.16 0.00 2.00 0.00 0.00 34.13 33.88 3a4t s GLU 37 CO 0.04 0.36 -1.04 1.63 -0.56 0.00 0.00 175.26 175.69 3a4t n LYS 38 N 2.96 -0.03 -4.03 4.30 4.76 -1.26 0.63 118.16 125.50 3a4t n LYS 38 Ca -0.17 -0.01 -0.10 0.00 -2.87 0.00 0.00 58.31 55.16 3a4t n LYS 38 Cb 0.52 -1.03 -0.07 0.00 -1.84 0.00 0.00 35.03 32.62 3a4t n LYS 38 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3a4t s THR 39 N -2.01 0.01 -1.40 -0.18 2.01 -1.25 -4.46 115.64 108.36 3a4t s THR 39 Ca 0.39 -1.51 0.15 0.00 0.31 0.00 0.00 61.69 61.03 3a4t s THR 39 Cb -0.08 -2.18 0.25 0.00 0.01 0.00 0.00 72.50 70.50 3a4t s THR 39 CO 0.76 -0.06 1.41 2.22 -0.69 0.00 0.00 174.62 178.26 3a4t n PHE 40 N -0.33 0.00 -4.63 4.92 1.16 -1.26 -4.60 117.46 112.72 3a4t n PHE 40 Ca -0.02 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.22 3a4t n PHE 40 Cb 0.63 -0.30 -0.12 0.00 -1.61 0.00 0.00 39.48 38.08 3a4t n PHE 40 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3a4t s LEU 41 N -2.60 3.06 0.07 5.98 1.43 -1.26 -4.95 118.68 120.41 3a4t s LEU 41 Ca 0.13 -0.12 0.12 0.00 -1.03 0.00 0.00 54.13 53.23 3a4t s LEU 41 Cb 0.10 -1.68 0.55 0.00 0.03 0.00 0.00 46.19 45.18 3a4t s LEU 41 CO 0.23 0.28 1.39 -0.90 0.23 0.00 0.00 176.35 177.57 3a4t n ASP 42 N 2.80 0.16 -0.16 2.29 5.75 -1.26 -2.70 116.55 123.42 3a4t n ASP 42 Ca -0.18 0.55 0.07 0.00 -0.01 0.00 0.00 54.79 55.22 3a4t n ASP 42 Cb 0.53 -0.58 0.12 0.00 -1.03 0.00 0.00 41.12 40.15 3a4t n ASP 42 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3a4t n TYR 43 N -1.69 0.12 -4.74 2.11 0.18 -1.26 -4.80 117.16 107.08 3a4t n TYR 43 Ca 0.02 -0.83 -0.24 0.00 1.88 0.00 0.00 57.90 58.73 3a4t n TYR 43 Cb 0.12 -0.13 -0.15 0.00 -0.38 0.00 0.00 39.34 38.79 3a4t n TYR 43 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3a4t s ALA 44 N -2.28 1.41 0.06 -3.48 0.00 -1.10 0.22 121.76 116.59 3a4t s ALA 44 Ca 0.24 -0.76 0.07 0.00 0.00 0.00 0.00 51.96 51.50 3a4t s ALA 44 Cb 0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 3a4t s ALA 44 CO 0.03 0.33 -0.18 -0.06 0.00 0.00 0.00 175.76 175.89 3a4t s PHE 45 N -0.48 1.58 -0.09 0.00 0.08 -0.51 -3.92 117.98 114.64 3a4t s PHE 45 Ca 0.06 -0.39 -0.23 0.00 0.12 0.00 0.00 56.93 56.49 3a4t s PHE 45 Cb -0.07 -0.92 -0.03 0.00 -0.57 0.00 0.00 43.02 41.43 3a4t s PHE 45 CO -0.00 0.10 0.69 -2.00 -0.10 0.00 0.00 175.22 173.91 3a4t s GLU 46 N -1.42 4.40 -0.33 0.44 2.12 0.20 -0.73 118.70 123.39 3a4t s GLU 46 Ca 0.05 0.83 -0.20 0.00 0.36 0.00 0.00 54.97 56.01 3a4t s GLU 46 Cb -0.09 -3.47 -0.00 0.00 0.26 0.00 0.00 34.13 30.83 3a4t s GLU 46 CO 0.02 0.02 0.62 0.08 -0.54 0.00 0.00 175.26 175.46 3a4t s VAL 47 N 0.98 4.92 -0.22 3.70 1.01 -0.04 0.33 120.40 131.09 3a4t s VAL 47 Ca 0.36 0.72 -0.07 0.00 0.00 0.00 0.00 61.98 62.99 3a4t s VAL 47 Cb -0.17 -4.03 -0.19 0.00 0.00 0.00 0.00 36.38 32.00 3a4t s VAL 47 CO 0.16 -0.21 -0.04 0.29 0.00 0.00 0.00 175.10 175.31 3a4t n LYS 48 N 5.93 0.66 -3.74 2.72 4.76 -0.14 -4.41 118.16 123.94 3a4t n LYS 48 Ca -0.01 0.26 -0.13 0.00 -2.87 0.00 0.00 58.31 55.55 3a4t n LYS 48 Cb 0.49 -1.59 -0.08 0.00 -1.84 0.00 0.00 35.03 32.00 3a4t n LYS 48 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 3a4t s LYS 49 N -2.51 0.72 -0.14 1.97 0.00 -1.15 -4.98 119.74 113.66 3a4t s LYS 49 Ca -0.32 -0.19 -0.05 0.00 0.00 0.00 0.00 55.97 55.41 3a4t s LYS 49 Cb 0.09 0.32 0.07 0.00 0.00 0.00 0.00 37.83 38.31 3a4t s LYS 49 CO 0.62 -0.21 0.28 0.45 0.00 0.00 0.00 175.35 176.49 3a4t s SER 50 N -1.41 0.32 0.00 0.03 0.15 -1.26 0.04 113.70 111.56 3a4t s SER 50 Ca -0.12 0.61 0.13 0.00 0.70 0.00 0.00 55.95 57.26 3a4t s SER 50 Cb -0.04 0.76 0.65 0.00 -1.71 0.00 0.00 66.02 65.67 3a4t s SER 50 CO 0.04 -0.24 1.32 -0.81 1.20 0.00 0.00 173.24 174.74 3a4t n PRO 51 N 5.35 0.19 -4.68 5.44 -0.04 -1.26 -4.76 135.00 135.24 3a4t n PRO 51 Ca -0.06 0.16 -0.34 0.00 -0.04 0.00 0.00 63.50 63.22 3a4t n PRO 51 Cb 0.50 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.34 3a4t n PRO 51 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3a4t s PHE 52 N -2.55 2.89 -0.07 0.54 0.08 -1.26 -5.08 117.98 112.53 3a4t s PHE 52 Ca 0.12 -0.03 -0.35 0.00 0.12 0.00 0.00 56.93 56.80 3a4t s PHE 52 Cb 0.09 -1.70 -0.12 0.00 -0.57 0.00 0.00 43.02 40.71 3a4t s PHE 52 CO 0.19 0.29 1.82 0.43 -0.10 0.00 0.00 175.22 177.85 3a4t n SER 53 N 2.28 3.27 0.24 1.36 7.64 -1.26 -4.86 113.62 122.28 3a4t n SER 53 Ca -0.18 1.00 0.13 0.00 1.01 0.00 0.00 58.87 60.84 3a4t n SER 53 Cb 0.53 -1.36 0.42 0.00 -1.01 0.00 0.00 64.21 62.79 3a4t n SER 53 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 3a4t h ILE 54 N 5.13 0.14 -0.11 0.44 3.07 -1.98 0.15 117.51 124.35 3a4t h ILE 54 Ca -0.48 -0.89 0.00 0.00 1.55 0.00 0.00 64.86 65.04 3a4t h ILE 54 Cb 1.27 1.79 0.00 0.00 -0.27 0.00 0.00 36.82 39.61 3a4t h ILE 54 CO 0.94 0.06 0.00 0.61 -1.05 0.00 0.00 178.15 178.71 3a4t n GLY 55 N 0.53 1.64 0.00 0.16 0.00 -1.26 -4.30 105.19 101.96 3a4t n GLY 55 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3a4t n GLY 55 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3a4t n SER 56 N 0.10 1.07 -4.91 1.61 7.64 0.51 -4.87 113.62 114.78 3a4t n SER 56 Ca 0.05 -1.55 -0.28 0.00 1.01 0.00 0.00 58.87 58.10 3a4t n SER 56 Cb 0.41 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.57 3a4t n SER 56 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3a4t s THR 57 N -0.55 5.00 0.26 0.44 -4.23 -1.25 -4.95 115.64 110.35 3a4t s THR 57 Ca 0.00 0.07 -0.02 0.00 -1.18 0.00 0.00 61.69 60.56 3a4t s THR 57 Cb 0.00 -3.76 0.24 0.00 1.34 0.00 0.00 72.50 70.32 3a4t s THR 57 CO 0.00 -0.41 1.74 -0.65 -0.54 0.00 0.00 174.62 174.76 3a4t h PRO 58 N 1.42 0.52 -0.49 3.99 0.11 -1.98 -2.21 132.00 133.36 3a4t h PRO 58 Ca -0.48 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 65.70 3a4t h PRO 58 Cb 1.19 -0.12 -0.09 0.00 0.11 0.00 0.00 31.00 32.09 3a4t h PRO 58 CO 0.65 0.34 -0.14 0.93 -0.21 0.00 0.00 178.00 179.57 3a4t h GLU 59 N 0.53 -0.02 0.17 1.05 3.07 -1.97 0.22 114.58 117.63 3a4t h GLU 59 Ca 0.45 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 59.33 3a4t h GLU 59 Cb 0.68 0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.57 3a4t h GLU 59 CO -0.39 -0.02 -0.31 -0.92 -1.40 0.00 0.00 179.01 175.97 3a4t h TYR 60 N -0.03 -0.83 -0.90 4.33 5.03 -1.78 -0.98 116.97 121.82 3a4t h TYR 60 Ca 0.23 0.01 0.18 0.00 2.58 0.00 0.00 58.73 61.74 3a4t h TYR 60 Cb 0.38 0.34 -0.07 0.00 1.55 0.00 0.00 36.73 38.93 3a4t h TYR 60 CO -0.43 -0.42 0.59 -0.07 -1.32 0.00 0.00 178.16 176.50 3a4t h LEU 61 N -0.56 0.53 0.00 2.82 4.07 -0.90 0.33 115.31 121.60 3a4t h LEU 61 Ca 0.02 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.02 3a4t h LEU 61 Cb 0.57 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.25 3a4t h LEU 61 CO -0.14 0.23 0.00 0.49 -1.08 0.00 0.00 178.44 177.93 3a4t n PHE 62 N -4.55 0.00 -0.70 1.13 3.72 0.72 -4.92 117.46 112.85 3a4t n PHE 62 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 3a4t n PHE 62 Cb 0.60 -0.48 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 3a4t n PHE 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a4t n GLY 63 N 0.33 0.59 0.23 1.37 0.00 0.12 -4.86 105.19 102.97 3a4t n GLY 63 Ca 0.05 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.62 3a4t n GLY 63 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3a4t h TYR 64 N 0.00 0.00 -2.68 1.61 0.05 -1.32 -3.42 116.97 111.21 3a4t h TYR 64 Ca 0.00 0.00 0.10 0.00 0.05 0.00 0.00 58.73 58.88 3a4t h TYR 64 Cb 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 37.66 3a4t h TYR 64 CO 0.00 0.18 0.35 1.52 -1.05 0.00 0.00 178.16 179.16 3a4t s TYR 65 N -3.54 -0.22 -0.19 4.88 1.13 -1.26 -1.35 117.35 116.79 3a4t s TYR 65 Ca 0.02 -0.12 0.01 0.00 -1.41 0.00 0.00 57.07 55.57 3a4t s TYR 65 Cb 0.09 0.65 0.03 0.00 -1.10 0.00 0.00 41.96 41.63 3a4t s TYR 65 CO 0.63 -0.97 -0.15 1.41 -2.51 0.00 0.00 175.55 173.96 3a4t s MET 66 N -3.58 2.49 0.28 -3.49 -2.45 -0.31 -4.71 119.30 107.53 3a4t