#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a3t s PRO 45 N 0.00 3.03 -0.11 3.23 0.02 -1.26 -4.73 135.00 135.18 2a3t s PRO 45 Ca 0.00 2.20 -0.02 0.00 0.02 0.00 0.00 61.00 63.20 2a3t s PRO 45 Cb 0.00 -2.18 -0.03 0.00 0.02 0.00 0.00 34.50 32.32 2a3t s PRO 45 CO 0.00 -1.26 -0.04 1.03 -0.33 0.00 0.00 177.00 176.40 2a3t s ARG 46 N -3.00 3.20 -0.15 5.54 0.52 -1.26 -0.72 118.95 123.07 2a3t s ARG 46 Ca 0.74 -0.51 0.00 0.00 -0.52 0.00 0.00 55.73 55.44 2a3t s ARG 46 Cb -0.40 -2.77 0.03 0.00 0.52 0.00 0.00 34.95 32.33 2a3t s ARG 46 CO 0.46 0.49 -0.13 0.08 0.02 0.00 0.00 175.30 176.21 2a3t s VAL 47 N -0.31 1.56 -0.23 3.52 1.01 -0.34 -4.95 120.40 120.66 2a3t s VAL 47 Ca 0.05 -0.67 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 2a3t s VAL 47 Cb -0.12 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2a3t s VAL 47 CO 0.02 0.42 0.37 -0.75 0.00 0.00 0.00 175.10 175.16 2a3t s LYS 48 N 1.49 4.11 -0.00 2.72 2.20 -1.26 -0.15 119.74 128.84 2a3t s LYS 48 Ca 0.04 0.11 0.01 0.00 -0.36 0.00 0.00 55.97 55.77 2a3t s LYS 48 Cb -0.13 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.57 2a3t s LYS 48 CO -0.10 -0.11 0.03 -1.01 -0.36 0.00 0.00 175.35 173.80 2a3t s HIS 49 N 1.55 3.17 -0.34 4.03 3.76 -0.46 -4.96 115.29 122.05 2a3t s HIS 49 Ca 0.17 0.14 -0.11 0.00 -0.15 0.00 0.00 55.06 55.10 2a3t s HIS 49 Cb -0.15 -1.70 0.00 0.00 1.11 0.00 0.00 32.58 31.85 2a3t s HIS 49 CO 0.08 0.50 0.19 0.99 -0.85 0.00 0.00 174.74 175.65 2a3t s THR 50 N -1.13 4.73 0.52 1.30 2.01 -1.26 -4.69 115.64 117.11 2a3t s THR 50 Ca 0.21 -0.53 -0.20 0.00 0.31 0.00 0.00 61.69 61.48 2a3t s THR 50 Cb -0.12 -3.49 -0.07 0.00 0.01 0.00 0.00 72.50 68.83 2a3t s THR 50 CO 0.12 -0.05 1.11 -0.76 -0.69 0.00 0.00 174.62 174.34 2a3t s LEU 51 N 1.62 3.81 0.12 4.42 1.43 -1.26 -4.72 118.68 124.09 2a3t s LEU 51 Ca 0.04 2.13 0.10 0.00 -1.03 0.00 0.00 54.13 55.37 2a3t s LEU 51 Cb -0.18 -4.53 -0.04 0.00 0.03 0.00 0.00 46.19 41.47 2a3t s LEU 51 CO 0.07 -1.07 -0.25 0.68 0.23 0.00 0.00 176.35 176.02 2a3t s VAL 52 N -1.79 2.40 0.61 -1.59 -7.23 -1.26 -4.97 120.40 106.57 2a3t s VAL 52 Ca 0.70 -1.66 -0.18 0.00 -1.81 0.00 0.00 61.98 59.03 2a3t s VAL 52 Cb -0.23 -2.06 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 2a3t s VAL 52 CO 0.26 0.12 1.18 -2.84 -0.31 0.00 0.00 175.10 173.51 2a3t s PRO 53 N -2.01 2.89 0.72 4.82 0.02 -1.26 -4.44 135.00 135.73 2a3t s PRO 53 Ca 0.15 1.73 -0.15 0.00 0.02 0.00 0.00 61.00 62.75 2a3t s PRO 53 Cb -0.10 -1.93 0.03 0.00 0.02 0.00 0.00 34.50 32.52 2a3t s PRO 53 CO 0.07 -1.25 1.17 -1.25 -0.33 0.00 0.00 177.00 175.41 2a3t s PRO 54 N -3.50 2.31 -0.00 5.54 0.04 -1.26 -2.15 135.00 135.97 2a3t s PRO 54 Ca 0.75 1.60 0.05 0.00 0.04 0.00 0.00 61.00 63.44 2a3t s PRO 54 Cb -0.28 -1.87 0.15 0.00 0.04 0.00 0.00 34.50 32.54 2a3t s PRO 54 CO 0.35 -1.67 1.11 -0.35 0.04 0.00 0.00 177.00 176.48 2a3t n PRO 55 N -2.72 1.43 -2.16 0.56 -0.04 -1.26 -5.02 135.00 125.78 2a3t n PRO 55 Ca 0.12 -0.63 -0.26 0.00 -0.04 0.00 0.00 63.50 62.69 2a3t n PRO 55 Cb 0.51 -1.16 0.08 0.00 -0.04 0.00 0.00 33.50 32.89 2a3t n PRO 55 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2a3t s PHE 56 N -1.75 2.83 0.01 0.54 0.08 -0.91 -0.61 117.98 118.16 2a3t s PHE 56 Ca 0.12 0.45 0.04 0.00 0.12 0.00 0.00 56.93 57.65 2a3t s PHE 56 Cb 0.06 -3.27 -0.01 0.00 -0.57 0.00 0.00 43.02 39.23 2a3t s PHE 56 CO 0.08 -1.52 -0.11 0.00 -0.10 0.00 0.00 175.22 173.57 2a3t s ALA 57 N -3.31 0.93 0.80 5.36 0.00 -1.26 -4.66 121.76 119.62 2a3t s ALA 57 Ca 0.61 -0.56 -0.14 0.00 0.00 0.00 0.00 51.96 51.87 2a3t s ALA 57 Cb -0.10 -0.20 0.08 0.00 0.00 0.00 0.00 23.12 22.90 2a3t s ALA 57 CO 0.46 0.20 1.18 -2.39 0.00 0.00 0.00 175.76 175.21 2a3t n HIS 58 N 2.51 1.21 -1.62 0.00 1.44 -1.26 -4.88 115.22 112.62 2a3t n HIS 58 Ca -0.15 0.40 -0.45 0.00 -2.01 0.00 0.00 57.72 55.51 2a3t n HIS 58 Cb 0.56 -2.10 -0.02 0.00 0.12 0.00 0.00 29.99 28.54 2a3t n HIS 58 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2a3t n ALA 59 N -3.24 0.21 -3.81 1.59 0.00 -1.26 -4.97 120.51 109.03 2a3t n ALA 59 Ca 0.13 0.41 -0.05 0.00 0.00 0.00 0.00 53.44 53.93 2a3t n ALA 59 Cb 0.50 -2.12 -0.01 0.00 0.00 0.00 0.00 19.45 17.82 2a3t n ALA 59 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2a3t s HIS 60 N -0.59 -0.11 -0.05 0.00 -3.43 -1.26 -5.05 115.29 104.81 2a3t s HIS 60 Ca 0.64 -0.31 0.06 0.00 -0.80 0.00 0.00 55.06 54.66 2a3t s HIS 60 Cb -0.70 0.69 -0.01 0.00 -1.43 0.00 0.00 32.58 31.13 2a3t s HIS 60 CO 0.56 -1.08 -0.25 -1.21 -2.00 0.00 0.00 174.74 170.76 2a3t s GLU 61 N -3.34 2.42 0.15 -0.38 2.02 -1.26 -5.05 118.70 113.26 2a3t s GLU 61 Ca 0.13 -0.90 -0.11 0.00 0.02 0.00 0.00 54.97 54.11 2a3t s GLU 61 Cb -0.04 -2.14 0.01 0.00 0.10 0.00 0.00 34.13 32.06 2a3t s GLU 61 CO 0.05 0.45 1.56 1.96 0.02 0.00 0.00 175.26 179.31 2a3t h GLN 62 N 5.85 0.94 -5.23 1.61 4.20 -1.98 -3.39 115.11 117.11 2a3t h GLN 62 Ca -0.36 -0.37 -0.61 0.00 0.06 0.00 0.00 58.65 57.37 2a3t h GLN 62 Cb 1.16 -0.05 -0.13 0.00 0.30 0.00 0.00 27.48 28.76 2a3t h GLN 62 CO 0.47 1.03 -0.41 0.08 -0.67 0.00 0.00 178.83 179.34 2a3t s VAL 63 N -4.78 5.32 0.11 -0.54 1.01 -1.26 -3.35 120.40 116.90 2a3t s VAL 63 Ca -0.12 0.35 -0.31 0.00 0.00 0.00 0.00 61.98 61.90 2a3t s VAL 63 Cb 0.12 -3.57 -0.09 0.00 0.00 0.00 0.00 36.38 32.84 2a3t s VAL 63 CO 0.85 0.33 1.71 0.00 0.00 0.00 0.00 175.10 178.00 2a3t s ALA 64 N 1.01 3.74 -1.60 5.51 0.00 -0.25 -4.85 121.76 125.31 2a3t s ALA 64 Ca 0.11 1.33 0.25 0.00 0.00 0.00 0.00 51.96 53.66 2a3t s ALA 64 Cb -0.14 -3.71 1.36 0.00 0.00 0.00 0.00 23.12 20.63 2a3t s ALA 64 CO 0.05 -1.11 1.86 0.00 0.00 0.00 0.00 175.76 176.56 2a3t n ALA 65 N 5.39 2.33 -3.02 0.00 0.00 -1.26 -4.87 120.51 119.08 2a3t n ALA 65 Ca 0.16 -0.13 -0.14 0.00 0.00 0.00 0.00 53.44 53.33 2a3t n ALA 65 Cb 0.39 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 2a3t n ALA 65 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2a3t s SER 66 N -2.40 0.74 1.10 0.00 1.04 -1.26 -5.17 113.70 107.74 2a3t s SER 66 Ca 0.28 -1.41 -0.14 0.00 0.48 0.00 0.00 55.95 55.16 2a3t s SER 66 Cb 0.17 0.68 0.21 0.00 0.10 0.00 0.00 66.02 67.18 2a3t s SER 66 CO 0.36 -1.34 0.94 0.61 0.98 0.00 0.00 173.24 174.79 2a3t n GLY 67 N -0.55 -2.08 3.52 7.32 0.00 -1.26 -4.95 105.19 107.19 2a3t n GLY 67 Ca -0.00 -1.59 -0.49 0.00 0.00 0.00 0.00 46.02 43.93 2a3t n GLY 67 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2a3t n PRO 68 N -3.65 0.73 -4.42 1.61 -0.02 -1.26 -5.00 135.00 122.98 2a3t n PRO 68 Ca 0.12 0.26 -0.21 0.00 -2.02 0.00 0.00 63.50 61.65 2a3t n PRO 68 Cb 0.45 -1.60 -0.10 0.00 -0.02 0.00 0.00 33.50 32.23 2a3t n PRO 68 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2a3t s VAL 69 N -0.53 1.59 -0.37 -1.45 -7.23 -1.26 -4.42 120.40 106.73 2a3t s VAL 69 Ca 0.71 -2.11 -0.16 0.00 -1.81 0.00 0.00 61.98 58.60 2a3t s VAL 69 Cb -0.91 -2.45 0.00 0.00 0.56 0.00 0.00 36.38 33.59 2a3t s VAL 69 CO 0.55 -0.29 0.40 -0.63 -0.31 0.00 0.00 175.10 174.82 2a3t s ILE 70 N -3.05 5.13 -0.25 -0.62 1.01 0.10 -1.13 121.20 122.39 2a3t s ILE 70 Ca 0.30 -0.10 -0.23 0.00 0.00 0.00 0.00 60.65 60.61 2a3t s ILE 70 Cb 0.04 -3.92 -0.01 0.00 0.01 0.00 0.00 42.46 38.58 2a3t s ILE 70 CO 0.12 -0.23 0.78 0.20 0.00 0.00 0.00 174.94 175.80 2a3t s ASN 71 N 1.76 6.76 -0.22 3.58 0.01 0.41 -1.20 114.94 126.05 2a3t s ASN 71 Ca 0.12 0.93 -0.08 0.00 -0.71 0.00 0.00 52.86 53.13 2a3t s ASN 71 Cb -0.17 -2.41 -0.04 0.00 0.41 0.00 0.00 41.25 39.05 2a3t s ASN 71 CO 0.12 -0.49 0.08 -1.61 -1.51 0.00 0.00 177.10 173.69 2a3t s GLU 72 N 2.78 3.83 0.12 -0.60 2.02 0.79 0.05 118.70 127.69 2a3t s GLU 72 Ca 0.33 -0.40 0.07 0.00 0.02 0.00 0.00 54.97 54.99 2a3t s GLU 72 Cb -0.15 -3.30 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 2a3t s GLU 72 CO 0.08 0.03 -0.17 -0.06 0.02 0.00 0.00 175.26 175.16 2a3t s PHE 73 N 1.03 1.63 -0.01 1.61 0.08 -0.75 -1.35 117.98 120.22 2a3t s PHE 73 Ca 0.04 -0.48 0.01 0.00 0.12 0.00 0.00 56.93 56.63 2a3t s PHE 73 Cb -0.14 -0.86 0.01 0.00 -0.57 0.00 0.00 43.02 41.46 2a3t s PHE 73 CO 0.03 0.21 -0.04 -2.00 -0.10 0.00 0.00 175.22 173.32 2a3t s GLU 74 N -2.37 0.48 0.02 0.44 2.12 -1.26 -0.93 118.70 117.21 2a3t s GLU 74 Ca 0.09 -0.14 0.02 0.00 0.36 0.00 0.00 54.97 55.30 2a3t s GLU 74 Cb -0.07 -0.50 -0.02 0.00 0.26 0.00 0.00 34.13 33.80 2a3t s GLU 74 CO 0.04 0.04 -0.06 -1.64 -0.54 0.00 0.00 175.26 173.10 2a3t s MET 75 N 0.22 0.47 -0.12 4.30 -1.94 -0.51 -4.89 119.30 116.83 2a3t s MET 75 Ca -0.02 -0.53 -0.00 0.00 -1.71 0.00 0.00 55.69 53.43 2a3t s MET 75 Cb -0.06 -0.31 -0.02 0.00 2.01 0.00 0.00 34.83 36.45 2a3t s MET 75 CO -0.00 0.07 -0.11 0.50 -0.01 0.00 0.00 175.02 175.46 2a3t s ARG 76 N -1.02 3.30 -0.02 2.03 3.52 -1.26 -1.66 118.95 123.85 2a3t s ARG 76 Ca -0.06 -0.65 -0.29 0.00 -0.13 0.00 0.00 55.73 54.59 2a3t s ARG 76 Cb -0.07 -2.65 -0.03 0.00 -1.56 0.00 0.00 34.95 30.65 2a3t s ARG 76 CO 0.00 0.29 0.96 0.42 -0.81 0.00 0.00 175.30 176.16 2a3t s ILE 77 N 0.17 4.88 -0.18 4.11 1.01 -0.01 0.19 121.20 131.37 2a3t s ILE 77 Ca -0.06 2.01 0.01 0.00 0.00 0.00 0.00 60.65 62.60 2a3t s ILE 77 Cb -0.15 -4.30 0.03 0.00 0.01 0.00 0.00 42.46 38.06 2a3t s ILE 77 CO 0.05 0.15 -0.14 -0.63 0.00 0.00 0.00 174.94 174.37 2a3t s ILE 78 N 1.09 1.73 -0.25 2.92 -1.09 -0.48 -4.40 121.20 120.72 2a3t s ILE 78 Ca 0.50 -0.89 -0.18 0.00 -2.23 0.00 0.00 60.65 57.85 2a3t s ILE 78 Cb -0.20 -1.69 -0.03 0.00 -1.58 0.00 0.00 42.46 38.96 2a3t s ILE 78 CO 0.26 0.34 0.52 -1.61 -1.23 0.00 0.00 174.94 173.23 2a3t s GLU 79 N 1.39 4.10 -0.02 2.79 2.02 -1.26 -1.15 118.70 126.57 2a3t s GLU 79 Ca 0.02 0.35 -0.26 0.00 0.02 0.00 0.00 54.97 55.10 2a3t s GLU 79 Cb -0.14 -3.63 0.06 0.00 0.10 0.00 0.00 34.13 30.51 2a3t s GLU 79 CO -0.10 -0.31 0.57 -1.59 0.02 0.00 0.00 175.26 173.85 2a3t s LYS 80 N 2.17 0.98 0.21 1.61 -2.85 -0.83 -5.01 119.74 116.02 2a3t s LYS 80 Ca 0.22 0.06 -0.30 0.00 -1.00 0.00 0.00 55.97 54.95 2a3t s LYS 80 Cb -0.16 0.46 -0.08 0.00 -2.06 0.00 0.00 37.83 35.99 2a3t s LYS 80 CO 0.09 -0.31 1.09 -2.00 0.10 0.00 0.00 175.35 174.32 2a3t s GLU 81 N -1.52 4.62 0.08 1.78 2.12 -1.26 -1.23 118.70 123.30 2a3t s GLU 81 Ca -0.10 1.74 0.07 0.00 0.36 0.00 0.00 54.97 57.03 2a3t s GLU 81 Cb -0.01 -3.25 -0.03 0.00 0.26 0.00 0.00 34.13 31.10 2a3t s GLU 81 CO 0.06 0.13 -0.18 0.14 -0.54 0.00 0.00 175.26 174.88 2a3t s VAL 82 N -0.55 1.43 -0.37 3.70 -7.23 0.21 -4.88 120.40 112.71 2a3t s VAL 82 Ca 0.48 -1.39 -0.20 0.00 -1.81 0.00 0.00 61.98 59.05 2a3t s VAL 82 Cb -0.30 -1.32 0.00 0.00 0.56 0.00 0.00 36.38 35.32 2a3t s VAL 82 CO 0.37 -0.11 0.62 -1.58 -0.31 0.00 0.00 175.10 174.09 2a3t s GLN 83 N -1.75 3.61 0.10 4.82 0.74 -1.26 -0.17 119.66 125.75 2a3t s GLN 83 Ca 0.03 -0.03 -0.06 0.00 0.05 0.00 0.00 55.36 55.35 2a3t s GLN 83 Cb -0.10 -3.83 -0.17 0.00 1.10 0.00 0.00 33.01 30.01 2a3t s GLN 83 CO 0.03 -0.77 1.23 -0.07 -0.55 0.00 0.00 175.29 175.17 2a3t h LEU 84 N 9.39 0.55 -8.01 3.68 3.38 -1.17 -3.45 115.31 119.68 2a3t h LEU 84 Ca -0.26 -0.49 0.02 0.00 0.09 0.00 0.00 57.88 57.24 2a3t h LEU 84 Cb 1.11 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 2a3t h LEU 84 CO 0.84 1.31 0.24 -0.62 0.09 0.00 0.00 178.44 180.30 2a3t s ASP 85 N -7.15 -0.11 0.24 -0.43 -1.08 -0.85 -0.16 116.67 107.13 2a3t s ASP 85 Ca -0.06 -0.90 -0.14 0.00 -0.52 0.00 0.00 52.55 50.93 2a3t s ASP 85 Cb 0.08 0.79 0.30 0.00 -1.46 0.00 0.00 42.92 42.63 2a3t s ASP 85 CO 0.88 -1.52 1.56 -0.33 0.52 0.00 0.00 175.17 176.29 2a3t h GLU 86 N 2.01 -0.02 -0.74 4.34 5.08 -1.95 -2.17 114.58 121.13 2a3t h GLU 86 Ca -0.26 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.63 2a3t h GLU 86 Cb 1.25 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 30.08 2a3t h GLU 86 CO 0.32 -0.01 -0.90 -0.25 -1.00 0.00 0.00 179.01 177.17 2a3t n ASP 87 N -5.52 4.00 -3.74 1.42 8.00 -1.26 -5.00 116.55 114.46 2a3t n ASP 87 Ca 0.11 -3.30 -0.21 0.00 0.71 0.00 0.00 54.79 52.10 2a3t n ASP 87 Cb 0.42 -0.39 -0.18 0.00 -0.02 0.00 0.00 41.12 40.96 2a3t n ASP 87 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a3t s ALA 88 N -3.63 0.49 0.10 2.24 0.00 -0.82 -4.42 121.76 115.72 2a3t s ALA 88 Ca 0.44 0.02 0.09 0.00 0.00 0.00 0.00 51.96 52.52 2a3t s ALA 88 Cb 0.39 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.81 2a3t s ALA 88 CO 0.00 -0.44 -0.23 0.71 0.00 0.00 0.00 175.76 175.80 2a3t s TYR 89 N 1.97 1.99 -0.11 0.00 1.51 -1.26 -0.69 117.35 120.76 2a3t s TYR 89 Ca 0.04 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.73 2a3t s TYR 89 Cb -0.12 -1.10 0.01 0.00 -0.11 0.00 0.00 41.96 40.63 2a3t s TYR 89 CO -0.04 0.24 -0.21 -1.17 -1.11 0.00 0.00 175.55 173.26 2a3t s LEU 90 N -1.86 1.98 -1.01 -1.29 2.96 0.76 -4.88 118.68 115.32 2a3t s LEU 90 Ca 0.09 -0.52 -0.23 0.00 -0.22 0.00 0.00 54.13 53.25 2a3t s LEU 90 Cb -0.10 -1.29 -0.04 0.00 0.50 0.00 0.00 46.19 45.26 2a3t s LEU 90 CO 0.05 0.10 1.87 -1.10 -1.32 0.00 0.00 176.35 175.94 2a3t s GLN 91 N 0.62 2.75 0.46 1.98 -1.52 -1.26 -0.62 119.66 122.07 2a3t s GLN 91 Ca -0.13 -0.72 -0.07 0.00 -1.95 0.00 0.00 55.36 52.48 2a3t s GLN 91 Cb -0.17 -5.18 -0.04 0.00 -0.22 0.00 0.00 33.01 27.40 2a3t s GLN 91 CO 0.04 -3.33 0.79 0.00 -0.25 0.00 0.00 175.29 172.53 2a3t s ALA 92 N 9.37 3.38 -0.07 6.09 0.00 -0.36 -4.71 121.76 135.46 2a3t s ALA 92 Ca 0.66 -0.40 -0.00 0.00 0.00 0.00 0.00 51.96 52.21 2a3t s ALA 92 Cb -0.04 -2.64 0.03 0.00 0.00 0.00 0.00 23.12 20.47 2a3t s ALA 92 CO 0.02 -0.25 -0.02 -1.64 0.00 0.00 0.00 175.76 173.87 2a3t s MET 93 N -4.48 0.80 0.07 0.00 1.00 -0.19 -1.96 119.30 114.54 2a3t s MET 93 Ca 0.49 -0.01 0.06 0.00 0.00 0.00 0.00 55.69 56.23 2a3t s MET 93 Cb -0.10 -1.00 -0.03 0.00 0.00 0.00 0.00 34.83 33.70 2a3t s MET 93 CO 0.41 -0.22 -0.16 0.95 0.00 0.00 0.00 175.02 176.00 2a3t s THR 94 N 1.57 1.25 -0.34 2.05 -4.23 -0.30 -2.38 115.64 113.27 2a3t s THR 94 Ca -0.01 -1.32 -0.26 0.00 -1.18 0.00 0.00 61.69 58.92 2a3t s THR 94 Cb -0.13 -1.17 0.01 0.00 1.34 0.00 0.00 72.50 72.55 2a3t s THR 94 CO -0.04 -0.16 0.92 -0.36 -0.54 0.00 0.00 174.62 174.45 2a3t s PHE 95 N -1.20 3.13 -1.12 3.99 