s MET 66 Ca 0.10 -0.83 -0.29 0.00 -1.25 0.00 0.00 55.69 53.41 3a4t s MET 66 Cb -0.03 -2.46 -0.10 0.00 1.25 0.00 0.00 34.83 33.49 3a4t s MET 66 CO 0.01 -0.32 1.32 -2.14 1.05 0.00 0.00 175.02 174.95 3a4t s PRO 67 N 1.34 4.37 -0.26 4.11 0.02 -1.26 0.01 135.00 143.32 3a4t s PRO 67 Ca 0.02 2.17 -0.34 0.00 0.02 0.00 0.00 61.00 62.86 3a4t s PRO 67 Cb -0.15 -3.12 0.17 0.00 0.02 0.00 0.00 34.50 31.42 3a4t s PRO 67 CO -0.10 -0.22 1.33 1.14 -0.33 0.00 0.00 177.00 178.81 3a4t s GLN 68 N -1.07 0.11 0.67 5.54 -2.07 -1.06 -4.93 119.66 116.85 3a4t s GLN 68 Ca 0.53 -0.02 -0.17 0.00 -1.82 0.00 0.00 55.36 53.88 3a4t s GLN 68 Cb -0.39 0.05 0.00 0.00 -1.09 0.00 0.00 33.01 31.59 3a4t s GLN 68 CO 0.47 -0.04 1.21 -1.54 -1.32 0.00 0.00 175.29 174.06 3a4t s SER 69 N -1.63 4.67 0.51 12.60 1.04 -1.26 -3.87 113.70 125.75 3a4t s SER 69 Ca 0.10 2.36 0.29 0.00 0.48 0.00 0.00 55.95 59.19 3a4t s SER 69 Cb -0.01 -2.59 1.26 0.00 0.10 0.00 0.00 66.02 64.77 3a4t s SER 69 CO -0.05 -1.95 1.95 -0.29 0.98 0.00 0.00 173.24 173.89 3a4t h ILE 70 N 0.24 0.30 -0.76 -1.02 2.10 -1.94 -2.72 117.51 113.70 3a4t h ILE 70 Ca -0.49 -0.73 -0.05 0.00 1.08 0.00 0.00 64.86 64.67 3a4t h ILE 70 Cb 1.30 1.56 -0.03 0.00 -1.09 0.00 0.00 36.82 38.56 3a4t h ILE 70 CO 0.52 0.10 0.28 0.28 -1.08 0.00 0.00 178.15 178.26 3a4t h SER 71 N 0.00 1.07 1.15 2.19 0.02 -1.90 -1.91 113.55 114.16 3a4t h SER 71 Ca -0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3a4t h SER 71 Cb 0.55 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.82 3a4t h SER 71 CO 0.01 0.96 0.00 -1.54 -1.14 0.00 0.00 176.83 175.12 3a4t n SER 72 N -4.27 0.46 0.05 3.07 3.41 -1.03 -2.61 113.62 112.71 3a4t n SER 72 Ca 0.07 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.36 3a4t n SER 72 Cb 0.20 -0.68 0.45 0.00 -0.26 0.00 0.00 64.21 63.93 3a4t n SER 72 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3a4t n MET 73 N -1.95 0.15 -0.05 4.33 2.00 -0.72 -4.33 117.12 116.55 3a4t n MET 73 Ca 0.05 0.10 -0.12 0.00 0.00 0.00 0.00 57.70 57.73 3a4t n MET 73 Cb 0.36 -1.65 -0.07 0.00 0.00 0.00 0.00 33.22 31.85 3a4t n MET 73 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 3a4t h ILE 74 N 0.00 1.31 -0.51 2.02 2.04 -1.57 -3.28 117.51 117.52 3a4t h ILE 74 Ca 0.00 -1.06 0.08 0.00 1.00 0.00 0.00 64.86 64.88 3a4t h ILE 74 Cb 0.63 1.74 -0.07 0.00 -0.74 0.00 0.00 36.82 38.38 3a4t h ILE 74 CO 0.00 0.31 0.12 -0.65 0.00 0.00 0.00 178.15 177.93 3a4t h PRO 75 N -0.06 0.26 -0.28 2.37 0.11 -1.76 -0.67 132.00 131.97 3a4t h PRO 75 Ca 0.03 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 3a4t h PRO 75 Cb 0.51 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 3a4t h PRO 75 CO 0.02 0.17 0.13 -1.35 -0.21 0.00 0.00 178.00 176.76 3a4t h PRO 76 N 0.27 0.38 -0.24 1.05 0.11 -1.84 -1.48 132.00 130.25 3a4t h PRO 76 Ca 0.25 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.28 3a4t h PRO 76 Cb 0.33 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 3a4t h PRO 76 CO -0.31 0.30 -0.02 0.82 -0.21 0.00 0.00 178.00 178.58 3a4t h ILE 77 N 0.38 1.27 -0.85 4.15 2.04 -1.28 0.16 117.51 123.39 3a4t h ILE 77 Ca 0.10 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 3a4t h ILE 77 Cb 0.05 1.42 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 3a4t h ILE 77 CO -0.01 0.30 0.43 0.58 0.00 0.00 0.00 178.15 179.45 3a4t h VAL 78 N 0.20 1.26 -0.37 1.67 2.07 -1.03 -2.93 116.25 117.11 3a4t h VAL 78 Ca 0.07 -0.68 -0.14 0.00 0.82 0.00 0.00 66.70 66.77 3a4t h VAL 78 Cb 0.46 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3a4t h VAL 78 CO 0.02 0.30 -0.31 0.25 0.02 0.00 0.00 177.57 177.84 3a4t h LEU 79 N 1.19 0.85 -2.81 2.57 5.85 -1.10 -3.48 115.31 118.39 3a4t h LEU 79 Ca 0.29 -0.35 -0.28 0.00 0.84 0.00 0.00 57.88 58.39 3a4t h LEU 79 Cb 0.08 -0.24 0.10 0.00 0.37 0.00 0.00 40.66 40.97 3a4t h LEU 79 CO -0.04 1.09 -0.71 -3.20 -0.34 0.00 0.00 178.44 175.24 3a4t n ASN 80 N -4.08 -6.32 -4.77 1.25 5.15 0.56 -4.92 115.26 102.14 3a4t n ASN 80 Ca -0.01 -0.70 -0.39 0.00 -0.60 0.00 0.00 54.58 52.88 3a4t n ASN 80 Cb 0.49 -4.31 -0.01 0.00 -0.53 0.00 0.00 39.78 35.42 3a4t n ASN 80 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3a4t s PRO 81 N -4.68 4.01 0.49 1.20 0.04 -1.26 -5.03 135.00 129.76 3a4t s PRO 81 Ca 0.33 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.40 3a4t s PRO 81 Cb -0.08 -2.74 0.00 0.00 0.04 0.00 0.00 34.50 31.72 3a4t s PRO 81 CO 0.80 -0.42 0.73 1.03 0.04 0.00 0.00 177.00 179.17 3a4t s ARG 82 N -2.24 3.01 0.21 4.56 1.81 -1.26 -4.62 118.95 120.42 3a4t s ARG 82 Ca 0.57 -0.39 -0.19 0.00 -1.72 0.00 0.00 55.73 53.99 3a4t s ARG 82 Cb -0.35 -2.49 0.18 0.00 -0.45 0.00 0.00 34.95 31.84 3a4t s ARG 82 CO 0.45 -0.39 1.57 0.93 -0.68 0.00 0.00 175.30 177.19 3a4t h GLU 83 N 0.25 -0.08 -0.42 3.54 5.08 -1.82 -0.94 114.58 120.19 3a4t h GLU 83 Ca -0.46 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3a4t h GLU 83 Cb 1.26 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3a4t h GLU 83 CO 0.58 -0.06 0.00 -0.25 -1.00 0.00 0.00 179.01 178.28 3a4t n ASP 84 N -5.45 2.38 -4.74 1.42 9.92 -1.26 -1.28 116.55 117.53 3a4t n ASP 84 Ca 0.07 -1.97 -0.31 0.00 -0.53 0.00 0.00 54.79 52.05 3a4t n ASP 84 Cb 0.38 -0.28 0.11 0.00 -0.64 0.00 0.00 41.12 40.69 3a4t n ASP 84 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 3a4t s ASP 85 N -1.09 4.09 -0.25 -2.24 1.01 -0.36 -4.50 116.67 113.33 3a4t s ASP 85 Ca 0.31 1.87 -0.07 0.00 0.71 0.00 0.00 52.55 55.37 3a4t s ASP 85 Cb 0.16 -2.50 -0.02 0.00 1.01 0.00 0.00 42.92 41.57 3a4t s ASP 85 CO 0.22 -2.31 0.05 0.12 0.21 0.00 0.00 175.17 173.47 3a4t s PHE 86 N -2.85 3.08 0.00 4.23 5.36 -1.26 -1.15 117.98 125.38 3a4t s PHE 86 Ca 0.62 -0.63 0.05 0.00 -0.96 0.00 0.00 56.93 56.01 3a4t s PHE 86 Cb -0.18 -2.22 -0.01 0.00 -0.34 0.00 0.00 43.02 40.26 3a4t s PHE 86 CO 0.57 -0.44 -0.15 0.42 -1.46 0.00 0.00 175.22 174.15 3a4t s ILE 87 N 1.57 1.21 -0.15 3.12 -1.09 0.51 -1.52 121.20 124.84 3a4t s ILE 87 Ca 0.05 -0.74 -0.02 0.00 -2.23 0.00 0.00 60.65 57.72 3a4t s ILE 87 Cb -0.15 -1.03 -0.02 0.00 -1.58 0.00 0.00 42.46 39.68 3a4t s ILE 87 CO 0.02 0.28 -0.09 -0.22 -1.23 0.00 0.00 174.94 173.70 3a4t s LEU 88 N -0.53 2.91 -0.43 2.97 2.96 -1.14 0.21 118.68 125.62 3a4t s LEU 88 Ca 0.05 -0.28 -0.07 0.00 -0.22 0.00 0.00 54.13 53.62 3a4t s LEU 88 Cb -0.06 -1.69 0.10 0.00 0.50 0.00 0.00 46.19 45.05 3a4t s LEU 88 CO -0.00 0.13 0.27 -0.62 -1.32 0.00 0.00 176.35 174.81 3a4t s ASP 89 N 0.56 5.51 0.20 3.68 3.68 0.81 -0.63 116.67 130.47 3a4t s ASP 89 Ca -0.06 -1.84 -0.06 0.00 2.13 0.00 0.00 52.55 52.72 3a4t s ASP 89 Cb -0.15 -1.93 0.15 0.00 -1.45 0.00 0.00 42.92 39.53 3a4t s ASP 89 CO 0.03 -0.59 1.62 0.24 0.13 0.00 0.00 175.17 176.60 3a4t h MET 90 N 8.29 0.85 -2.75 4.34 2.86 -1.50 -1.36 114.93 125.66 3a4t h MET 90 Ca -0.19 -0.33 -0.60 0.00 -2.06 0.00 0.00 59.70 56.52 3a4t h MET 90 Cb 1.07 -0.05 -0.40 0.00 0.06 0.00 0.00 31.60 32.28 3a4t h MET 90 CO 0.77 0.97 -0.80 0.00 1.06 0.00 0.00 176.91 178.91 3a4t n ALA 92 N 3.06 1.75 -1.78 0.00 0.00 0.11 -4.72 120.51 118.92 3a4t n ALA 92 Ca 0.18 -0.80 -0.36 0.00 0.00 0.00 0.00 53.44 52.47 3a4t n ALA 92 Cb 0.39 -0.73 -0.02 0.00 0.00 0.00 0.00 19.45 19.09 3a4t n ALA 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a4t s ALA 93 N -2.76 2.93 -2.05 0.00 0.00 -1.26 -0.49 121.76 118.13 3a4t s ALA 93 Ca -0.05 0.78 0.25 0.00 0.00 0.00 0.00 51.96 52.94 3a4t s ALA 93 Cb 0.08 -3.32 1.44 0.00 0.00 0.00 0.00 23.12 21.33 3a4t s ALA 93 CO 0.83 -0.48 1.94 -0.35 0.00 0.00 0.00 175.76 177.70 3a4t n PRO 94 N -0.63 1.09 -0.11 0.00 -0.05 -1.26 -4.93 135.00 129.11 3a4t n PRO 94 Ca 0.08 -0.13 0.00 0.00 -0.05 0.00 0.00 63.50 63.40 3a4t n PRO 94 Cb 0.50 -1.40 0.00 0.00 -0.05 0.00 0.00 33.50 32.55 3a4t n PRO 94 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 3a4t n GLY 95 N 0.93 0.81 0.43 0.55 0.00 0.35 -3.56 105.19 104.70 3a4t n GLY 95 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 3a4t n GLY 95 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3a4t h GLY 96 N 0.00 -1.02 1.97 -0.02 0.00 -1.92 -1.88 103.07 100.20 3a4t h GLY 96 Ca 0.00 0.74 -0.14 0.00 0.00 0.00 0.00 47.33 47.94 3a4t h GLY 96 CO 0.00 -0.11 -0.63 0.50 0.00 0.00 0.00 176.54 176.29 3a4t h LYS 97 N -0.31 0.03 -0.70 4.80 1.57 -1.87 -2.86 116.57 117.23 3a4t h LYS 97 Ca 0.09 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 3a4t h LYS 97 Cb 0.54 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 3a4t h LYS 97 CO -0.64 0.65 0.33 1.15 -0.57 0.00 0.00 179.45 180.37 3a4t h THR 98 N 0.02 1.23 0.00 -0.16 2.02 -1.79 -0.48 112.91 113.76 3a4t h THR 98 Ca -0.01 -0.67 -0.08 0.00 0.77 0.00 0.00 66.41 66.43 3a4t h THR 98 Cb 1.12 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 3a4t h THR 98 CO 0.08 0.28 -0.38 0.71 0.37 0.00 0.00 175.52 176.58 3a4t h THR 99 N 0.98 0.75 0.18 3.16 1.35 -1.37 -1.81 112.91 116.15 3a4t h THR 99 Ca 0.24 -1.75 -0.01 0.00 -0.55 0.00 0.00 66.41 64.34 3a4t h THR 99 Cb 0.13 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 3a4t h THR 99 CO -0.03 0.38 -0.09 -0.74 -0.25 0.00 0.00 175.52 174.79 3a4t h HIS 100 N 0.00 -0.23 -0.64 4.73 6.17 -1.24 -1.37 115.15 122.56 3a4t h HIS 100 Ca -0.00 -0.01 0.09 0.00 0.71 0.00 0.00 60.37 61.16 3a4t h HIS 100 Cb 1.11 0.08 -0.07 0.00 2.52 0.00 0.00 27.41 31.05 3a4t h HIS 100 CO 0.00 0.15 0.27 -0.07 0.71 0.00 0.00 177.93 179.00 3a4t h LEU 101 N -0.68 0.32 -0.59 0.26 3.38 -1.01 -1.07 115.31 115.91 3a4t h LEU 101 Ca -0.03 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.05 3a4t h LEU 101 Cb 0.49 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 3a4t h LEU 101 CO 0.04 0.19 0.35 0.00 0.09 0.00 0.00 178.44 179.11 3a4t h ALA 102 N 1.41 0.77 -0.63 1.53 0.00 -1.28 -1.12 119.26 119.93 3a4t h ALA 102 Ca 0.32 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 3a4t h ALA 102 Cb 0.36 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3a4t h ALA 102 CO -0.28 0.07 0.38 0.37 0.00 0.00 0.00 179.25 179.78 3a4t h GLN 103 N 0.69 0.86 0.00 0.00 4.15 -0.63 0.47 115.11 120.65 3a4t h GLN 103 Ca 0.24 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.55 3a4t h GLN 103 Cb 0.05 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 3a4t h GLN 103 CO -0.11 0.62 -0.17 -0.07 -1.93 0.00 0.00 178.83 177.17 3a4t h LEU 104 N 0.86 0.00 -1.44 -2.39 3.38 -0.96 -1.81 115.31 112.95 3a4t h LEU 104 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3a4t h LEU 104 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3a4t h LEU 104 CO -0.04 0.17 0.00 0.23 0.09 0.00 0.00 178.44 178.89 3a4t n MET 105 N -4.27 1.99 -2.29 1.13 2.81 -0.45 -4.64 117.12 111.41 3a4t n MET 105 Ca -0.02 -1.44 -0.16 0.00 -1.81 0.00 0.00 57.70 54.27 3a4t n MET 105 Cb 0.24 -1.47 -0.02 0.00 -0.71 0.00 0.00 33.22 31.26 3a4t n MET 105 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3a4t n LYS 106 N 0.75 -1.90 -1.06 0.03 5.02 -0.03 -1.98 118.16 118.98 3a4t n LYS 106 Ca 0.17 0.80 -0.02 0.00 -2.02 0.00 0.00 58.31 57.24 3a4t n LYS 106 Cb 0.47 -5.38 -0.01 0.00 -0.02 0.00 0.00 35.03 30.09 3a4t n LYS 106 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3a4t n ASN 107 N -1.75 -3.65 -3.61 4.39 3.02 -0.15 -5.00 115.26 108.51 3a4t n ASN 107 Ca -0.19 0.05 -0.15 0.00 -0.03 0.00 0.00 54.58 54.27 3a4t n ASN 107 Cb 0.63 -1.35 0.08 0.00 -0.61 0.00 0.00 39.78 38.53 3a4t n ASN 107 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3a4t n LYS 108 N -2.42 0.16 0.00 3.52 4.76 -0.84 -4.21 118.16 119.13 3a4t n LYS 108 Ca -0.02 -1.72 0.00 0.00 -2.87 0.00 0.00 58.31 53.69 3a4t n LYS 108 Cb 0.14 -0.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.91 3a4t n LYS 108 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3a4t n GLY 109 N 0.14 1.15 3.18 0.72 0.00 -0.41 -4.80 105.19 105.17 3a4t n GLY 109 Ca 0.10 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.44 3a4t n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a4t s THR 110 N 0.00 -0.01 -0.12 2.61 2.01 -0.30 -4.73 115.64 115.10 3a4t s THR 110 Ca 0.00 0.04 0.02 0.00 0.31 0.00 0.00 61.69 62.07 3a4t s THR 110 Cb 0.00 -0.45 -0.00 0.00 0.01 0.00 0.00 72.50 72.06 3a4t s THR 110 CO 0.00 0.02 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.12 3a4t s ILE 111 N 0.57 2.34 -0.33 1.82 1.01 0.16 -0.36 121.20 126.40 3a4t s ILE 111 Ca -0.03 -0.91 -0.12 0.00 0.00 0.00 0.00 60.65 59.59 3a4t s ILE 111 Cb -0.05 -1.93 -0.02 0.00 0.01 0.00 0.00 42.46 40.47 3a4t s ILE 111 CO -0.03 0.54 0.23 -0.69 0.00 0.00 0.00 174.94 174.99 3a4t s VAL 112 N 0.50 5.27 -0.27 2.92 1.01 0.13 -0.28 120.40 129.68 3a4t s VAL 112 Ca -0.13 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 61.64 3a4t s VAL 112 Cb -0.17 -3.67 0.01 0.00 0.00 0.00 0.00 36.38 32.55 3a4t s VAL 112 CO 0.05 0.04 0.04 0.00 0.00 0.00 0.00 175.10 175.22 3a4t s ALA 113 N 1.73 2.97 -0.07 5.51 0.00 -0.54 -0.13 121.76 131.23 3a4t s ALA 113 Ca 0.06 -1.40 0.03 0.00 0.00 0.00 0.00 51.96 50.66 3a4t s ALA 113 Cb -0.17 -2.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 3a4t s ALA 113 CO 0.10 -0.81 -0.16 0.08 0.00 0.00 0.00 175.76 174.98 3a4t s VAL 114 N 1.47 2.88 -0.14 0.00 1.01 -0.51 -0.38 120.40 124.72 3a4t s VAL 114 Ca 0.03 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.19 3a4t s VAL 114 Cb -0.17 -2.13 0.07 0.00 0.00 0.00 0.00 36.38 34.15 3a4t s VAL 114 CO 0.00 0.57 0.28 -0.70 0.00 0.00 0.00 175.10 175.26 3a4t s GLU 115 N -0.40 0.17 0.25 2.72 2.56 -0.79 0.05 118.70 123.26 3a4t s GLU 115 Ca 0.04 0.75 -0.04 0.00 0.00 0.00 0.00 54.97 55.72 3a4t s GLU 115 Cb -0.12 -0.06 0.30 0.00 2.00 0.00 0.00 34.13 36.25 3a4t s GLU 115 CO 0.02 -0.31 1.82 0.97 -0.56 0.00 0.00 175.26 177.20 3a4t h ILE 116 N 6.27 1.24 -3.31 -3.70 2.10 -1.83 -1.67 117.51 116.62 3a4t h ILE 116 Ca -0.15 -0.78 -0.56 0.00 1.08 0.00 0.00 64.86 64.45 3a4t h ILE 116 Cb 1.12 0.45 -0.04 0.00 -1.09 0.00 0.00 36.82 37.26 3a4t h ILE 116 CO 0.14 0.31 0.01 -0.55 -1.08 0.00 0.00 178.15 176.98 3a4t s SER 117 N -6.46 7.10 -0.04 2.19 0.15 -1.26 -4.53 113.70 110.84 3a4t s SER 117 Ca -0.11 1.33 -0.24 0.00 0.70 0.00 0.00 55.95 57.63 3a4t s SER 117 Cb 0.16 -2.38 -0.23 0.00 -1.71 0.00 0.00 66.02 61.85 3a4t s SER 117 CO 0.82 0.24 1.04 0.50 1.20 0.00 0.00 173.24 177.03 3a4t h LYS 118 N 4.35 0.20 0.02 5.44 3.64 -1.98 -1.86 116.57 126.39 3a4t h LYS 118 Ca -0.49 -0.22 0.03 0.00 -1.27 0.00 0.00 60.65 58.70 3a4t h LYS 118 Cb 1.21 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 33.05 3a4t h LYS 118 CO 0.64 0.94 -0.20 1.15 -2.27 0.00 0.00 179.45 179.71 3a4t h THR 119 N -0.45 0.53 0.00 1.00 2.02 -1.99 -2.32 112.91 111.70 3a4t h THR 119 Ca -0.04 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 3a4t h THR 119 Cb 1.04 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 3a4t h THR 119 CO 0.06 0.00 -0.17 0.03 0.37 0.00 0.00 175.52 175.81 3a4t h ARG 120 N -0.33 0.00 -0.78 6.66 3.08 -1.98 -1.83 114.38 119.19 3a4t h ARG 120 Ca 0.05 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.11 3a4t h ARG 120 Cb 0.40 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.41 3a4t h ARG 120 CO -0.17 0.17 0.52 1.15 -1.07 0.00 0.00 179.97 180.56 3a4t h THR 121 N 0.00 1.19 -0.35 2.04 2.02 -0.78 -1.59 112.91 115.43 3a4t h THR 121 Ca -0.00 -0.36 0.08 0.00 0.77 0.00 0.00 66.41 66.90 3a4t h THR 121 Cb 0.32 0.05 -0.08 0.00 -1.74 0.00 0.00 68.15 66.70 3a4t h THR 121 CO 0.02 0.19 -0.24 0.11 0.37 0.00 0.00 175.52 175.97 3a4t h LYS 122 N 1.05 -0.18 -0.52 6.66 1.57 -1.03 -0.84 116.57 123.27 3a4t h LYS 122 Ca 0.29 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.05 3a4t h LYS 122 Cb -0.10 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 3a4t h LYS 122 CO -0.07 -0.12 0.21 0.00 -0.57 0.00 0.00 179.45 178.90 3a4t h ALA 123 N 0.96 0.68 -0.11 3.86 0.00 -1.43 -0.63 119.26 122.59 3a4t h ALA 123 Ca 0.17 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.96 