0.08 -1.26 -1.38 117.98 120.22 2a3t s PHE 95 Ca 0.00 0.89 0.00 0.00 0.12 0.00 0.00 56.93 57.94 2a3t s PHE 95 Cb -0.10 -3.53 0.00 0.00 -0.57 0.00 0.00 43.02 38.82 2a3t s PHE 95 CO 0.03 -0.74 0.00 -0.25 -0.10 0.00 0.00 175.22 174.16 2a3t n ASP 96 N 6.63 -4.68 0.00 1.36 9.92 0.13 -3.19 116.55 126.72 2a3t n ASP 96 Ca 0.07 0.26 0.00 0.00 -0.53 0.00 0.00 54.79 54.59 2a3t n ASP 96 Cb 0.48 -3.11 0.00 0.00 -0.64 0.00 0.00 41.12 37.85 2a3t n ASP 96 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2a3t n GLY 97 N -1.14 0.83 3.43 0.44 0.00 -1.26 -4.96 105.19 102.53 2a3t n GLY 97 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.63 2a3t n GLY 97 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a3t s SER 98 N -2.90 3.53 -0.21 1.61 1.04 -1.19 -5.04 113.70 110.54 2a3t s SER 98 Ca 0.00 -0.75 0.01 0.00 0.48 0.00 0.00 55.95 55.70 2a3t s SER 98 Cb 0.00 -0.33 0.04 0.00 0.10 0.00 0.00 66.02 65.84 2a3t s SER 98 CO 0.00 0.15 -0.12 -0.63 0.98 0.00 0.00 173.24 173.62 2a3t s ILE 99 N -1.34 1.85 1.02 -1.02 1.01 -1.26 -3.30 121.20 118.16 2a3t s ILE 99 Ca 0.18 -1.16 -0.16 0.00 0.00 0.00 0.00 60.65 59.51 2a3t s ILE 99 Cb -0.09 -1.89 0.20 0.00 0.01 0.00 0.00 42.46 40.69 2a3t s ILE 99 CO 0.09 0.18 1.18 -2.16 0.00 0.00 0.00 174.94 174.23 2a3t s PRO 100 N 1.30 0.25 0.84 2.79 0.04 -1.26 -1.46 135.00 137.50 2a3t s PRO 100 Ca -0.02 -0.03 -0.13 0.00 0.04 0.00 0.00 61.00 60.86 2a3t s PRO 100 Cb -0.17 -1.77 0.09 0.00 0.04 0.00 0.00 34.50 32.70 2a3t s PRO 100 CO -0.08 -2.74 1.10 0.41 0.04 0.00 0.00 177.00 175.73 2a3t n GLY 101 N -2.29 -0.33 3.76 0.56 0.00 -0.20 -4.71 105.19 101.98 2a3t n GLY 101 Ca 0.11 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 2a3t n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2a3t s PRO 102 N -4.15 2.53 0.01 1.61 0.04 -1.26 -4.29 135.00 129.48 2a3t s PRO 102 Ca 0.70 1.43 -0.30 0.00 0.04 0.00 0.00 61.00 62.88 2a3t s PRO 102 Cb -0.27 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 2a3t s PRO 102 CO 0.54 -1.47 0.96 -1.17 0.04 0.00 0.00 177.00 175.90 2a3t s LEU 103 N -5.14 4.38 -0.11 -3.56 2.96 -1.26 -4.17 118.68 111.78 2a3t s LEU 103 Ca 0.67 1.65 -0.05 0.00 -0.22 0.00 0.00 54.13 56.18 2a3t s LEU 103 Cb -0.22 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 2a3t s LEU 103 CO 0.45 -0.23 0.09 -0.04 -1.32 0.00 0.00 176.35 175.30 2a3t s MET 104 N 0.88 3.34 -0.09 1.98 -1.94 -0.83 -4.53 119.30 118.12 2a3t s MET 104 Ca 0.51 -0.23 0.01 0.00 -1.71 0.00 0.00 55.69 54.26 2a3t s MET 104 Cb -0.21 -3.07 0.02 0.00 2.01 0.00 0.00 34.83 33.58 2a3t s MET 104 CO 0.28 0.71 -0.10 0.42 -0.01 0.00 0.00 175.02 176.32 2a3t s ILE 105 N -0.86 1.10 0.31 2.53 1.01 -1.26 0.42 121.20 124.45 2a3t s ILE 105 Ca 0.14 -0.40 0.04 0.00 0.00 0.00 0.00 60.65 60.43 2a3t s ILE 105 Cb -0.12 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.27 2a3t s ILE 105 CO 0.03 0.36 0.29 0.68 0.00 0.00 0.00 174.94 176.31 2a3t s VAL 106 N 1.16 0.00 0.15 2.92 -7.23 -0.45 -4.99 120.40 111.96 2a3t s VAL 106 Ca -0.05 -1.92 0.08 0.00 -1.81 0.00 0.00 61.98 58.27 2a3t s VAL 106 Cb -0.14 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.24 2a3t s VAL 106 CO -0.02 0.00 -0.07 -1.00 -0.31 0.00 0.00 175.10 173.70 2a3t s HIS 107 N -3.50 2.75 0.15 2.82 3.76 -1.26 -0.60 115.29 119.40 2a3t s HIS 107 Ca 0.38 -0.17 -0.32 0.00 -0.15 0.00 0.00 55.06 54.80 2a3t s HIS 107 Cb 0.03 -1.37 -0.12 0.00 1.11 0.00 0.00 32.58 32.22 2a3t s HIS 107 CO 0.24 0.48 1.73 -1.91 -0.85 0.00 0.00 174.74 174.43 2a3t n GLU 108 N 0.23 2.56 0.00 1.40 2.13 0.18 -1.20 120.64 125.95 2a3t n GLU 108 Ca -0.11 0.93 0.00 0.00 0.66 0.00 0.00 57.16 58.63 2a3t n GLU 108 Cb 0.54 -2.77 0.00 0.00 0.27 0.00 0.00 31.44 29.49 2a3t n GLU 108 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2a3t n GLY 109 N 3.92 1.92 3.64 8.31 0.00 0.16 -4.60 105.19 118.55 2a3t n GLY 109 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2a3t n GLY 109 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a3t s ASP 110 N -1.69 2.58 0.14 1.61 1.01 -0.34 -4.75 116.67 115.23 2a3t s ASP 110 Ca 0.00 1.62 0.03 0.00 0.71 0.00 0.00 52.55 54.91 2a3t s ASP 110 Cb 0.00 -2.27 -0.04 0.00 1.01 0.00 0.00 42.92 41.62 2a3t s ASP 110 CO 0.00 -3.22 0.20 -0.31 0.21 0.00 0.00 175.17 172.05 2a3t s TYR 111 N -2.74 3.32 -0.16 4.23 1.51 -0.29 -0.88 117.35 122.34 2a3t s TYR 111 Ca 0.66 0.07 0.02 0.00 -1.01 0.00 0.00 57.07 56.80 2a3t s TYR 111 Cb -0.21 -1.61 0.02 0.00 -0.11 0.00 0.00 41.96 40.05 2a3t s TYR 111 CO 0.59 0.52 -0.21 0.08 -1.11 0.00 0.00 175.55 175.43 2a3t s VAL 112 N -1.69 2.05 -0.33 0.71 1.01 0.27 -0.45 120.40 121.96 2a3t s VAL 112 Ca 0.33 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 2a3t s VAL 112 Cb -0.11 -1.83 0.07 0.00 0.00 0.00 0.00 36.38 34.51 2a3t s VAL 112 CO 0.26 0.54 0.06 -0.70 0.00 0.00 0.00 175.10 175.25 2a3t s GLU 113 N 1.12 2.21 -0.20 2.72 2.12 0.11 -1.19 118.70 125.58 2a3t s GLU 113 Ca 0.01 -1.48 -0.07 0.00 0.36 0.00 0.00 54.97 53.79 2a3t s GLU 113 Cb -0.14 -3.28 -0.04 0.00 0.26 0.00 0.00 34.13 30.93 2a3t s GLU 113 CO -0.09 -0.77 0.06 -1.17 -0.54 0.00 0.00 175.26 172.75 2a3t s LEU 114 N 1.18 3.64 -0.29 2.70 2.96 0.28 -1.81 118.68 127.35 2a3t s LEU 114 Ca -0.00 -0.04 -0.18 0.00 -0.22 0.00 0.00 54.13 53.69 2a3t s LEU 114 Cb -0.20 -1.94 -0.02 0.00 0.50 0.00 0.00 46.19 44.53 2a3t s LEU 114 CO -0.03 0.10 0.50 -0.89 -1.32 0.00 0.00 176.35 174.71 2a3t s THR 115 N 0.82 5.06 -0.11 3.68 2.01 -0.10 -1.31 115.64 125.69 2a3t s THR 115 Ca 0.03 0.69 0.01 0.00 0.31 0.00 0.00 61.69 62.74 2a3t s THR 115 Cb -0.14 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.51 2a3t s THR 115 CO 0.02 0.01 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.59 2a3t s LEU 116 N 2.31 2.59 -0.11 4.42 2.96 -0.05 -1.42 118.68 129.38 2a3t s LEU 116 Ca 0.20 -0.35 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 2a3t s LEU 116 Cb -0.16 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 44.99 2a3t s LEU 116 CO 0.10 0.19 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.54 2a3t s ILE 117 N 0.18 1.57 -0.53 6.68 1.01 -0.66 -1.36 121.20 128.09 2a3t s ILE 117 Ca -0.09 -0.69 -0.04 0.00 0.00 0.00 0.00 60.65 59.84 2a3t s ILE 117 Cb -0.15 -1.43 0.14 0.00 0.01 0.00 0.00 42.46 41.03 2a3t s ILE 117 CO 0.05 0.46 0.35 0.21 0.00 0.00 0.00 174.94 176.01 2a3t s ASN 118 N 0.96 5.33 0.65 3.58 2.47 -0.54 -0.83 114.94 126.55 2a3t s ASN 118 Ca -0.07 -2.44 -0.18 0.00 0.42 0.00 0.00 52.86 50.60 2a3t s ASN 118 Cb -0.15 -1.87 -0.02 0.00 -1.45 0.00 0.00 41.25 37.76 2a3t s ASN 118 CO -0.02 -0.48 1.20 -0.81 -3.72 0.00 0.00 177.10 173.28 2a3t n PRO 119 N 4.07 1.02 0.33 0.43 -0.04 -1.26 1.00 135.00 140.55 2a3t n PRO 119 Ca 0.02 0.40 0.21 0.00 -0.04 0.00 0.00 63.50 64.10 2a3t n PRO 119 Cb 0.40 -2.43 1.12 0.00 -0.04 0.00 0.00 33.50 32.54 2a3t n PRO 119 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2a3t h PRO 120 N 0.45 0.00 0.00 0.54 0.13 -1.90 -1.90 132.00 129.33 2a3t h PRO 120 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2a3t