3a4t h ALA 123 Cb 0.47 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3a4t h ALA 123 CO -0.47 0.29 -0.14 1.25 0.00 0.00 0.00 179.25 180.19 3a4t h LEU 124 N 0.71 -0.43 -0.08 0.00 6.46 -1.08 0.43 115.31 121.32 3a4t h LEU 124 Ca 0.17 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 58.02 3a4t h LEU 124 Cb 0.20 0.21 -0.00 0.00 -0.73 0.00 0.00 40.66 40.33 3a4t h LEU 124 CO -0.01 -0.19 0.05 0.50 -0.62 0.00 0.00 178.44 178.17 3a4t h LYS 125 N -0.18 0.11 -0.44 1.25 3.64 -1.08 -2.01 116.57 117.85 3a4t h LYS 125 Ca 0.09 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.53 3a4t h LYS 125 Cb 0.30 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.01 3a4t h LYS 125 CO -0.22 0.09 -0.43 1.03 -2.27 0.00 0.00 179.45 177.65 3a4t h SER 126 N 0.09 -1.44 -0.77 4.20 0.87 -0.94 -0.82 113.55 114.74 3a4t h SER 126 Ca 0.03 0.22 0.14 0.00 -1.23 0.00 0.00 61.79 60.95 3a4t h SER 126 Cb 0.01 0.63 -0.09 0.00 -0.44 0.00 0.00 62.40 62.51 3a4t h SER 126 CO -0.01 -0.36 0.34 0.78 -0.53 0.00 0.00 176.83 177.05 3a4t h ASN 127 N -0.30 0.36 0.11 6.23 -0.26 -0.77 0.29 115.58 121.23 3a4t h ASN 127 Ca 0.15 0.10 -0.01 0.00 -0.56 0.00 0.00 56.30 55.98 3a4t h ASN 127 Cb 0.58 0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.90 3a4t h ASN 127 CO -0.60 0.15 -0.05 0.40 -1.06 0.00 0.00 177.43 176.26 3a4t h ILE 128 N 0.50 1.01 -0.36 2.81 2.04 -1.13 0.87 117.51 123.25 3a4t h ILE 128 Ca 0.42 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.80 3a4t h ILE 128 Cb 0.61 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 3a4t h ILE 128 CO -0.38 0.12 0.23 0.78 0.00 0.00 0.00 178.15 178.90 3a4t h ASN 129 N -0.38 0.39 -0.29 1.72 2.35 -1.00 0.23 115.58 118.60 3a4t h ASN 129 Ca -0.02 -0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.76 3a4t h ASN 129 Cb 0.31 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.56 3a4t h ASN 129 CO 0.03 0.28 0.11 -0.09 -1.65 0.00 0.00 177.43 176.11 3a4t h ARG 130 N 0.47 0.24 0.00 0.81 2.43 -0.32 -2.45 114.38 115.56 3a4t h ARG 130 Ca 0.14 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3a4t h ARG 130 Cb -0.03 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 3a4t h ARG 130 CO -0.04 0.16 0.00 -1.33 -1.51 0.00 0.00 179.97 177.25 3a4t n MET 131 N -5.01 0.81 -2.54 0.20 2.81 0.29 -3.64 117.12 110.04 3a4t n MET 131 Ca -0.01 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.67 3a4t n MET 131 Cb 0.09 -1.12 -0.00 0.00 -0.71 0.00 0.00 33.22 31.48 3a4t n MET 131 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a4t n GLY 132 N 0.38 -0.51 3.73 3.03 0.00 -0.92 -4.82 105.19 106.08 3a4t n GLY 132 Ca 0.05 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3a4t n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a4t s VAL 133 N -3.06 4.68 -0.07 1.61 1.01 0.78 -4.96 120.40 120.39 3a4t s VAL 133 Ca 0.07 1.95 0.02 0.00 0.00 0.00 0.00 61.98 64.01 3a4t s VAL 133 Cb -0.03 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 3a4t s VAL 133 CO 0.08 0.28 0.08 0.18 0.00 0.00 0.00 175.10 175.72 3a4t n LEU 134 N 3.17 0.07 -1.85 3.92 4.77 -1.26 -4.68 117.00 121.14 3a4t n LEU 134 Ca 0.02 -0.37 -0.07 0.00 -0.03 0.00 0.00 56.01 55.56 3a4t n LEU 134 Cb 0.50 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.83 3a4t n LEU 134 CO 0.50 0.02 0.97 -0.46 -1.33 0.00 0.00 177.39 177.09 3a4t n ASN 135 N -1.18 4.27 -4.03 -1.43 6.94 -1.26 -4.95 115.26 113.62 3a4t n ASN 135 Ca 0.00 -3.06 -0.23 0.00 -0.02 0.00 0.00 54.58 51.27 3a4t n ASN 135 Cb 0.04 -0.72 -0.16 0.00 -2.36 0.00 0.00 39.78 36.58 3a4t n ASN 135 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 3a4t s THR 136 N -2.60 1.06 -0.29 5.53 2.01 -1.26 0.35 115.64 120.44 3a4t s THR 136 Ca 0.46 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.94 3a4t s THR 136 Cb 0.37 -0.95 0.01 0.00 0.01 0.00 0.00 72.50 71.95 3a4t s THR 136 CO 0.11 0.33 0.05 -0.63 -0.69 0.00 0.00 174.62 173.79 3a4t s ILE 137 N 0.44 3.69 -0.22 1.82 1.01 0.62 -4.96 121.20 123.60 3a4t s ILE 137 Ca -0.09 -0.80 -0.20 0.00 0.00 0.00 0.00 60.65 59.56 3a4t s ILE 137 Cb -0.13 -2.90 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 3a4t s ILE 137 CO 0.02 0.10 0.58 -0.63 0.00 0.00 0.00 174.94 175.01 3a4t s ILE 138 N 1.45 5.04 -0.25 2.92 1.01 -1.26 -1.46 121.20 128.65 3a4t s ILE 138 Ca 0.02 1.07 -0.05 0.00 0.00 0.00 0.00 60.65 61.69 3a4t s ILE 138 Cb -0.17 -3.90 0.00 0.00 0.01 0.00 0.00 42.46 38.40 3a4t s ILE 138 CO 0.01 0.10 -0.00 -0.63 0.00 0.00 0.00 174.94 174.42 3a4t s ILE 139 N 2.05 3.53 -0.81 2.92 -1.09 0.48 -4.98 121.20 123.30 3a4t s ILE 139 Ca 0.26 -0.62 -0.21 0.00 -2.23 0.00 0.00 60.65 57.85 3a4t s ILE 139 Cb -0.16 -2.71 0.09 0.00 -1.58 0.00 0.00 42.46 38.11 3a4t s ILE 139 CO 0.09 0.28 1.09 0.21 -1.23 0.00 0.00 174.94 175.38 3a4t s ASN 140 N 1.47 6.39 0.17 3.58 2.47 -1.26 -1.89 114.94 125.86 3a4t s ASN 140 Ca 0.04 -1.45 -0.21 0.00 0.42 0.00 0.00 52.86 51.65 3a4t s ASN 140 Cb -0.16 -2.43 0.06 0.00 -1.45 0.00 0.00 41.25 37.27 3a4t s ASN 140 CO -0.01 -1.31 0.57 0.00 -3.72 0.00 0.00 177.10 172.63 3a4t s ALA 141 N 3.64 -1.42 -0.43 1.71 0.00 -0.63 -4.95 121.76 119.69 3a4t s ALA 141 Ca 0.29 0.30 -0.29 0.00 0.00 0.00 0.00 51.96 52.26 3a4t s ALA 141 Cb -0.10 0.85 0.01 0.00 0.00 0.00 0.00 23.12 23.89 3a4t s ALA 141 CO 0.00 -0.77 1.35 0.34 0.00 0.00 0.00 175.76 176.68 3a4t s ASP 142 N -2.78 6.40 0.35 0.00 -1.08 -1.26 -2.79 116.67 115.51 3a4t s ASP 142 Ca 0.03 0.74 0.16 0.00 -0.52 0.00 0.00 52.55 52.95 3a4t s ASP 142 Cb -0.01 -2.54 1.15 0.00 -1.46 0.00 0.00 42.92 40.06 3a4t s ASP 142 CO -0.11 -1.40 1.63 0.24 0.52 0.00 0.00 175.17 176.06 3a4t h MET 143 N 10.38 0.18 0.00 4.34 2.86 -1.94 0.52 114.93 131.27 3a4t h MET 143 Ca -0.26 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.35 3a4t h MET 143 Cb 1.09 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.71 3a4t h MET 143 CO 1.10 0.12 -0.07 0.00 1.06 0.00 0.00 176.91 179.12 3a4t h ARG 144 N 0.19 0.00 0.00 1.72 3.08 -1.98 -0.42 114.38 116.97 3a4t h ARG 144 Ca 0.76 0.00 -0.39 0.00 0.07 0.00 0.00 59.98 60.42 3a4t h ARG 144 Cb 1.83 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.81 3a4t h ARG 144 CO -0.68 0.07 -2.47 1.63 -1.07 0.00 0.00 179.97 177.45 3a4t n LYS 145 N -3.82 0.64 -0.22 0.04 5.02 0.08 -4.49 118.16 115.42 3a4t n LYS 145 Ca -0.02 0.16 0.19 0.00 -2.02 0.00 0.00 58.31 56.61 3a4t n LYS 145 Cb 0.17 -1.51 0.53 0.00 -0.02 0.00 0.00 35.03 34.19 3a4t n LYS 145 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 3a4t h TYR 146 N -0.10 0.49 -0.07 2.13 3.20 0.02 -1.76 116.97 120.88 3a4t h TYR 146 Ca -0.59 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.32 3a4t h TYR 146 Cb 1.86 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.98 3a4t h TYR 146 CO 0.02 0.14 0.05 1.57 -1.64 0.00 0.00 178.16 178.30 3a4t h LYS 147 N 0.38 0.00 -0.33 1.82 5.09 -1.30 -1.49 116.57 120.75 3a4t h LYS 147 Ca 0.44 0.00 -0.06 0.00 0.09 0.00 0.00 60.65 61.12 3a4t h LYS 147 Cb 1.13 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.44 3a4t h LYS 147 CO -0.15 0.00 -0.04 -0.44 -2.09 0.00 0.00 179.45 176.73 3a4t h ASP 148 N 0.00 0.49 -0.02 7.07 3.32 -1.57 0.10 116.42 125.82 3a4t h ASP 148 Ca 0.03 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 3a4t h ASP 148 Cb 0.14 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 3a4t h ASP 148 CO -0.00 0.59 0.00 0.22 -1.72 0.00 0.00 179.24 178.33 3a4t h TYR 149 N 0.49 0.03 -0.47 4.55 3.20 -1.37 -0.07 116.97 123.34 3a4t h TYR 149 Ca 0.10 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.98 3a4t h TYR 149 Cb 0.38 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 3a4t h TYR 149 CO 0.01 0.27 0.30 -0.07 -1.64 0.00 0.00 178.16 177.03 3a4t h LEU 150 N -0.21 0.51 0.18 2.82 3.38 -1.32 -2.46 115.31 118.21 3a4t h LEU 150 Ca 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3a4t h LEU 150 Cb 0.25 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3a4t h LEU 150 CO 0.00 