h PRO 120 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2a3t h PRO 120 CO 0.52 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.44 2a3t n GLU 121 N -3.01 0.10 -1.37 0.86 0.00 -1.26 -4.68 120.64 111.27 2a3t n GLU 121 Ca -0.03 0.12 -0.31 0.00 0.00 0.00 0.00 57.16 56.94 2a3t n GLU 121 Cb 0.13 -1.62 0.08 0.00 0.00 0.00 0.00 31.44 30.03 2a3t n GLU 121 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 2a3t s ASN 122 N -3.57 4.80 -0.03 -1.84 0.01 -0.72 -4.99 114.94 108.60 2a3t s ASN 122 Ca 0.12 1.74 0.18 0.00 -0.71 0.00 0.00 52.86 54.18 2a3t s ASN 122 Cb 0.15 -2.50 -0.27 0.00 0.41 0.00 0.00 41.25 39.04 2a3t s ASN 122 CO 0.52 -1.83 0.38 0.35 -1.51 0.00 0.00 177.10 175.00 2a3t n THR 123 N -3.39 0.01 -4.38 1.60 -2.24 -1.26 -4.76 114.28 99.87 2a3t n THR 123 Ca 0.08 -0.41 -0.26 0.00 -2.27 0.00 0.00 64.05 61.20 2a3t n THR 123 Cb 0.53 0.09 -0.12 0.00 -2.10 0.00 0.00 70.33 68.73 2a3t n THR 123 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2a3t s MET 124 N -3.21 1.37 0.54 -0.78 -1.94 -1.26 -4.95 119.30 109.08 2a3t s MET 124 Ca -0.06 -1.39 -0.19 0.00 -1.71 0.00 0.00 55.69 52.34 2a3t s MET 124 Cb 0.11 -1.71 -0.06 0.00 2.01 0.00 0.00 34.83 35.18 2a3t s MET 124 CO 0.73 0.38 1.12 -2.14 -0.01 0.00 0.00 175.02 175.11 2a3t s PRO 125 N -2.35 3.36 0.14 2.03 0.02 -1.26 -4.17 135.00 132.78 2a3t s PRO 125 Ca 0.15 1.58 -0.06 0.00 0.02 0.00 0.00 61.00 62.70 2a3t s PRO 125 Cb -0.09 -2.01 -0.02 0.00 0.02 0.00 0.00 34.50 32.40 2a3t s PRO 125 CO 0.07 -0.83 0.18 -1.01 -0.33 0.00 0.00 177.00 175.08 2a3t s HIS 126 N -1.81 0.55 0.00 6.54 3.76 -0.77 -4.92 115.29 118.64 2a3t s HIS 126 Ca 0.72 -0.93 0.00 0.00 -0.15 0.00 0.00 55.06 54.70 2a3t s HIS 126 Cb -0.23 -0.23 0.00 0.00 1.11 0.00 0.00 32.58 33.23 2a3t s HIS 126 CO 0.27 -0.62 0.00 0.27 -0.85 0.00 0.00 174.74 173.81 2a3t n ASN 127 N -0.14 0.00 -3.72 1.40 6.94 -1.26 -0.89 115.26 117.58 2a3t n ASN 127 Ca -0.08 -0.29 -0.12 0.00 -0.02 0.00 0.00 54.58 54.07 2a3t n ASN 127 Cb 0.63 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.93 2a3t n ASN 127 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 2a3t s ILE 128 N -2.56 -0.03 -0.28 1.53 2.07 -1.26 -4.21 121.20 116.47 2a3t s ILE 128 Ca 0.00 0.10 -0.01 0.00 -1.41 0.00 0.00 60.65 59.33 2a3t s ILE 128 Cb 0.00 -0.49 0.04 0.00 0.13 0.00 0.00 42.46 42.14 2a3t s ILE 128 CO 0.00 0.04 -0.04 -0.62 -1.91 0.00 0.00 174.94 172.41 2a3t s ASP 129 N 1.11 4.61 -0.26 4.50 -1.08 0.75 -1.61 116.67 124.71 2a3t s ASP 129 Ca -0.08 -1.16 -0.19 0.00 -0.52 0.00 0.00 52.55 50.60 2a3t s ASP 129 Cb -0.08 -1.67 -0.02 0.00 -1.46 0.00 0.00 42.92 39.69 2a3t s ASP 129 CO -0.09 -0.20 0.59 -0.36 0.52 0.00 0.00 175.17 175.63 2a3t s PHE 130 N 1.25 3.28 -0.15 -5.34 0.08 0.17 -1.27 117.98 115.99 2a3t s PHE 130 Ca -0.04 0.75 0.28 0.00 0.12 0.00 0.00 56.93 58.05 2a3t s PHE 130 Cb -0.19 -2.80 1.27 0.00 -0.57 0.00 0.00 43.02 40.74 2a3t s PHE 130 CO -0.03 -0.31 1.85 0.45 -0.10 0.00 0.00 175.22 177.09 2a3t h HIS 131 N 7.93 0.00 0.00 0.36 3.86 -1.44 -2.02 115.15 123.84 2a3t h HIS 131 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 2a3t h HIS 131 Cb 1.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.60 2a3t h HIS 131 CO 0.75 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.54 2a3t h ALA 132 N 2.12 1.00 -2.44 2.45 0.00 -1.91 -3.47 119.26 117.01 2a3t h ALA 132 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 2a3t h ALA 132 Cb 0.32 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2a3t h ALA 132 CO 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 179.25 178.78 2a3t s ALA 133 N -3.37 3.89 -0.23 0.00 0.00 -0.76 -4.46 121.76 116.82 2a3t s ALA 133 Ca 0.05 -1.14 -0.03 0.00 0.00 0.00 0.00 51.96 50.84 2a3t s ALA 133 Cb 0.09 -1.69 0.01 0.00 0.00 0.00 0.00 23.12 21.53 2a3t s ALA 133 CO 0.49 0.43 -0.05 0.99 0.00 0.00 0.00 175.76 177.62 2a3t s THR 134 N -1.84 3.17 0.00 0.00 2.01 -1.26 -4.65 115.64 113.07 2a3t s THR 134 Ca 0.34 -0.71 0.00 0.00 0.31 0.00 0.00 61.69 61.63 2a3t s THR 134 Cb -0.10 -2.51 0.00 0.00 0.01 0.00 0.00 72.50 69.90 2a3t s THR 134 CO 0.28 0.33 0.00 0.61 -0.69 0.00 0.00 174.62 175.15 2a3t n GLY 135 N 4.75 2.96 4.12 4.40 0.00 -1.26 -4.93 105.19 115.23 2a3t n GLY 135 Ca -0.18 -1.92 -0.30 0.00 0.00 0.00 0.00 46.02 43.62 2a3t n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3t n ALA 136 N -0.11 -1.78 -3.75 4.61 0.00 -1.26 -0.44 120.51 117.79 2a3t n ALA 136 Ca 0.00 -0.23 -0.24 0.00 0.00 0.00 0.00 53.44 52.97 2a3t n ALA 136 Cb 0.00 -1.93 0.04 0.00 0.00 0.00 0.00 19.45 17.56 2a3t n ALA 136 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2a3t n LEU 137 N -4.42 -3.00 0.00 0.00 4.77 -1.26 -0.87 117.00 112.22 2a3t n LEU 137 Ca -0.19 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.01 2a3t n LEU 137 Cb 0.63 -2.69 0.00 0.00 -2.33 0.00 0.00 43.42 39.03 2a3t n LEU 137 CO 0.81 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.93 2a3t n GLY 138 N -1.62 0.39 0.00 -0.72 0.00 0.42 -1.92 105.19 101.74 2a3t n GLY 138 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2a3t n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3t n GLY 139 N -1.81 1.14 0.33 -0.02 0.00 -0.39 -0.66 105.19 103.78 2a3t n GLY 139 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2a3t n GLY 139 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2a3t h GLY 140 N 0.00 0.74 1.97 -0.02 0.00 -0.59 -1.23 103.07 103.93 2a3t h GLY 140 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2a3t h GLY 140 CO 0.00 0.22 0.00 0.61 0.00 0.00 0.00 176.54 177.37 2a3t n GLY 141 N -1.47 -1.12 0.00 4.60 0.00 -0.05 -3.14 105.19 104.01 2a3t n GLY 141 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2a3t n GLY 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2a3t n LEU 142 N -1.49 1.40 -0.04 0.99 4.77 -0.50 -4.77 117.00 117.36 2a3t n LEU 142 Ca 0.05 -1.40 0.01 0.00 -0.03 0.00 0.00 56.01 54.64 2a3t n LEU 142 Cb 0.21 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2a3t n LEU 142 CO 0.17 0.35 0.40 0.35 -1.33 0.00 0.00 177.39 177.33 2a3t n THR 143 N -0.21 0.67 -2.04 -5.08 -2.24 -1.03 -4.93 114.28 99.42 2a3t n THR 143 Ca 0.00 -0.71 -0.42 0.00 -2.27 0.00 0.00 64.05 60.65 2a3t n THR 143 Cb 0.11 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 68.91 2a3t n THR 143 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2a3t s LEU 144 N -0.77 4.23 -0.03 3.22 2.96 -1.25 -4.29 118.68 122.75 2a3t s LEU 144 Ca 0.03 2.10 0.03 0.00 -0.22 0.00 0.00 54.13 56.08 2a3t s LEU 144 Cb 0.03 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.19 2a3t s LEU 144 CO 0.00 -0.98 -0.13 0.27 -1.32 0.00 0.00 176.35 174.19 2a3t s ILE 145 N 4.24 1.10 0.52 6.68 -4.36 -0.07 -4.97 121.20 124.34 2a3t s ILE 145 Ca 0.72 -0.53 -0.07 0.00 -0.26 0.00 0.00 60.65 60.51 2a3t s ILE 145 Cb -0.31 -0.96 -0.04 0.00 1.25 0.00 0.00 42.46 42.40 2a3t s ILE 145 CO 0.28 0.33 0.86 0.20 0.24 0.00 0.00 174.94 176.85 2a3t s ASN 146 N 0.13 6.25 0.11 4.36 0.01 -1.26 -1.84 114.94 122.71 2a3t s ASN 146 Ca -0.04 1.08 -0.36 0.00 -0.71 0.00 0.00 52.86 52.84 2a3t s ASN 146 Cb -0.10 -2.32 -0.16 0.00 0.41 0.00 0.00 41.25 39.08 2a3t s ASN 146 CO 0.01 -0.67 1.31 -2.65 -1.51 0.00 0.00 177.10 173.59 2a3t n PRO 147 N -2.41 1.20 -0.33 -0.60 -0.02 -1.26 -0.66 135.00 130.92 2a3t n PRO 147 Ca 0.02 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2a3t n PRO 147 Cb 0.55 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2a3t n PRO 147 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a3t n GLY 148 N 2.43 0.70 3.62 -1.23 0.00 0.28 -4.70 105.19 106.29 2a3t n GLY 148 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2a3t n GLY 148 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a3t s GLU 149 N -0.64 2.18 0.13 1.61 2.02 0.17 -4.88 118.70 119.29 2a3t s GLU 149 Ca 0.00 -1.50 0.01 0.00 0.02 0.00 0.00 54.97 53.50 2a3t s GLU 149 Cb 0.00 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.10 2a3t s GLU 149 CO 0.00 0.34 -0.00 -1.59 0.02 0.00 0.00 175.26 174.03 2a3t s LYS 150 N -3.65 0.95 0.00 1.61 -2.85 -1.26 -1.47 119.74 113.06 2a3t s LYS 150 Ca 0.32 -1.43 -0.16 0.00 -1.00 0.00 0.00 55.97 53.69 2a3t s LYS 150 Cb -0.06 -0.08 0.03 0.00 -2.06 0.00 0.00 37.83 35.66 2a3t s LYS 150 CO 0.19 -0.14 0.34 0.54 0.10 0.00 0.00 175.35 176.39 2a3t s VAL 151 N -3.77 0.06 -0.14 1.79 0.11 -0.47 -5.01 120.40 112.97 2a3t s VAL 151 Ca 0.19 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 2a3t s VAL 151 Cb 0.06 -0.74 0.02 0.00 -1.53 0.00 0.00 36.38 34.20 2a3t s VAL 151 CO -0.00 -0.27 -0.12 -0.69 -3.33 0.00 0.00 175.10 170.69 2a3t s VAL 152 N -1.68 1.40 -0.10 2.04 1.01 -1.26 -0.87 120.40 120.94 2a3t s VAL 152 Ca -0.11 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.35 2a3t s VAL 152 Cb -0.04 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.98 2a3t s VAL 152 CO 0.02 0.42 -0.10 -0.22 0.00 0.00 0.00 175.10 175.23 2a3t s LEU 153 N 1.56 2.93 -0.08 3.92 2.96 -0.43 -4.96 118.68 124.58 2a3t s LEU 153 Ca 0.05 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 2a3t s LEU 153 Cb -0.13 -1.64 -0.02 0.00 0.50 0.00 0.00 46.19 44.90 2a3t s LEU 153 CO -0.10 0.27 -0.16 -0.60 -1.32 0.00 0.00 176.35 174.44 2a3t s ARG 154 N -0.24 2.79 0.05 1.98 3.52 -1.26 -0.55 118.95 125.25 2a3t s ARG 154 Ca 0.02 -0.73 0.00 0.00 -0.13 0.00 0.00 55.73 54.90 2a3t s ARG 154 Cb -0.13 -2.43 -0.03 0.00 -1.56 0.00 0.00 34.95 30.80 2a3t s ARG 154 CO 0.03 0.45 -0.04 -0.59 -0.81 0.00 0.00 175.30 174.34 2a3t s PHE 155 N -0.29 0.55 -0.14 5.12 -0.12 -0.34 -4.98 117.98 117.78 2a3t s PHE 155 Ca 0.02 -0.86 -0.18 0.00 -0.05 0.00 0.00 56.93 55.86 2a3t s PHE 155 Cb -0.13 -0.37 -0.04 0.00 -0.63 0.00 0.00 43.02 41.85 2a3t s PHE 155 CO 0.03 -0.26 0.47 0.21 -0.05 0.00 0.00 175.22 175.61 2a3t s LYS 156 N -3.12 4.30 -1.25 1.99 2.20 -1.26 -0.57 119.74 122.03 2a3t s LYS 156 Ca 0.01 0.40 -0.14 0.00 -0.36 0.00 0.00 55.97 55.89 2a3t s LYS 156 Cb 0.02 -3.47 0.15 0.00 -1.51 0.00 0.00 37.83 33.02 2a3t s LYS 156 CO -0.06 0.09 1.58 0.00 -0.36 0.00 0.00 175.35 176.61 2a3t n ALA 157 N 3.93 4.11 0.90 3.13 0.00 -0.06 -4.70 120.51 127.82 2a3t n ALA 157 Ca -0.07 -4.18 0.14 0.00 0.00 0.00 0.00 53.44 49.33 2a3t n ALA 157 Cb 0.51 -3.16 0.57 0.00 0.00 0.00 0.00 19.45 17.37 2a3t n ALA 157 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2a3t n THR 158 N 4.73 0.16 -4.31 0.00 -2.24 -1.26 -0.66 114.28 110.70 2a3t n THR 158 Ca 0.40 -0.04 -0.21 0.00 -2.27 0.00 0.00 64.05 61.92 2a3t n THR 158 Cb 0.42 -0.54 -0.16 0.00 -2.10 0.00 0.00 70.33 67.95 2a3t n THR 158 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2a3t s ARG 159 N -3.02 1.10 0.27 -0.78 0.52 -1.26 -4.76 118.95 111.02 2a3t s ARG 159 Ca 0.13 -0.21 -0.29 0.00 -0.52 0.00 0.00 55.73 54.85 2a3t s ARG 159 Cb 0.17 -1.01 -0.09 0.00 0.52 0.00 0.00 34.95 34.54 2a3t s ARG 159 CO 0.53 -0.04 0.96 0.00 0.02 0.00 0.00 175.30 176.78 2a3t s ALA 160 N 0.79 3.30 0.00 2.13 0.00 -1.26 -4.78 121.76 121.94 2a3t s ALA 160 Ca -0.13 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.46 2a3t s ALA 160 Cb -0.15 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2a3t s ALA 160 CO 0.01 0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.33 2a3t n GLY 161 N 1.14 1.92 3.77 0.00 0.00 0.70 -2.98 105.19 109.74 2a3t n GLY 161 Ca -0.00 -1.50 -0.38 0.00 0.00 0.00 0.00 46.02 44.13 2a3t n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3t s ALA 162 N -1.84 3.53 0.04 4.61 0.00 0.37 -0.74 121.76 127.72 2a3t s ALA 162 Ca 0.00 -0.05 0.04 0.00 0.00 0.00 0.00 51.96 51.95 2a3t s ALA 162 Cb 0.00 -2.66 -0.02 0.00 0.00 0.00 0.00 23.12 20.44 2a3t s ALA 162 CO 0.00 0.21 -0.11 -0.06 0.00 0.00 0.00 175.76 175.80 2a3t s PHE 163 N -0.27 0.92 0.42 0.00 0.40 0.44 -4.29 117.98 115.59 2a3t s PHE 163 Ca 0.29 -0.41 -0.24 0.00 -0.60 0.00 0.00 56.93 55.97 2a3t s PHE 163 Cb -0.18 -0.54 -0.09 0.00 0.51 0.00 0.00 43.02 42.73 2a3t s PHE 163 CO 0.15 -0.01 1.08 0.08 0.70 0.00 0.00 175.22 177.23 2a3t s VAL 164 N -1.08 3.56 0.06 -0.44 1.01 -1.26 -0.84 120.40 121.41 2a3t s VAL 164 Ca -0.04 1.18 0.08 0.00 0.00 0.00 0.00 61.98 63.21 2a3t s VAL 164 Cb -0.09 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 2a3t s VAL 164 CO 0.01 -0.00 -0.23 -0.72 0.00 0.00 0.00 175.10 174.16 2a3t s TYR 165 N -1.63 2.03 0.16 5.22 -0.85 -0.61 -1.18 117.35 120.48 2a3t s TYR 165 Ca 0.59 -0.39 -0.19 0.00 -0.52 0.00 0.00 57.07 56.56 2a3t s TYR 165 Cb -0.24 -1.18 0.04 0.00 0.38 0.00 0.00 41.96 40.96 2a3t s TYR 165 CO 0.29 0.15 0.51 -3.38 -1.52 0.00 0.00 175.55 171.60 2a3t s HIS 166 N -0.88 -0.28 0.33 -3.49 -3.43 -0.40 -0.39 115.29 106.75 2a3t s HIS 166 Ca 0.09 -0.02 -0.26 0.00 -0.80 0.00 0.00 55.06 54.07 2a3t s HIS 166 Cb -0.09 0.40 -0.09 0.00 -1.43 0.00 0.00 32.58 31.36 2a3t s HIS 166 CO 0.03 -0.82 1.00 0.00 -2.00 0.00 0.00 174.74 172.94 2a3t n ALA 168 N 0.58 -0.09 0.60 0.00 0.00 -1.26 -4.50 120.51 115.85 2a3t n ALA 168 Ca 0.02 -2.08 0.11 0.00 0.00 0.00 0.00 53.44 51.49 2a3t n ALA 168 Cb 0.49 -1.15 0.45 0.00 0.00 0.00 0.00 19.45 19.23 2a3t n ALA 168 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2a3t n PRO 169 N 1.44 0.11 0.00 0.00 -0.02 -1.26 -4.90 135.00 130.37 2a3t n PRO 169 Ca 0.13 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2a3t n PRO 169 Cb 0.61 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 2a3t n PRO 169 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a3t n GLY 170 N 0.58 4.19 7.00 -1.23 0.00 -1.26 -4.97 105.19 109.50 2a3t n GLY 170 Ca 0.04 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2a3t n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3t n GLY 171 N -1.24 2.57 0.29 -0.02 0.00 -1.26 -2.00 105.19 103.53 2a3t n GLY 171 Ca 0.00 -0.25 0.19 0.00 0.00 0.00 0.00 46.02 45.96 2a3t n GLY 171 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2a3t h PRO 172 N 0.00 0.00 -0.08 1.61 0.11 -2.03 -1.29 132.00 130.31 2a3t h PRO 172 Ca 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 2a3t h PRO 172 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 