0.37 -0.08 -0.07 0.09 0.00 0.00 178.44 178.74 3a4t h LEU 151 N 0.61 -0.20 -1.41 1.67 3.38 -0.77 0.56 115.31 119.14 3a4t h LEU 151 Ca 0.17 -0.18 0.27 0.00 0.09 0.00 0.00 57.88 58.24 3a4t h LEU 151 Cb -0.05 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.66 3a4t h LEU 151 CO -0.05 0.07 0.67 0.50 0.09 0.00 0.00 178.44 179.72 3a4t h LYS 152 N -0.47 0.36 -0.51 1.13 3.64 -0.98 -0.47 116.57 119.26 3a4t h LYS 152 Ca -0.02 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3a4t h LYS 152 Cb 0.36 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3a4t h LYS 152 CO 0.04 0.24 0.00 0.09 -2.27 0.00 0.00 179.45 177.55 3a4t n ASN 153 N -4.59 3.40 -2.93 4.20 3.02 -0.93 -4.94 115.26 112.48 3a4t n ASN 153 Ca 0.25 -1.97 -0.19 0.00 -0.03 0.00 0.00 54.58 52.63 3a4t n ASN 153 Cb 0.89 -0.34 0.06 0.00 -0.61 0.00 0.00 39.78 39.78 3a4t n ASN 153 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3a4t n GLU 154 N 1.13 -6.11 -3.17 3.52 1.02 -0.19 -4.91 120.64 111.93 3a4t n GLU 154 Ca 0.18 0.68 -0.46 0.00 -0.02 0.00 0.00 57.16 57.54 3a4t n GLU 154 Cb 0.53 -5.24 -0.03 0.00 -0.02 0.00 0.00 31.44 26.68 3a4t n GLU 154 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3a4t s ILE 155 N -3.23 5.18 0.11 -3.67 1.01 0.18 -5.01 121.20 115.78 3a4t s ILE 155 Ca 0.44 -1.86 0.02 0.00 0.00 0.00 0.00 60.65 59.24 3a4t s ILE 155 Cb -0.20 -4.55 -0.04 0.00 0.01 0.00 0.00 42.46 37.69 3a4t s ILE 155 CO 0.55 -1.17 0.24 -0.36 0.00 0.00 0.00 174.94 174.20 3a4t s PHE 156 N 1.46 3.48 0.10 3.97 0.08 -1.26 -4.70 117.98 121.11 3a4t s PHE 156 Ca 0.20 0.17 0.07 0.00 0.12 0.00 0.00 56.93 57.49 3a4t s PHE 156 Cb -0.13 -1.70 -0.04 0.00 -0.57 0.00 0.00 43.02 40.58 3a4t s PHE 156 CO -0.05 0.55 -0.13 -0.06 -0.10 0.00 0.00 175.22 175.43 3a4t s PHE 157 N -1.63 2.68 0.07 0.36 0.08 -0.47 -4.80 117.98 114.27 3a4t s PHE 157 Ca 0.34 -0.19 -0.19 0.00 0.12 0.00 0.00 56.93 57.02 3a4t s PHE 157 Cb -0.12 -1.42 -0.10 0.00 -0.57 0.00 0.00 43.02 40.81 3a4t s PHE 157 CO 0.28 0.40 1.45 -0.44 -0.10 0.00 0.00 175.22 176.81 3a4t h ASP 158 N 3.75 0.44 -4.41 1.36 3.45 -1.62 -0.94 116.42 118.46 3a4t h ASP 158 Ca -0.49 -0.39 -0.14 0.00 0.43 0.00 0.00 57.03 56.44 3a4t h ASP 158 Cb 1.17 -0.12 -0.23 0.00 -0.56 0.00 0.00 39.33 39.59 3a4t h ASP 158 CO 0.50 0.73 -0.37 -0.54 -1.57 0.00 0.00 179.24 177.99 3a4t s LYS 159 N -4.68 0.47 -0.05 3.56 1.02 -1.21 -2.34 119.74 116.51 3a4t s LYS 159 Ca -0.14 0.07 0.03 0.00 0.02 0.00 0.00 55.97 55.95 3a4t s LYS 159 Cb 0.07 0.21 0.01 0.00 -0.52 0.00 0.00 37.83 37.60 3a4t s LYS 159 CO 0.76 -0.10 -0.12 0.42 -0.92 0.00 0.00 175.35 175.38 3a4t s ILE 160 N -0.60 1.10 -0.30 2.17 1.01 0.30 -2.87 121.20 122.01 3a4t s ILE 160 Ca -0.07 -0.49 -0.16 0.00 0.00 0.00 0.00 60.65 59.93 3a4t s ILE 160 Cb -0.04 -0.99 -0.02 0.00 0.01 0.00 0.00 42.46 41.42 3a4t s ILE 160 CO 0.02 0.34 0.42 -0.22 0.00 0.00 0.00 174.94 175.49 3a4t s LEU 161 N 0.42 4.20 -1.07 2.97 0.20 0.20 -0.97 118.68 124.63 3a4t s LEU 161 Ca -0.09 0.13 -0.07 0.00 0.69 0.00 0.00 54.13 54.78 3a4t s LEU 161 Cb -0.13 -2.47 0.27 0.00 -0.43 0.00 0.00 46.19 43.43 3a4t s LEU 161 CO 0.02 -0.30 1.04 -0.22 -0.29 0.00 0.00 176.35 176.61 3a4t s LEU 162 N 2.16 6.16 -0.93 -0.68 0.20 0.63 -1.43 118.68 124.80 3a4t s LEU 162 Ca 0.16 -3.64 -0.21 0.00 0.69 0.00 0.00 54.13 51.13 3a4t s LEU 162 Cb -0.16 -2.14 0.10 0.00 -0.43 0.00 0.00 46.19 43.56 3a4t s LEU 162 CO 0.11 -0.26 1.21 -0.62 -0.29 0.00 0.00 176.35 176.50 3a4t s ASP 163 N 0.97 6.54 0.36 3.68 2.15 -1.26 -1.65 116.67 127.46 3a4t s ASP 163 Ca 0.30 -1.73 -0.22 0.00 0.43 0.00 0.00 52.55 51.33 3a4t s ASP 163 Cb -0.09 -2.46 -0.10 0.00 -0.30 0.00 0.00 42.92 39.97 3a4t s ASP 163 CO -0.09 -1.25 0.91 0.00 -0.17 0.00 0.00 175.17 174.57 3a4t s ALA 164 N 3.57 3.17 0.78 3.66 0.00 -0.10 -4.51 121.76 128.32 3a4t s ALA 164 Ca 0.36 0.40 -0.15 0.00 0.00 0.00 0.00 51.96 52.57 3a4t s ALA 164 Cb -0.05 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 19.97 3a4t s ALA 164 CO -0.07 0.18 0.70 -0.35 0.00 0.00 0.00 175.76 176.22 3a4t n PRO 165 N -0.00 0.21 -4.16 0.00 -0.04 -1.26 -4.39 135.00 125.36 3a4t n PRO 165 Ca 0.04 0.12 -0.15 0.00 -0.04 0.00 0.00 63.50 63.47 3a4t n PRO 165 Cb 0.52 -2.01 -0.11 0.00 -0.04 0.00 0.00 33.50 31.86 3a4t n PRO 165 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3a4t n SER 167 N 0.83 0.14 0.26 0.00 3.41 -1.26 -0.46 113.62 116.55 3a4t n SER 167 Ca -0.18 1.42 0.13 0.00 -0.26 0.00 0.00 58.87 59.97 3a4t n SER 167 Cb 0.56 -0.62 0.72 0.00 -0.26 0.00 0.00 64.21 64.61 3a4t n SER 167 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3a4t h GLY 168 N 0.00 0.00 2.00 5.00 0.00 -1.95 -2.28 103.07 105.84 3a4t h GLY 168 Ca 0.64 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.85 3a4t h GLY 168 CO -0.71 0.00 -0.55 3.43 0.00 0.00 0.00 176.54 178.72 3a4t h ASN 169 N 0.00 0.00 0.00 0.19 -0.26 -1.13 -3.54 115.58 110.84 3a4t h ASN 169 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 3a4t h ASN 169 Cb 0.34 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.60 3a4t h ASN 169 CO 0.02 0.55 0.00 -0.38 -1.06 0.00 0.00 177.43 176.55 3a4t n ILE 170 N -3.45 0.00 -0.75 2.81 5.41 -0.86 -5.05 119.36 117.47 3a4t n ILE 170 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.81 3a4t n ILE 170 Cb 0.66 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.56 3a4t n ILE 170 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3a4t n SER 179 N 0.00 -4.04 -0.15 4.38 3.41 -1.26 -4.61 113.62 111.34 3a4t n SER 179 Ca 0.00 0.82 -0.04 0.00 -0.26 0.00 0.00 58.87 59.39 3a4t n SER 179 Cb 0.00 -2.32 0.16 0.00 -0.26 0.00 0.00 64.21 61.79 3a4t n SER 179 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3a4t h GLU 180 N -0.40 0.88 -0.30 4.33 5.08 -2.03 -2.05 114.58 120.09 3a4t h GLU 180 Ca -0.06 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 3a4t h GLU 180 Cb 0.61 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 3a4t h GLU 180 CO 0.02 0.81 0.10 0.93 -1.00 0.00 0.00 179.01 179.87 3a4t h GLU 181 N 0.84 0.46 -0.82 2.33 3.07 -2.05 -1.89 114.58 116.52 3a4t h GLU 181 Ca 0.18 -0.09 0.10 0.00 -0.50 0.00 0.00 59.36 59.05 3a4t h GLU 181 Cb 0.35 -0.07 -0.08 0.00 -0.84 0.00 0.00 28.75 28.11 3a4t h GLU 181 CO 0.00 0.50 0.46 -0.44 -1.40 0.00 0.00 179.01 178.13 3a4t h ASP 182 N 0.33 0.64 -0.20 1.42 3.32 -1.77 0.56 116.42 120.71 3a4t h ASP 182 Ca 0.10 0.06 -0.18 0.00 0.02 0.00 0.00 57.03 57.03 3a4t h ASP 182 Cb 0.23 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3a4t h ASP 182 CO -0.00 0.35 -0.56 0.40 -1.72 0.00 0.00 179.24 177.71 3a4t h ILE 183 N 0.76 1.30 -0.28 0.35 2.04 -1.30 -1.39 117.51 118.99 3a4t h ILE 183 Ca 0.41 -1.77 -0.13 0.00 1.00 0.00 0.00 64.86 64.36 3a4t h ILE 183 Cb 0.41 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 3a4t h ILE 183 CO -0.27 0.56 -0.37 0.50 0.00 0.00 0.00 178.15 178.58 3a4t h LYS 184 N 0.46 0.62 0.04 2.37 1.63 -0.95 -1.79 116.57 118.95 3a4t h LYS 184 Ca -0.01 -0.30 -0.00 0.00 -0.85 0.00 0.00 60.65 59.48 3a4t h LYS 184 Cb 1.17 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.80 3a4t h LYS 184 CO 0.12 0.89 -0.02 -0.92 -3.45 0.00 0.00 179.45 176.08 3a4t h TYR 185 N 0.52 -0.05 -0.58 1.91 3.20 -0.79 -2.77 116.97 118.41 3a4t h TYR 185 Ca 0.05 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3a4t h TYR 185 Cb 0.87 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 39.13 3a4t h TYR 185 CO 0.04 0.32 0.36 0.00 -1.64 0.00 0.00 178.16 177.24 3a4t h SER 187 N 0.79 1.05 -0.16 0.00 0.87 -1.27 -0.45 113.55 114.38 3a4t h SER 187 Ca 0.21 -0.35 -0.01 0.00 -1.23 0.00 0.00 61.79 60.41 3a4t h SER 187 Cb -0.06 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.61 3a4t h SER 187 CO -0.04 1.15 0.06 0.25 -0.53 0.00 0.00 176.83 177.72 3a4t h LEU 188 N 0.93 0.23 -0.19 2.23 5.85 -1.24 -2.25 115.31 120.87 3a4t h LEU 188 Ca 0.14 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.73 3a4t h LEU 188 Cb 0.68 