2a3t h PRO 172 CO 0.00 0.00 -0.09 0.52 -0.21 0.00 0.00 178.00 178.22 2a3t h MET 173 N 0.00 0.12 0.37 1.05 2.86 -1.80 -3.20 114.93 114.34 2a3t h MET 173 Ca 0.00 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2a3t h MET 173 Cb 0.07 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2a3t h MET 173 CO 0.00 0.22 -0.29 0.82 1.06 0.00 0.00 176.91 178.72 2a3t h ILE 174 N 0.12 0.00 -0.84 -1.22 2.04 -1.31 -0.02 117.51 116.28 2a3t h ILE 174 Ca 0.03 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.89 2a3t h ILE 174 Cb 0.24 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.28 2a3t h ILE 174 CO 0.01 0.00 0.55 1.55 0.00 0.00 0.00 178.15 180.27 2a3t h PRO 175 N -0.65 1.11 -0.35 2.37 0.13 -1.77 -2.61 132.00 130.24 2a3t h PRO 175 Ca -0.05 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.99 2a3t h PRO 175 Cb 0.54 -0.25 -0.02 0.00 0.13 0.00 0.00 31.00 31.40 2a3t h PRO 175 CO 0.01 0.74 0.14 2.35 -0.23 0.00 0.00 178.00 181.01 2a3t h TRP 176 N 1.14 0.52 -0.61 1.56 7.01 -1.50 0.32 115.95 124.39 2a3t h TRP 176 Ca 0.31 -0.04 -0.07 0.00 2.11 0.00 0.00 58.89 61.20 2a3t h TRP 176 Cb -0.13 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 26.75 2a3t h TRP 176 CO 0.00 0.48 0.10 0.45 -2.79 0.00 0.00 178.44 176.68 2a3t h HIS 177 N 0.41 1.08 -0.00 2.65 3.86 -0.89 -1.82 115.15 120.44 2a3t h HIS 177 Ca 0.12 -0.15 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2a3t h HIS 177 Cb 0.17 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.35 2a3t h HIS 177 CO -0.01 0.92 0.00 0.28 0.86 0.00 0.00 177.93 179.99 2a3t h VAL 178 N 0.92 1.10 0.00 2.45 2.07 -1.15 -2.17 116.25 119.47 2a3t h VAL 178 Ca 0.19 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2a3t h VAL 178 Cb 0.43 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2a3t h VAL 178 CO 0.01 0.08 0.00 1.33 0.02 0.00 0.00 177.57 179.01 2a3t n VAL 179 N -5.03 0.31 1.12 2.57 0.24 0.07 -0.93 118.33 116.68 2a3t n VAL 179 Ca -0.07 0.08 0.12 0.00 -2.04 0.00 0.00 64.34 62.43 2a3t n VAL 179 Cb 0.09 -0.74 0.35 0.00 -1.47 0.00 0.00 33.84 32.06 2a3t n VAL 179 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2a3t n SER 180 N -1.24 2.15 0.00 -1.34 7.64 -0.69 -4.62 113.62 115.51 2a3t n SER 180 Ca 0.11 -1.74 0.00 0.00 1.01 0.00 0.00 58.87 58.24 2a3t n SER 180 Cb 0.15 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 2a3t n SER 180 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2a3t n GLY 181 N 1.25 0.90 3.17 0.23 0.00 -0.11 -1.02 105.19 109.61 2a3t n GLY 181 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2a3t n GLY 181 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2a3t n MET 182 N -0.50 3.45 -3.55 1.61 2.81 -0.85 -4.57 117.12 115.52 2a3t n MET 182 Ca 0.00 -3.62 -0.17 0.00 -1.81 0.00 0.00 57.70 52.10 2a3t n MET 182 Cb 0.00 -3.03 -0.06 0.00 -0.71 0.00 0.00 33.22 29.42 2a3t n MET 182 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2a3t s ALA 183 N 1.25 -1.76 0.00 3.04 0.00 -1.26 -1.56 121.76 121.47 2a3t s ALA 183 Ca 0.42 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.88 2a3t s ALA 183 Cb 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.85 2a3t s ALA 183 CO 0.00 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 175.81 2a3t n GLY 184 N 1.39 4.49 3.17 0.00 0.00 0.47 -1.03 105.19 113.69 2a3t n GLY 184 Ca -0.18 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.79 2a3t n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3t s ILE 186 N -0.41 2.13 -0.24 0.00 2.07 -0.02 -1.96 121.20 122.78 2a3t s ILE 186 Ca -0.05 -1.00 -0.06 0.00 -1.41 0.00 0.00 60.65 58.13 2a3t s ILE 186 Cb -0.03 -1.81 -0.02 0.00 0.13 0.00 0.00 42.46 40.72 2a3t s ILE 186 CO 0.01 0.56 0.03 -0.32 -1.91 0.00 0.00 174.94 173.31 2a3t s MET 187 N 0.28 3.56 -0.46 3.50 -2.45 0.17 -0.42 119.30 123.48 2a3t s MET 187 Ca -0.17 -0.53 -0.12 0.00 -1.25 0.00 0.00 55.69 53.63 2a3t s MET 187 Cb -0.17 -3.20 0.10 0.00 1.25 0.00 0.00 34.83 32.80 2a3t s MET 187 CO 0.08 -0.17 0.35 0.08 1.05 0.00 0.00 175.02 176.41 2a3t s VAL 188 N 1.52 4.59 0.36 10.11 1.01 0.08 -1.33 120.40 136.73 2a3t s VAL 188 Ca 0.06 -1.44 -0.22 0.00 0.00 0.00 0.00 61.98 60.38 2a3t s VAL 188 Cb -0.15 -3.87 -0.10 0.00 0.00 0.00 0.00 36.38 32.27 2a3t s VAL 188 CO 0.01 -0.65 0.90 -0.76 0.00 0.00 0.00 175.10 174.60 2a3t s LEU 189 N 1.48 4.13 0.57 3.92 1.43 0.23 -0.22 118.68 130.23 2a3t s LEU 189 Ca 0.04 1.66 -0.20 0.00 -1.03 0.00 0.00 54.13 54.60 2a3t s LEU 189 Cb -0.25 -4.21 -0.04 0.00 0.03 0.00 0.00 46.19 41.72 2a3t s LEU 189 CO 0.02 -0.20 1.27 -2.65 0.23 0.00 0.00 176.35 175.02 2a3t n PRO 190 N -0.06 1.42 0.12 1.29 -0.02 -1.26 -0.65 135.00 135.84 2a3t n PRO 190 Ca 0.04 0.53 0.17 0.00 -2.02 0.00 0.00 63.50 62.22 2a3t n PRO 190 Cb 0.52 -2.48 0.72 0.00 -0.02 0.00 0.00 33.50 32.25 2a3t n PRO 190 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a3t h ARG 191 N 1.08 0.00 -0.62 -0.52 3.08 -1.90 -0.81 114.38 114.70 2a3t h ARG 191 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 2a3t h ARG 191 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.37 2a3t h ARG 191 CO 0.55 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 179.20 2a3t n ASP 192 N -4.22 5.38 -0.02 7.04 10.43 -1.26 -1.10 116.55 132.80 2a3t n ASP 192 Ca 0.04 -2.73 0.00 0.00 2.57 0.00 0.00 54.79 54.67 2a3t n ASP 192 Cb 0.41 -0.65 -0.00 0.00 1.84 0.00 0.00 41.12 42.72 2a3t n ASP 192 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2a3t n GLY 193 N 0.85 -1.49 3.77 0.44 0.00 -0.31 -4.81 105.19 103.64 2a3t n GLY 193 Ca 0.27 -1.52 -0.36 0.00 0.00 0.00 0.00 46.02 44.42 2a3t n GLY 193 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a3t s LEU 194 N -3.03 3.78 0.08 0.99 1.43 -1.26 -4.49 118.68 116.19 2a3t s LEU 194 Ca 0.00 2.25 0.06 0.00 -1.03 0.00 0.00 54.13 55.41 2a3t s LEU 194 Cb 0.00 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.67 2a3t s LEU 194 CO 0.00 -1.24 -0.16 -0.54 0.23 0.00 0.00 176.35 174.64 2a3t s LYS 195 N -3.19 0.91 0.28 1.70 -0.14 -1.26 -1.04 119.74 117.00 2a3t s LYS 195 Ca 0.72 -1.03 -0.03 0.00 -1.36 0.00 0.00 55.97 54.28 2a3t s LYS 195 Cb -0.26 -0.97 0.06 0.00 -1.68 0.00 0.00 37.83 34.98 2a3t s LYS 195 CO 0.30 0.22 0.38 -0.40 -0.76 0.00 0.00 175.35 175.09 2a3t n ASP 196 N 1.17 0.23 0.17 2.83 5.68 0.11 -4.83 116.55 121.91 2a3t n ASP 196 Ca -0.20 -1.26 0.12 0.00 -0.50 0.00 0.00 54.79 52.94 2a3t n ASP 196 Cb 0.54 -0.28 0.62 0.00 -1.14 0.00 0.00 41.12 40.87 2a3t n ASP 196 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 2a3t h HIS 197 N -0.87 0.00 -0.37 2.11 2.07 -1.90 0.11 115.15 116.30 2a3t h HIS 197 Ca -0.13 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.39 2a3t h HIS 197 Cb 0.39 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.37 2a3t h HIS 197 CO 0.00 0.00 0.00 0.39 -3.07 0.00 0.00 177.93 175.25 2a3t n GLU 198 N -2.31 2.92 -1.03 5.12 1.02 -1.26 -4.97 120.64 120.12 2a3t n GLU 198 Ca -0.01 -2.25 -0.01 0.00 -0.02 0.00 0.00 57.16 54.87 2a3t n GLU 198 Cb 0.05 -1.41 -0.00 0.00 -0.02 0.00 0.00 31.44 30.06 2a3t n GLU 198 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2a3t n GLY 199 N 0.45 0.48 3.77 0.62 0.00 0.02 -5.02 105.19 105.51 2a3t n GLY 199 Ca 0.15 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 2a3t n GLY 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a3t s LYS 200 N -0.94 4.65 0.32 1.61 1.02 -1.26 -4.69 119.74 120.45 2a3t s LYS 200 Ca 0.00 1.27 -0.29 0.00 0.02 0.00 0.00 55.97 56.96 2a3t s LYS 200 Cb 0.00 -3.23 -0.11 0.00 -0.52 0.00 0.00 37.83 33.97 2a3t s LYS 200 CO 0.00 0.54 1.43 -1.25 -0.92 0.00 0.00 175.35 175.15 2a3t s PRO 201 N -1.23 4.23 -0.00 -1.68 0.04 -1.26 0.07 135.00 135.16 2a3t s PRO 201 Ca 0.38 2.39 0.04 0.00 0.04 0.00 0.00 61.00 63.86 2a3t s PRO 201 Cb -0.24 -3.04 -0.01 0.00 0.04 0.00 0.00 34.50 31.25 2a3t s PRO 201 CO 0.28 -0.41 -0.13 0.08 0.04 0.00 0.00 177.00 176.85 2a3t s VAL 202 N -0.68 1.05 -0.01 -0.36 1.01 -0.20 -4.84 120.40 116.37 2a3t s VAL 202 Ca 0.55 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.92 2a3t s VAL 202 Cb -0.43 -0.89 -0.00 0.00 0.00 0.00 0.00 36.38 35.06 2a3t s VAL 202 CO 0.53 0.25 -0.08 -0.13 0.00 0.00 0.00 175.10 175.66 2a3t s ARG 203 N -0.44 0.76 0.11 2.72 0.52 -1.26 -3.98 118.95 117.38 2a3t s ARG 203 Ca 0.04 -0.29 0.02 0.00 -0.52 0.00 0.00 55.73 54.99 2a3t s ARG 203 Cb -0.05 -0.73 -0.04 0.00 0.52 0.00 0.00 34.95 34.64 2a3t s ARG 203 CO -0.00 0.15 0.19 1.52 0.02 0.00 0.00 175.30 177.18 2a3t s TYR 204 N -0.04 3.36 -0.01 -0.53 1.13 -1.26 -4.84 117.35 115.16 2a3t s TYR 204 Ca 0.01 0.12 0.05 0.00 -1.41 0.00 0.00 57.07 55.84 2a3t s TYR 204 Cb -0.05 -1.65 -0.24 0.00 -1.10 0.00 0.00 41.96 38.91 2a3t s TYR 204 CO -0.00 0.54 0.81 -0.44 -2.51 0.00 0.00 175.55 173.95 2a3t h ASP 205 N 2.73 0.16 -3.75 -0.18 3.32 -0.81 -3.48 116.42 114.41 2a3t h ASP 205 Ca -0.47 -0.26 -0.18 0.00 0.02 0.00 0.00 57.03 56.14 2a3t h ASP 205 Cb 1.18 -0.05 -0.27 0.00 0.22 0.00 0.00 39.33 40.41 2a3t h ASP 205 CO 0.69 1.22 -0.49 -0.89 -1.72 0.00 0.00 179.24 178.05 2a3t s THR 206 N -2.62 -0.01 -0.12 0.35 2.01 -1.14 -5.04 115.64 109.07 2a3t s THR 206 Ca -0.07 0.02 -0.03 0.00 0.31 0.00 0.00 61.69 61.92 2a3t s THR 206 Cb 0.08 -0.29 -0.03 0.00 0.01 0.00 0.00 72.50 72.27 2a3t s THR 206 CO 0.83 0.01 0.01 -0.69 -0.69 0.00 0.00 174.62 174.08 2a3t s VAL 207 N 0.25 4.34 -0.10 3.82 1.01 -1.26 -0.53 120.40 127.93 2a3t s VAL 207 Ca -0.01 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.77 2a3t s VAL 207 Cb -0.03 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 2a3t s VAL 207 CO -0.01 0.55 -0.18 -0.31 0.00 0.00 0.00 175.10 175.16 2a3t s TYR 208 N -0.35 2.68 -0.40 5.22 2.02 0.20 -4.58 117.35 122.12 2a3t s TYR 208 Ca 0.07 -0.66 -0.17 0.00 -0.37 0.00 0.00 57.07 55.94 2a3t s TYR 208 Cb -0.12 -1.74 0.01 0.00 -0.40 0.00 0.00 41.96 39.71 2a3t s TYR 208 CO 0.02 -0.19 0.46 -0.47 -1.57 0.00 0.00 175.55 173.80 2a3t s TYR 209 N 0.07 3.17 -0.43 2.71 5.04 0.22 -1.24 117.35 126.89 2a3t s TYR 209 Ca -0.08 -0.22 -0.13 0.00 -2.44 0.00 0.00 57.07 54.21 2a3t s TYR 209 Cb -0.15 -2.91 0.06 0.00 0.35 0.00 0.00 41.96 39.31 2a3t s TYR 209 CO 0.05 -0.66 0.31 0.42 -1.34 0.00 0.00 175.55 174.34 2a3t s ILE 210 N 2.22 4.90 -0.36 3.14 -1.09 0.76 -4.24 121.20 126.54 2a3t s ILE 210 Ca 0.14 -1.03 -0.17 0.00 -2.23 0.00 0.00 60.65 57.36 2a3t s ILE 210 Cb -0.16 -3.87 -0.00 0.00 -1.58 0.00 0.00 42.46 36.84 2a3t s ILE 210 CO 0.14 -0.45 0.43 -0.83 -1.23 0.00 0.00 174.94 173.00 2a3t s GLY 211 N 2.14 1.87 -0.14 6.18 0.00 -1.26 -2.05 107.32 114.05 2a3t s GLY 211 Ca 0.04 -1.21 -0.12 0.00 0.00 0.00 0.00 44.72 43.42 2a3t s GLY 211 CO 0.06 1.13 0.25 1.85 0.00 0.00 0.00 173.10 176.40 2a3t s GLU 212 N 2.19 4.08 -0.02 2.90 2.12 -0.55 -1.62 118.70 127.80 2a3t s GLU 212 Ca 0.14 0.04 0.01 0.00 0.36 0.00 0.00 54.97 55.52 2a3t s GLU 212 Cb -0.16 -3.36 0.01 0.00 0.26 0.00 0.00 34.13 30.88 2a3t s GLU 212 CO 0.13 0.39 -0.02 -1.54 -0.54 0.00 0.00 175.26 173.68 2a3t s SER 213 N 0.04 0.41 0.00 -1.70 1.04 -0.29 -4.33 113.70 108.87 2a3t s SER 213 Ca 0.16 -0.04 -0.13 0.00 0.48 0.00 0.00 55.95 56.42 2a3t s SER 213 Cb -0.13 -0.15 -0.05 0.00 0.10 0.00 0.00 66.02 65.79 2a3t s SER 213 CO 0.04 -0.03 0.37 1.51 0.98 0.00 0.00 173.24 176.11 2a3t s ASP 214 N 0.51 6.72 0.10 7.02 -4.77 -1.26 -1.08 116.67 123.91 2a3t s ASP 214 Ca -0.05 0.87 0.03 0.00 -3.30 0.00 0.00 52.55 50.09 2a3t s ASP 214 Cb -0.08 -2.21 -0.04 0.00 -1.09 0.00 0.00 42.92 39.50 2a3t s ASP 214 CO -0.01 0.30 -0.08 -1.00 0.70 0.00 0.00 175.17 175.08 2a3t s HIS 215 N -1.15 0.97 -0.45 2.11 3.76 0.11 -4.71 115.29 115.93 2a3t s HIS 215 Ca 0.25 -0.77 0.09 0.00 -0.15 0.00 0.00 55.06 54.47 2a3t s HIS 215 Cb -0.15 -0.54 0.30 0.00 1.11 0.00 0.00 32.58 33.30 2a3t s HIS 215 CO 0.13 -0.07 0.71 0.66 -0.85 0.00 0.00 174.74 175.33 2a3t n TYR 216 N 0.28 1.25 -2.58 1.40 4.02 -1.26 -0.60 117.16 119.66 2a3t n TYR 216 Ca -0.14 -3.83 -0.43 0.00 -0.01 0.00 0.00 57.90 53.50 2a3t n TYR 216 Cb 0.59 -0.43 -0.02 0.00 -0.02 0.00 0.00 39.34 39.45 2a3t n TYR 216 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2a3t s ILE 217 N -2.45 4.53 0.67 -0.72 -1.09 -1.26 -4.67 121.20 116.21 2a3t s ILE 217 Ca 0.40 1.83 -0.16 0.00 -2.23 0.00 0.00 60.65 60.49 2a3t s ILE 217 Cb 0.26 -4.18 0.00 0.00 -1.58 0.00 0.00 42.46 36.96 2a3t s ILE 217 CO -0.09 -0.05 1.19 -2.84 -1.23 0.00 0.00 174.94 171.92 2a3t s PRO 218 N 2.49 2.57 0.07 2.79 0.02 -1.26 -4.83 135.00 136.84 2a3t s PRO 218 Ca 0.51 1.72 0.09 0.00 0.02 0.00 0.00 61.00 63.34 2a3t s PRO 218 Cb -0.20 -1.89 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 2a3t s PRO 218 CO 0.17 -1.50 -0.23 0.15 -0.33 0.00 0.00 177.00 175.25 2a3t s LYS 219 N -3.72 1.44 0.85 5.54 1.02 -1.26 -1.36 119.74 122.25 2a3t s LYS 219 Ca 0.74 -1.09 -0.12 0.00 0.02 0.00 0.00 55.97 55.53 2a3t s LYS 219 Cb -0.28 -1.67 0.10 0.00 -0.52 0.00 0.00 37.83 35.46 2a3t s LYS 219 CO 0.40 0.42 1.10 -0.51 -0.92 0.00 0.00 175.35 175.83 2a3t s ASP 220 N -1.47 3.99 0.55 2.83 -0.00 0.11 -4.88 116.67 117.80 2a3t s ASP 220 Ca 0.09 1.38 0.27 0.00 -0.00 0.00 0.00 52.55 54.29 2a3t s ASP 220 Cb -0.10 -2.08 1.45 0.00 -0.00 0.00 0.00 42.92 42.19 2a3t s ASP 220 CO 0.03 -2.29 1.97 -0.08 -0.00 0.00 0.00 175.17 174.80 2a3t h GLU 221 N -1.31 0.00 -0.16 8.23 4.57 -2.02 0.30 114.58 124.19 2a3t h GLU 221 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2a3t h GLU 221 Cb 1.28 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 2a3t h GLU 221 CO 0.57 0.00 0.00 -0.40 -1.18 0.00 0.00 179.01 178.00 2a3t n ASP 222 N -4.19 1.07 0.00 1.04 5.68 -1.26 -4.89 116.55 113.99 2a3t n ASP 222 Ca 0.10 -1.82 0.00 0.00 -0.50 0.00 0.00 54.79 52.57 2a3t n ASP 222 Cb 0.65 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 2a3t n ASP 222 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2a3t n GLY 223 N 0.90 1.11 3.85 6.12 0.00 0.09 -5.05 105.19 112.22 2a3t n GLY 223 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 2a3t n GLY 223 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2a3t s THR 224 N -2.52 