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.62 3a4t h LEU 188 CO 0.05 0.34 -0.04 -0.09 -0.34 0.00 0.00 178.44 178.36 3a4t h ARG 189 N 0.10 0.01 -0.62 1.25 2.43 -1.13 -2.44 114.38 113.99 3a4t h ARG 189 Ca 0.05 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.32 3a4t h ARG 189 Cb 0.19 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 3a4t h ARG 189 CO -0.00 0.01 0.41 1.96 -1.51 0.00 0.00 179.97 180.84 3a4t h GLN 190 N 0.01 0.45 -0.07 0.20 4.20 -1.09 -0.96 115.11 117.85 3a4t h GLN 190 Ca 0.09 -0.03 -0.21 0.00 0.06 0.00 0.00 58.65 58.56 3a4t h GLN 190 Cb 0.14 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3a4t h GLN 190 CO -0.19 0.30 -0.82 0.87 -0.67 0.00 0.00 178.83 178.32 3a4t h LYS 191 N 0.47 0.52 -0.34 1.46 1.57 -1.15 -2.43 116.57 116.66 3a4t h LYS 191 Ca 0.28 -0.47 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 3a4t h LYS 191 Cb 0.50 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 3a4t h LYS 191 CO -0.08 1.10 0.10 0.93 -0.57 0.00 0.00 179.45 180.93 3a4t h GLU 192 N 0.34 0.54 -0.65 3.15 5.08 -0.96 -3.09 114.58 118.99 3a4t h GLU 192 Ca -0.06 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 3a4t h GLU 192 Cb 1.43 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.58 3a4t h GLU 192 CO 0.15 0.58 0.16 -0.07 -1.00 0.00 0.00 179.01 178.83 3a4t h LEU 193 N 0.40 0.98 -0.36 1.33 -0.00 -1.12 -2.58 115.31 113.96 3a4t h LEU 193 Ca 0.11 -0.23 -0.17 0.00 -0.00 0.00 0.00 57.88 57.59 3a4t h LEU 193 Cb 0.27 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 40.66 3a4t h LEU 193 CO -0.00 0.95 -0.46 -0.29 -0.00 0.00 0.00 178.44 178.64 3a4t h ILE 194 N 0.96 1.27 0.06 1.22 2.10 -1.51 0.88 117.51 122.49 3a4t h ILE 194 Ca 0.20 -1.64 -0.00 0.00 1.08 0.00 0.00 64.86 64.50 3a4t h ILE 194 Cb 0.35 1.49 0.00 0.00 -1.09 0.00 0.00 36.82 37.58 3a4t h ILE 194 CO 0.00 0.54 -0.03 -0.78 -1.08 0.00 0.00 178.15 176.80 3a4t h ASP 195 N 0.72 -0.07 -0.96 2.19 1.82 -1.56 -1.20 116.42 117.36 3a4t h ASP 195 Ca 0.04 -0.00 0.19 0.00 -0.39 0.00 0.00 57.03 56.86 3a4t h ASP 195 Cb 1.06 0.02 -0.11 0.00 0.68 0.00 0.00 39.33 40.98 3a4t h ASP 195 CO 0.11 -0.04 0.55 0.40 -1.61 0.00 0.00 179.24 178.64 3a4t h ILE 196 N -0.09 0.67 -0.34 2.25 2.04 -1.14 -1.98 117.51 118.92 3a4t h ILE 196 Ca -0.01 -0.23 -0.16 0.00 1.00 0.00 0.00 64.86 65.45 3a4t h ILE 196 Cb 0.07 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.08 3a4t h ILE 196 CO 0.01 0.12 -0.44 1.23 0.00 0.00 0.00 178.15 179.08 3a4t h GLY 197 N 0.68 0.96 1.01 5.37 0.00 -0.22 -2.14 103.07 108.73 3a4t h GLY 197 Ca 0.56 -1.02 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 3a4t h GLY 197 CO -0.40 0.92 0.35 -2.22 0.00 0.00 0.00 176.54 175.19 3a4t h ILE 198 N 0.70 1.24 -0.68 2.60 2.04 -1.07 -2.55 117.51 119.79 3a4t h ILE 198 Ca 0.05 -0.65 0.05 0.00 1.00 0.00 0.00 64.86 65.30 3a4t h ILE 198 Cb 1.03 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 3a4t h ILE 198 CO 0.10 0.28 0.45 0.44 0.00 0.00 0.00 178.15 179.41 3a4t h ASP 199 N 1.01 0.64 -0.01 1.72 3.32 -0.81 -2.42 116.42 119.87 3a4t h ASP 199 Ca 0.25 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3a4t h ASP 199 Cb 0.11 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3a4t h ASP 199 CO -0.03 0.42 0.00 0.18 -1.72 0.00 0.00 179.24 178.09 3a4t n LEU 200 N -4.47 0.74 -4.79 1.55 4.77 -0.86 -4.90 117.00 109.04 3a4t n LEU 200 Ca 0.09 -0.25 -0.38 0.00 -0.03 0.00 0.00 56.01 55.44 3a4t n LEU 200 Cb 0.19 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 3a4t n LEU 200 CO 0.34 0.12 0.17 -0.22 -1.33 0.00 0.00 177.39 176.48 3a4t s LEU 201 N -1.98 4.42 0.72 2.23 2.96 -0.91 -1.36 118.68 124.76 3a4t s LEU 201 Ca 0.43 1.00 -0.15 0.00 -0.22 0.00 0.00 54.13 55.19 3a4t s LEU 201 Cb 0.21 -2.71 0.04 0.00 0.50 0.00 0.00 46.19 44.23 3a4t s LEU 201 CO 0.35 0.20 1.18 -0.54 -1.32 0.00 0.00 176.35 176.22 3a4t s LYS 202 N -0.52 2.23 0.17 1.98 1.02 -0.36 -4.79 119.74 119.47 3a4t s LYS 202 Ca 0.26 1.65 -0.34 0.00 0.02 0.00 0.00 55.97 57.56 3a4t s LYS 202 Cb -0.17 -1.86 -0.14 0.00 -0.52 0.00 0.00 37.83 35.14 3a4t s LYS 202 CO 0.14 -1.74 1.50 1.17 -0.92 0.00 0.00 175.35 175.50 3a4t n LYS 203 N -2.75 1.97 -0.82 1.68 4.81 -1.26 -0.13 118.16 121.66 3a4t n LYS 203 Ca 0.12 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 3a4t n LYS 203 Cb 0.51 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.13 3a4t n LYS 203 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3a4t n ASP 204 N 2.99 -0.56 -4.90 3.14 8.00 0.30 -4.99 116.55 120.52 3a4t n ASP 204 Ca 0.16 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.38 3a4t n ASP 204 Cb 0.28 -0.09 0.04 0.00 -0.02 0.00 0.00 41.12 41.32 3a4t n ASP 204 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3a4t s GLY 205 N -1.86 1.61 -0.07 0.44 0.00 0.81 -4.74 107.32 103.52 3a4t s GLY 205 Ca 0.00 -0.56 0.04 0.00 0.00 0.00 0.00 44.72 44.20 3a4t s GLY 205 CO 0.00 -0.24 -0.21 -0.54 0.00 0.00 0.00 173.10 172.11 3a4t s GLU 206 N -5.14 2.50 -0.09 2.90 2.02 -0.99 -1.30 118.70 118.61 3a4t s GLU 206 Ca 0.56 -0.77 0.04 0.00 0.02 0.00 0.00 54.97 54.81 3a4t s GLU 206 Cb -0.11 -2.00 -0.01 0.00 0.10 0.00 0.00 34.13 32.11 3a4t s GLU 206 CO 0.48 0.22 -0.20 -1.17 0.02 0.00 0.00 175.26 174.61 3a4t s LEU 207 N 0.21 2.34 -0.25 1.80 0.20 -0.69 -0.54 118.68 121.75 3a4t s LEU 207 Ca -0.12 -0.43 -0.11 0.00 0.69 0.00 0.00 54.13 54.17 3a4t s LEU 207 Cb -0.15 -1.47 -0.05 0.00 -0.43 0.00 0.00 46.19 44.08 3a4t s LEU 207 CO 0.06 0.21 0.17 -0.69 -0.29 0.00 0.00 176.35 175.81 3a4t s VAL 208 N 0.03 5.34 -0.23 1.68 1.01 -0.14 -0.32 120.40 127.78 3a4t s VAL 208 Ca -0.08 0.18 -0.15 0.00 0.00 0.00 0.00 61.98 61.93 3a4t s VAL 208 Cb -0.15 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 3a4t s VAL 208 CO 0.05 0.32 0.39 -0.47 0.00 0.00 0.00 175.10 175.39 3a4t s TYR 209 N 1.25 3.33 0.18 5.22 5.04 0.29 -0.26 117.35 132.40 3a4t s TYR 209 Ca 0.07 0.54 -0.00 0.00 -2.44 0.00 0.00 57.07 55.24 3a4t s TYR 209 Cb -0.14 -2.54 -0.04 0.00 0.35 0.00 0.00 41.96 39.59 3a4t s TYR 209 CO 0.06 -0.09 0.08 -1.54 -1.34 0.00 0.00 175.55 172.72 3a4t s SER 210 N 1.24 0.56 -0.11 4.32 1.04 -0.66 -0.40 113.70 119.70 3a4t s SER 210 Ca 0.17 -1.29 -0.30 0.00 0.48 0.00 0.00 55.95 55.01 3a4t s SER 210 Cb -0.15 0.27 0.11 0.00 0.10 0.00 0.00 66.02 66.35 3a4t s SER 210 CO 0.08 -0.74 0.88 0.28 0.98 0.00 0.00 173.24 174.73 3a4t s THR 211 N -3.97 0.00 -0.19 2.02 -1.32 -0.87 -0.92 115.64 110.38 3a4t s THR 211 Ca 0.31 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 60.79 3a4t s THR 211 Cb 0.07 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 70.20 3a4t s THR 211 CO 0.07 0.00 1.94 0.00 -2.21 0.00 0.00 174.62 174.42 3a4t s SER 213 N 0.79 -0.02 -0.12 0.00 0.15 -1.25 -4.70 113.70 108.55 3a4t s SER 213 Ca 0.19 0.08 0.16 0.00 0.70 0.00 0.00 55.95 57.08 3a4t s SER 213 Cb 0.15 0.06 0.60 0.00 -1.71 0.00 0.00 66.02 65.12 3a4t s SER 213 CO 0.00 -0.04 1.52 1.15 1.20 0.00 0.00 173.24 177.07 3a4t n MET 214 N 3.31 3.49 -2.65 5.44 0.00 -1.26 -3.56 117.12 121.88 3a4t n MET 214 Ca -0.15 -2.75 -0.42 0.00 0.00 0.00 0.00 57.70 54.37 3a4t n MET 214 Cb 0.58 -1.80 -0.03 0.00 0.00 0.00 0.00 33.22 31.97 3a4t n MET 214 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 3a4t s GLU 215 N -2.05 4.50 0.50 3.17 0.41 -1.26 -4.95 118.70 119.02 3a4t s GLU 215 Ca 0.44 1.48 0.19 0.00 -0.41 0.00 0.00 54.97 56.67 3a4t s GLU 215 Cb 0.30 -3.47 1.29 0.00 -1.78 0.00 0.00 34.13 30.47 3a4t s GLU 215 CO 0.18 -0.16 2.10 -0.39 -0.49 0.00 0.00 175.26 176.50 3a4t h VAL 216 N 4.84 0.91 -0.08 2.63 -1.51 -1.97 -0.31 116.25 120.75 3a4t h VAL 216 Ca -0.39 -0.32 0.02 0.00 -1.23 0.00 0.00 66.70 64.79 3a4t h VAL 216 Cb 1.20 1.18 -0.00 0.00 -2.13 0.00 0.00 31.29 31.54 3a4t h VAL 216 CO 0.79 0.09 0.07 -0.33 -1.23 0.00 0.00 177.57 176.96 3a4t h GLU 217 N 0.00 0.00 -0.11 5.19 4.39 -1.94 -1.28 114.58 120.83 3a4t h GLU 217 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3a4t h GLU 217 Cb 0.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 3a4t h GLU 217 CO 0.01 0.00 0.00 0.39 -1.16 0.00 0.00 179.01 178.25 3a4t n GLU 218 N -4.17 2.34 0.00 2.33 1.02 -0.15 -4.24 120.64 117.77 3a4t n GLU 218 Ca -0.01 -1.97 0.00 0.00 -0.02 0.00 0.00 57.16 55.16 3a4t n GLU 218 Cb 0.18 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 3a4t n GLU 218 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3a4t n ASN 219 N 1.34 0.00 0.29 1.62 5.03 -0.55 -4.74 115.26 118.25 3a4t n ASN 219 Ca 0.15 0.00 0.17 0.00 0.87 0.00 0.00 54.58 55.77 3a4t n ASN 219 Cb 0.59 0.00 0.90 0.00 -1.02 0.00 0.00 39.78 40.25 3a4t n ASN 219 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 3a4t h GLU 220 N 0.00 0.00 -0.62 3.52 3.07 -1.81 -2.57 114.58 116.18 3a4t h GLU 220 Ca 0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 3a4t h GLU 220 Cb 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.88 3a4t h GLU 220 CO 0.00 0.05 0.25 0.93 -1.40 0.00 0.00 179.01 178.84 3a4t h GLU 221 N 0.00 0.93 -0.43 2.33 4.39 -1.63 0.11 114.58 120.27 3a4t h GLU 221 Ca -0.00 -0.17 -0.10 0.00 0.34 0.00 0.00 59.36 59.44 3a4t h GLU 221 Cb 0.22 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 3a4t h GLU 221 CO 0.01 0.78 -0.10 0.28 -1.16 0.00 0.00 179.01 178.82 3a4t h VAL 222 N 0.87 1.27 -0.17 3.13 2.07 -1.65 -0.87 116.25 120.90 3a4t h VAL 222 Ca 0.21 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 3a4t h VAL 222 Cb 0.20 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 3a4t h VAL 222 CO -0.02 0.41 0.05 0.40 0.02 0.00 0.00 177.57 178.43 3a4t h ILE 223 N 0.66 1.19 -0.59 4.57 1.08 -1.28 -2.43 117.51 120.71 3a4t h ILE 223 Ca 0.11 -0.61 -0.04 0.00 -0.39 0.00 0.00 64.86 63.93 3a4t h ILE 223 Cb 0.64 1.28 -0.03 0.00 -3.07 0.00 0.00 36.82 35.64 3a4t h ILE 223 CO 0.04 0.19 0.22 0.50 -0.69 0.00 0.00 178.15 178.41 3a4t h LYS 224 N 0.08 0.87 -0.56 2.37 3.64 -0.75 -1.56 116.57 120.67 3a4t h LYS 224 Ca 0.05 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 3a4t h LYS 224 Cb 0.25 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 3a4t h LYS 224 CO -0.00 0.73 0.28 -0.92 -2.27 0.00 0.00 179.45 177.27 3a4t h TYR 225 N 0.86 0.79 -0.04 1.91 3.20 -1.13 -2.07 116.97 120.49 3a4t h TYR 225 Ca 0.20 -0.03 -0.22 0.00 3.14 0.00 0.00 58.73 61.81 3a4t h TYR 225 Cb 0.20 -0.25 0.01 0.00 1.54 0.00 0.00 36.73 38.23 3a4t h TYR 225 CO 0.01 0.60 -0.89 0.97 -1.64 0.00 0.00 178.16 177.22 3a4t h ILE 226 N 0.75 1.35 -0.76 1.81 6.09 -0.85 0.31 117.51 126.23 3a4t h ILE 226 Ca 0.19 -2.27 -0.04 0.00 -1.37 0.00 0.00 64.86 61.38 3a4t h ILE 226 Cb 0.10 2.28 -0.03 0.00 0.47 0.00 0.00 36.82 39.63 3a4t h ILE 226 CO -0.03 0.69 0.33 -0.07 -3.07 0.00 0.00 178.15 176.01 3a4t h LEU 227 N 0.32 1.02 -0.34 2.19 3.38 -1.20 -1.91 115.31 118.77 3a4t h LEU 227 Ca -0.07 -0.15 -0.19 0.00 0.09 0.00 0.00 57.88 57.55 3a4t h LEU 227 Cb 1.52 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 3a4t h LEU 227 CO 0.16 0.89 -0.82 1.56 0.09 0.00 0.00 178.44 180.32 3a4t h GLN 228 N 1.08 0.27 -0.48 1.13 4.20 -1.41 -3.27 115.11 116.63 3a4t h GLN 228 Ca 0.26 -0.26 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 3a4t h GLN 228 Cb 0.17 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3a4t h GLN 228 CO -0.03 0.95 -0.16 -0.22 -0.67 0.00 0.00 178.83 178.71 3a4t h LYS 229 N 0.16 0.96 -6.79 1.46 3.64 -0.60 -3.46 116.57 111.94 3a4t h LYS 229 Ca -0.04 -0.39 -0.68 0.00 -1.27 0.00 0.00 60.65 58.27 3a4t h LYS 229 Cb 1.43 -0.05 -0.20 0.00 -0.41 0.00 0.00 32.23 33.00 3a4t h LYS 229 CO 0.13 1.05 -0.84 1.03 -2.27 0.00 0.00 179.45 178.55 3a4t s ARG 230 N -4.75 1.51 0.00 1.90 0.52 -0.75 -5.02 118.95 112.36 3a4t s ARG 230 Ca -0.12 -1.37 0.24 0.00 -0.52 0.00 0.00 55.73 53.96 3a4t s ARG 230 Cb 0.12 -1.93 0.37 0.00 0.52 0.00 0.00 34.95 34.04 3a4t s ARG 230 CO 0.86 0.44 1.37 0.27 0.02 0.00 0.00 175.30 178.26 3a4t n ASN 231 N 0.70 3.22 -0.80 0.23 6.94 -1.26 -4.56 115.26 119.73 3a4t n ASN 231 Ca -0.16 -1.98 0.08 0.00 -0.02 0.00 0.00 54.58 52.50 3a4t n ASN 231 Cb 0.54 -0.16 0.24 0.00 -2.36 0.00 0.00 39.78 38.04 3a4t n ASN 231 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 3a4t n ASP 232 N 1.39 3.59 -4.08 0.53 5.75 -1.26 -4.94 116.55 117.53 3a4t n ASP 232 Ca 0.18 -3.08 -0.18 0.00 -0.01 0.00 0.00 54.79 51.69 3a4t n ASP 232 Cb 0.59 -0.54 -0.13 0.00 -1.03 0.00 0.00 41.12 40.01 3a4t n ASP 232 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3a4t s VAL 233 N -2.87 0.85 -0.08 2.12 0.11 -1.26 0.98 120.40 120.25 3a4t s VAL 233 Ca 0.41 -0.78 0.01 0.00 -2.93 0.00 0.00 61.98 58.68 3a4t s VAL 233 Cb 0.34 -0.77 0.02 0.00 -1.53 0.00 0.00 36.38 34.44 3a4t s VAL 233 CO 0.07 0.00 -0.07 -0.70 -3.33 0.00 0.00 175.10 171.07 3a4t s GLU 234 N -0.88 1.27 0.04 1.54 2.56 0.11 -4.88 118.70 118.47 3a4t s GLU 234 Ca 0.00 -0.21 -0.32 0.00 0.00 0.00 0.00 54.97 54.44 3a4t s GLU 234 Cb -0.07 -1.25 -0.11 0.00 2.00 0.00 0.00 34.13 34.70 3a4t s GLU 234 CO 0.01 -0.14 1.85 -0.11 -0.56 0.00 0.00 175.26 176.30 3a4t n LEU 235 N 4.41 3.76 -4.74 2.70 -0.00 -1.26 0.12 117.00 121.99 3a4t n LEU 235 Ca -0.18 0.98 -0.37 0.00 -0.00 0.00 0.00 56.01 56.44 3a4t n LEU 235 Cb 0.51 -1.47 -0.07 0.00 -0.00 0.00 0.00 43.42 42.39 3a4t n LEU 235 CO 0.20 0.05 0.05 -0.63 -0.00 0.00 0.00 177.39 177.06 3a4t s ILE 236 N 3.27 5.25 -0.10 1.96 1.01 0.91 -4.91 121.20 128.59 3a4t s ILE 236 Ca 0.86 0.69 -0.30 0.00 0.00 0.00 0.00 60.65 61.90 3a4t s ILE 236 Cb -0.56 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 3a4t s ILE 236 CO 0.43 0.40 1.27 -0.63 0.00 0.00 0.00 174.94 176.41 3a4t s ILE 237 N 0.31 4.17 -0.09 2.92 1.01 -1.26 -4.44 121.20 123.82 3a4t s ILE 237 Ca 0.20 1.47 -0.02 0.00 0.00 0.00 0.00 60.65 62.29 3a4t s ILE 237 Cb -0.14 -3.94 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 3a4t s ILE 237 CO 0.07 -0.06 0.00 -0.63 0.00 0.00 0.00 174.94 174.32 3a4t s ILE 238 N 2.89 4.33 -0.03 2.92 1.01 -0.55 -5.03 121.20 126.75 3a4t s ILE 238 Ca 0.57 -0.23 -0.01 0.00 0.00 0.00 0.00 60.65 60.98 3a4t s ILE 238 Cb -0.25 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 3a4t s ILE 238 CO 0.20 0.59 0.07 -0.54 0.00 0.00 0.00 174.94 175.26 3a4t s LYS 239 N -0.76 3.06 0.39 2.79 1.02 -1.26 -4.52 119.74 120.46 3a4t s LYS 239 Ca 0.12 -0.45 0.17 0.00 0.02 0.00 0.00 55.97 55.83 3a4t s LYS 239 Cb -0.12 -2.86 0.80 0.00 -0.52 0.00 0.00 37.83 35.13 3a4t s LYS 239 CO 0.02 0.67 1.82 0.00 -0.92 0.00 0.00 175.35 176.94 3a4t h ALA 240 N 4.38 1.20 -0.37 5.17 0.00 -1.96 -3.38 119.26 124.30 3a4t h ALA 240 Ca -0.50 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.12 3a4t h ALA 240 Cb 1.19 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 3a4t h ALA 240 CO 0.60 0.44 0.25 -2.95 0.00 0.00 0.00 179.25 177.59 3a4t h ASN 241 N 0.00 0.34 -0.66 0.00 -1.07 -1.96 0.18 115.58 112.42 3a4t h ASN 241 Ca -0.00 -0.01 0.11 0.00 0.07 0.00 0.00 56.30 56.47 3a4t h ASN 241 Cb 0.72 -0.08 -0.04 0.00 -2.07 0.00 0.00 38.32 36.85 3a4t h ASN 241 CO 0.05 0.24 0.44 -0.08 0.07 0.00 0.00 177.43 178.15 3a4t h GLU 242 N 0.40 0.45 -3.14 4.14 4.81 -2.03 -3.36 114.58 115.84 3a4t h GLU 242 Ca 0.15 -0.03 -0.73 0.00 -0.13 0.00 0.00 59.36 58.62 3a4t h GLU 242 Cb 0.09 -0.10 -0.10 0.00 0.63 0.00 0.00 28.75 29.27 3a4t h GLU 242 CO -0.03 0.30 2.56 1.19 -0.73 0.00 0.00 179.01 182.29 3a4t n PHE 243 N -4.48 2.79 -1.98 0.92 3.72 0.63 -4.96 117.46 114.10 3a4t n PHE 243 Ca 0.11 -2.86 -0.42 0.00 -0.05 0.00 0.00 57.45 54.23 3a4t n PHE 243 Cb 0.39 -2.05 -0.03 0.00 -0.94 0.00 0.00 39.48 36.85 3a4t n PHE 243 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3a4t s LYS 244 N 0.35 4.23 0.00 -1.08 1.02 -1.26 -2.80 119.74 120.20 3a4t s LYS 244 Ca 0.50 2.31 0.00 0.00 0.02 0.00 0.00 55.97 58.80 3a4t s LYS 244 Cb 0.15 -3.16 0.00 0.00 -0.52 0.00 0.00 37.83 34.29 3a4t s LYS 244 CO -0.05 -0.56 0.00 0.41 -0.92 0.00 0.00 175.35 174.22 3a4t n GLY 245 N 3.57 0.78 3.27 -3.33 0.00 -1.26 -4.25 105.19 103.97 3a4t n GLY 245 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 3a4t n GLY 245 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a4t s ILE 246 N -2.14 2.12 -1.02 -0.61 1.01 -1.12 -5.03 121.20 114.40 3a4t s ILE 246 Ca 0.00 -1.04 -0.20 0.00 0.00 0.00 0.00 60.65 59.41 3a4t s ILE 246 Cb 0.00 -1.77 -0.09 0.00 0.01 0.00 0.00 42.46 40.61 3a4t s ILE 246 CO 0.00 0.57 2.00 -3.20 0.00 0.00 0.00 174.94 174.31 3a4t n ASN 247 N 3.00 3.05 -4.19 3.58 5.15 -1.26 -4.86 115.26 119.73 3a4t n ASN 247 Ca -0.18 -2.74 -0.30 0.00 -0.60 0.00 0.00 54.58 50.77 3a4t n ASN 247 Cb 0.52 -1.34 -0.17 0.00 -0.53 0.00 0.00 39.78 38.26 3a4t n ASN 247 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 3a4t s ILE 248 N 4.95 1.84 0.24 -1.44 2.07 -1.26 0.14 121.20 127.73 3a4t s ILE 248 Ca 0.55 -0.91 -0.01 0.00 -1.41 0.00 0.00 60.65 58.87 3a4t s ILE 248 Cb 0.13 -1.59 -0.03 0.00 0.13 0.00 0.00 42.46 41.10 3a4t s ILE 248 CO 0.06 0.51 0.23 -1.59 -1.91 0.00 0.00 174.94 172.24 3a4t s LYS 249 N 0.24 1.39 0.45 3.50 0.00 -0.23 -4.98 119.74 120.10 3a4t s LYS 249 Ca -0.13 -1.65 -0.24 0.00 0.00 0.00 0.00 55.97 53.95 3a4t s LYS 249 Cb -0.16 0.32 -0.08 0.00 0.00 0.00 0.00 37.83 37.91 3a4t s LYS 249 CO 0.06 -0.49 1.30 -2.00 0.00 0.00 0.00 175.35 174.22 3a4t s GLU 250 N -3.95 3.73 0.00 1.78 2.12 -1.26 0.34 118.70 121.46 3a4t s GLU 250 Ca 0.36 2.13 0.00 0.00 0.36 0.00 0.00 54.97 57.82 3a4t s GLU 250 Cb 0.05 -2.58 0.00 0.00 0.26 0.00 0.00 34.13 31.86 3a4t s GLU 250 CO 0.15 -0.68 0.00 0.41 -0.54 0.00 0.00 175.26 174.60 3a4t n GLY 251 N 0.63 -1.18 0.78 -1.50 0.00 0.22 -4.62 105.19 99.51 3a4t n GLY 251 Ca 0.06 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.54 3a4t n GLY 251 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3a4t n TYR 252 N -1.70 0.31 -4.66 1.61 4.02 -1.26 -4.56 117.16 110.92 3a4t n TYR 252 Ca 0.00 -0.15 -0.33 0.00 -0.01 0.00 0.00 57.90 57.40 3a4t n TYR 252 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.18 3a4t n TYR 252 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3a4t s ILE 253 N -1.69 3.01 0.24 -0.72 1.01 -1.26 -5.10 121.20 116.69 3a4t s ILE 253 Ca 0.34 -0.67 -0.31 0.00 0.00 0.00 0.00 60.65 60.02 3a4t s ILE 253 Cb 0.19 -2.27 -0.14 0.00 0.01 0.00 0.00 42.46 40.25 3a4t s ILE 253 CO 0.28 0.51 1.26 1.17 0.00 0.00 0.00 174.94 178.17 3a4t n LYS 254 N 3.71 1.69 -0.82 2.79 4.81 -1.26 -2.24 118.16 126.84 3a4t n LYS 254 Ca -0.18 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 3a4t n LYS 254 Cb 0.52 -2.16 0.00 0.00 0.02 0.00 0.00 35.03 33.42 3a4t n LYS 254 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3a4t n GLY 255 N 1.82 0.70 3.75 3.14 0.00 -1.26 -4.90 105.19 108.43 3a4t n GLY 255 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 3a4t n GLY 255 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3a4t s THR 256 N -2.54 4.09 0.01 2.61 -4.23 -0.95 -1.48 115.64 113.15 3a4t s THR 256 Ca 0.00 -1.48 0.04 0.00 -1.18 0.00 0.00 61.69 59.07 3a4t s THR 256 Cb 0.00 -3.16 -0.01 0.00 1.34 0.00 0.00 72.50 70.67 3a4t s THR 256 CO 0.00 -0.28 -0.12 -0.76 -0.54 0.00 0.00 174.62 172.92 3a4t s LEU 257 N -3.53 2.09 -0.04 4.79 1.43 -0.30 0.69 118.68 123.80 3a4t s LEU 257 Ca 0.31 -0.32 0.04 0.00 -1.03 0.00 0.00 54.13 53.13 3a4t s LEU 257 Cb -0.08 -0.55 -0.00 0.00 0.03 0.00 0.00 46.19 45.59 3a4t s LEU 257 CO 0.22 0.07 -0.16 -0.60 0.23 0.00 0.00 176.35 176.12 3a4t s ARG 258 N -0.67 1.70 -0.15 1.70 3.52 0.15 -0.88 118.95 124.32 3a4t s ARG 258 Ca 0.02 -0.56 -0.07 0.00 -0.13 0.00 0.00 55.73 54.99 3a4t s ARG 258 Cb -0.06 -1.47 -0.04 0.00 -1.56 0.00 0.00 34.95 31.82 3a4t s ARG 258 CO 0.00 0.21 0.10 0.08 -0.81 0.00 0.00 175.30 174.88 3a4t s VAL 259 N 0.12 5.17 0.32 7.11 1.01 0.56 -1.07 120.40 133.61 3a4t s VAL 259 Ca -0.05 0.09 0.10 0.00 0.00 0.00 0.00 61.98 62.12 3a4t s VAL 259 Cb -0.12 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 3a4t s VAL 259 CO 0.02 0.54 -0.05 -0.36 0.00 0.00 0.00 175.10 175.25 3a4t s PHE 260 N -0.39 2.49 0.19 5.22 0.08 0.12 -2.77 117.98 122.93 3a4t s PHE 260 Ca 0.11 -0.39 -0.31 0.00 0.12 0.00 0.00 56.93 56.46 3a4t s PHE 260 Cb -0.12 -1.31 -0.16 0.00 -0.57 0.00 0.00 43.02 40.86 3a4t s PHE 260 CO 0.02 0.57 0.96 -2.30 -0.10 0.00 0.00 175.22 174.37 3a4t n PRO 261 N -0.84 0.82 -0.20 0.24 -0.02 -1.26 -0.88 135.00 132.85 3a4t n PRO 261 Ca -0.05 0.29 0.08 0.00 -2.02 0.00 0.00 63.50 61.81 3a4t n PRO 261 Cb 0.61 -1.64 0.24 0.00 -0.02 0.00 0.00 33.50 32.69 3a4t n PRO 261 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3a4t n PRO 262 N 1.29 2.05 -1.56 0.52 -0.04 -1.26 -4.96 135.00 131.04 3a4t n PRO 262 Ca 0.15 -1.62 -0.31 0.00 -0.04 0.00 0.00 63.50 61.68 3a4t n PRO 262 Cb 0.25 -1.38 0.07 0.00 -0.04 0.00 0.00 33.50 32.40 3a4t n PRO 262 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3a4t s ASN 263 N -1.14 5.02 0.10 3.54 0.01 -0.06 -4.59 114.94 117.81 3a4t s ASN 263 Ca 0.32 1.50 -0.31 0.00 -0.71 0.00 0.00 52.86 53.66 3a4t s ASN 263 Cb 0.17 -2.32 -0.09 0.00 0.41 0.00 0.00 41.25 39.43 3a4t s ASN 263 CO 0.23 -1.66 1.60 -0.70 -1.51 0.00 0.00 177.10 175.06 3a4t s GLU 264 N -5.09 4.21 0.16 -0.60 2.12 -1.26 -4.61 118.70 113.64 3a4t s GLU 264 Ca 0.59 2.30 -0.34 0.00 0.36 0.00 0.00 54.97 57.89 3a4t s GLU 264 Cb -0.14 -3.45 -0.15 0.00 0.26 0.00 0.00 34.13 30.65 3a4t s GLU 264 CO 0.55 -0.67 1.38 -2.30 -0.54 0.00 0.00 175.26 173.67 3a4t n PRO 265 N 5.01 1.60 -3.48 4.30 -0.02 -1.26 -4.62 135.00 136.53 3a4t n PRO 265 Ca 0.15 0.57 -0.15 0.00 -2.02 0.00 0.00 63.50 62.05 3a4t n PRO 265 Cb 0.40 -2.22 -0.04 0.00 -0.02 0.00 0.00 33.50 31.62 3a4t n PRO 265 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3a4t s PHE 266 N 0.33 -0.58 -0.00 6.00 0.40 -1.11 -3.77 117.98 119.24 3a4t s PHE 266 Ca 0.77 0.74 0.00 0.00 -0.60 0.00 0.00 56.93 57.85 3a4t s PHE 266 Cb -0.80 0.48 0.00 0.00 0.51 0.00 0.00 43.02 43.21 3a4t s PHE 266 CO 0.46 -0.68 -0.01 0.12 0.70 0.00 0.00 175.22 175.81 3a4t s PHE 267 N -2.26 0.15 -0.06 0.36 5.36 -0.71 -0.32 117.98 120.50 3a4t s PHE 267 Ca -0.05 -0.02 0.01 0.00 -0.96 0.00 0.00 56.93 55.91 3a4t s PHE 267 Cb -0.00 -0.11 0.02 0.00 -0.34 0.00 0.00 43.02 42.58 3a4t s PHE 267 CO -0.00 -0.01 -0.06 0.42 -1.46 0.00 0.00 175.22 174.10 3a4t s ILE 268 N 0.06 0.69 0.23 3.12 1.09 -0.06 -2.06 121.20 124.27 3a4t s ILE 268 Ca -0.00 -0.19 0.01 0.00 -1.10 0.00 0.00 60.65 59.37 3a4t s ILE 268 Cb -0.02 -0.70 -0.05 0.00 -1.06 0.00 0.00 42.46 40.63 3a4t s ILE 268 CO -0.00 0.27 0.07 0.00 -0.10 0.00 0.00 174.94 175.17 3a4t s ALA 269 N 1.03 1.59 -0.08 9.38 0.00 0.46 -1.15 121.76 133.00 3a4t s ALA 269 Ca -0.09 -1.78 -0.03 0.00 0.00 0.00 0.00 51.96 50.06 3a4t s ALA 269 Cb -0.14 0.91 0.04 0.00 0.00 0.00 0.00 23.12 23.93 3a4t s ALA 269 CO -0.00 -0.42 0.17 0.21 0.00 0.00 0.00 175.76 175.72 3a4t s LYS 270 N -4.00 0.11 0.27 0.00 2.20 -1.26 -0.55 119.74 116.50 3a4t s LYS 270 Ca 0.34 0.44 0.08 0.00 -0.36 0.00 0.00 55.97 56.47 3a4t s LYS 270 Cb 0.07 -0.18 -0.05 0.00 -1.51 0.00 0.00 37.83 36.16 3a4t s LYS 270 CO 0.11 -0.19 -0.12 -0.51 -0.36 0.00 0.00 175.35 174.28 3a4t s LEU 271 N 1.37 2.56 -0.03 5.43 1.43 0.57 -0.06 118.68 129.95 3a4t s LEU 271 Ca -0.07 -1.11 0.01 0.00 -1.03 0.00 0.00 54.13 51.93 3a4t s LEU 271 Cb -0.11 -0.79 0.01 0.00 0.03 0.00 0.00 46.19 45.33 3a4t s LEU 271 CO -0.07 -0.20 -0.05 -0.60 0.23 0.00 0.00 176.35 175.67 3a4t s ARG 272 N -3.65 0.67 -0.07 1.70 3.00 0.12 -1.71 118.95 119.02 3a4t s ARG 272 Ca 0.28 -0.14 -0.27 0.00 -1.00 0.00 0.00 55.73 54.61 3a4t s ARG 272 Cb 0.01 -0.69 -0.03 0.00 0.00 0.00 0.00 34.95 34.24 3a4t s ARG 272 CO 0.12 -0.00 0.85 0.21 0.00 0.00 0.00 175.30 176.47 3a4t s LYS 273 N 0.53 4.45 0.00 5.12 2.20 -0.42 0.07 119.74 131.69 3a4t s LYS 273 Ca -0.07 1.13 0.10 0.00 -0.36 0.00 0.00 55.97 56.78 3a4t s LYS 273 Cb -0.10 -3.49 0.08 0.00 -1.51 0.00 0.00 37.83 32.81 3a4t s LYS 273 CO -0.00 -0.09 0.81 0.44 -0.36 0.00 0.00 175.35 176.16