4.57 0.12 2.61 -4.23 -1.25 -4.77 115.64 110.17 2a3t s THR 224 Ca 0.00 1.13 -0.22 0.00 -1.18 0.00 0.00 61.69 61.43 2a3t s THR 224 Cb 0.00 -3.72 -0.07 0.00 1.34 0.00 0.00 72.50 70.05 2a3t s THR 224 CO 0.00 -0.65 0.66 -0.31 -0.54 0.00 0.00 174.62 173.77 2a3t s TYR 225 N -2.57 3.84 0.45 3.99 2.02 -1.26 0.10 117.35 123.91 2a3t s TYR 225 Ca 0.58 1.42 -0.20 0.00 -0.37 0.00 0.00 57.07 58.50 2a3t s TYR 225 Cb -0.10 -2.61 -0.10 0.00 -0.40 0.00 0.00 41.96 38.75 2a3t s TYR 225 CO 0.31 0.55 0.96 -1.64 -1.57 0.00 0.00 175.55 174.16 2a3t s MET 226 N -1.19 4.14 0.08 -0.62 -1.94 -0.46 -4.84 119.30 114.47 2a3t s MET 226 Ca 0.32 1.10 0.10 0.00 -1.71 0.00 0.00 55.69 55.50 2a3t s MET 226 Cb -0.21 -2.16 -0.03 0.00 2.01 0.00 0.00 34.83 34.43 2a3t s MET 226 CO 0.22 -0.11 -0.25 1.03 -0.01 0.00 0.00 175.02 175.90 2a3t s ARG 227 N -3.37 1.69 0.19 2.03 1.81 -1.26 -4.80 118.95 115.25 2a3t s ARG 227 Ca 0.62 -1.18 0.02 0.00 -1.72 0.00 0.00 55.73 53.47 2a3t s ARG 227 Cb -0.10 -1.99 -0.05 0.00 -0.45 0.00 0.00 34.95 32.37 2a3t s ARG 227 CO 0.17 0.49 -0.00 -0.06 -0.68 0.00 0.00 175.30 175.22 2a3t s PHE 228 N -0.93 1.33 -0.10 -0.53 0.40 -1.26 -5.05 117.98 111.84 2a3t s PHE 228 Ca 0.13 -0.98 0.14 0.00 -0.60 0.00 0.00 56.93 55.62 2a3t s PHE 228 Cb -0.10 -0.76 -0.04 0.00 0.51 0.00 0.00 43.02 42.62 2a3t s PHE 228 CO 0.04 -0.15 1.23 0.66 0.70 0.00 0.00 175.22 177.71 2a3t h SER 229 N 2.62 0.00 -5.26 1.36 4.64 -2.01 -3.48 113.55 111.41 2a3t h SER 229 Ca -0.37 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.10 2a3t h SER 229 Cb 1.21 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.23 2a3t h SER 229 CO 0.63 0.62 0.44 1.51 -0.87 0.00 0.00 176.83 179.16 2a3t s ASP 230 N -6.31 -0.18 0.16 4.97 -4.77 -1.26 -5.05 116.67 104.23 2a3t s ASP 230 Ca 0.01 -0.47 -0.15 0.00 -3.30 0.00 0.00 52.55 48.64 2a3t s ASP 230 Cb 0.08 0.54 0.08 0.00 -1.09 0.00 0.00 42.92 42.54 2a3t s ASP 230 CO 0.78 -1.01 1.78 -0.65 0.70 0.00 0.00 175.17 176.77 2a3t h PRO 231 N 2.00 0.42 -0.84 2.11 0.11 -1.93 -2.90 132.00 130.98 2a3t h PRO 231 Ca -0.23 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2a3t h PRO 231 Cb 1.23 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 2a3t h PRO 231 CO 0.26 0.28 0.52 0.77 -0.21 0.00 0.00 178.00 179.62 2a3t h SER 232 N 0.43 0.98 -0.64 -2.05 0.02 -1.97 -1.29 113.55 109.04 2a3t h SER 232 Ca 0.18 -0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2a3t h SER 232 Cb 0.09 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 2a3t h SER 232 CO -0.13 0.74 0.42 -0.08 -1.14 0.00 0.00 176.83 176.64 2a3t h GLU 233 N 1.14 0.83 -0.01 3.45 4.81 -1.92 -2.54 114.58 120.35 2a3t h GLU 233 Ca 0.30 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 2a3t h GLU 233 Cb -0.08 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.11 2a3t h GLU 233 CO -0.06 0.55 -0.13 0.41 -0.73 0.00 0.00 179.01 179.05 2a3t n GLY 234 N -1.44 -0.70 0.51 1.92 0.00 -0.53 -4.54 105.19 100.41 2a3t n GLY 234 Ca 0.07 -0.33 -0.19 0.00 0.00 0.00 0.00 46.02 45.57 2a3t n GLY 234 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2a3t h TYR 235 N 0.99 -1.33 -0.81 1.61 3.20 -1.02 -1.14 116.97 118.47 2a3t h TYR 235 Ca 0.00 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.92 2a3t h TYR 235 Cb 0.40 0.49 -0.06 0.00 1.54 0.00 0.00 36.73 39.10 2a3t h TYR 235 CO 0.00 -0.70 0.50 0.93 -1.64 0.00 0.00 178.16 177.24 2a3t h GLU 236 N -1.11 0.88 -0.77 1.82 5.08 -1.80 -0.72 114.58 117.97 2a3t h GLU 236 Ca -0.09 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 2a3t h GLU 236 Cb 0.92 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 2a3t h GLU 236 CO 0.04 0.59 0.32 -0.44 -1.00 0.00 0.00 179.01 178.51 2a3t h ASP 237 N 0.91 1.05 -0.57 1.42 3.32 -1.83 -2.91 116.42 117.81 2a3t h ASP 237 Ca 0.35 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 2a3t h ASP 237 Cb 0.16 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2a3t h ASP 237 CO -0.17 0.92 0.20 -0.03 -1.72 0.00 0.00 179.24 178.44 2a3t h MET 238 N 1.12 0.87 -0.72 3.56 4.05 -0.37 -2.99 114.93 120.44 2a3t h MET 238 Ca 0.26 -0.18 0.09 0.00 -0.28 0.00 0.00 59.70 59.59 2a3t h MET 238 Cb 0.19 -0.13 -0.07 0.00 -0.80 0.00 0.00 31.60 30.80 2a3t h MET 238 CO -0.02 0.77 0.38 0.28 0.23 0.00 0.00 176.91 178.55 2a3t h VAL 239 N 0.79 0.88 -0.93 -5.77 2.07 -1.03 0.67 116.25 112.93 2a3t h VAL 239 Ca 0.19 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2a3t h VAL 239 Cb 0.25 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 2a3t h VAL 239 CO -0.01 0.12 0.54 0.00 0.02 0.00 0.00 177.57 178.24 2a3t h ALA 240 N 1.42 1.18 -0.26 1.67 0.00 -1.37 0.87 119.26 122.76 2a3t h ALA 240 Ca 0.35 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2a3t h ALA 240 Cb 0.33 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2a3t h ALA 240 CO -0.25 0.66 0.03 0.28 0.00 0.00 0.00 179.25 179.98 2a3t h VAL 241 N 1.29 1.24 -0.83 0.00 2.07 -1.32 -3.16 116.25 115.53 2a3t h VAL 241 Ca 0.33 -0.82 0.13 0.00 0.82 0.00 0.00 66.70 67.16 2a3t h VAL 241 Cb -0.02 1.27 -0.09 0.00 -1.52 0.00 0.00 31.29 30.93 2a3t h VAL 241 CO -0.06 0.26 0.43 0.24 0.02 0.00 0.00 177.57 178.46 2a3t h MET 242 N 0.25 0.62 -0.21 1.57 2.86 -0.22 -1.78 114.93 118.03 2a3t h MET 242 Ca 0.08 -0.04 0.06 0.00 -2.06 0.00 0.00 59.70 57.74 2a3t h MET 242 Cb 0.36 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2a3t h MET 242 CO 0.01 0.41 0.17 -0.44 1.06 0.00 0.00 176.91 178.12 2a3t h ASP 243 N 0.64 0.00 1.39 1.22 3.32 -0.82 -0.24 116.42 121.94 2a3t h ASP 243 Ca 0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.49 2a3t h ASP 243 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 2a3t h ASP 243 CO -0.34 0.00 0.00 0.71 -1.72 0.00 0.00 179.24 177.89 2a3t h THR 244 N 0.00 0.00 -0.50 0.35 1.35 -1.36 -3.47 112.91 109.28 2a3t h THR 244 Ca 0.10 -0.53 -0.22 0.00 -0.55 0.00 0.00 66.41 65.22 2a3t h THR 244 Cb 0.43 1.47 -0.09 0.00 -1.73 0.00 0.00 68.15 68.24 2a3t h THR 244 CO -0.00 0.00 -0.20 0.18 -0.25 0.00 0.00 175.52 175.25 2a3t n LEU 245 N -2.48 -0.42 -4.38 3.87 4.77 -0.10 -4.98 117.00 113.28 2a3t n LEU 245 Ca 0.04 0.26 -0.40 0.00 -0.03 0.00 0.00 56.01 55.88 2a3t n LEU 245 Cb 0.40 -2.39 -0.11 0.00 -2.33 0.00 0.00 43.42 38.99 2a3t n LEU 245 CO 0.29 -0.90 -0.17 -0.63 -1.33 0.00 0.00 177.39 174.65 2a3t s ILE 246 N -2.05 4.53 0.41 -0.08 1.01 -1.26 -5.08 121.20 118.68 2a3t s ILE 246 Ca 0.00 -0.84 -0.25 0.00 0.00 0.00 0.00 60.65 59.56 2a3t s ILE 246 Cb 0.00 -3.52 -0.08 0.00 0.01 0.00 0.00 42.46 38.87 2a3t s ILE 246 CO 0.00 -0.21 1.19 -2.84 0.00 0.00 0.00 174.94 173.08 2a3t s PRO 247 N 1.55 3.99 0.17 2.79 0.02 -1.26 -4.87 135.00 137.40 2a3t s PRO 247 Ca 0.02 1.87 0.01 0.00 0.02 0.00 0.00 61.00 62.91 2a3t s PRO 247 Cb -0.19 -2.64 0.03 0.00 0.02 0.00 0.00 34.50 31.72 2a3t s PRO 247 CO 0.06 -0.38 1.40 0.66 -0.33 0.00 0.00 177.00 178.42 2a3t h SER 248 N 2.54 0.36 -4.75 2.53 4.64 -1.18 -3.47 113.55 114.22 2a3t h SER 248 Ca -0.49 -0.26 -0.16 0.00 -0.47 0.00 0.00 61.79 60.41 2a3t h SER 248 Cb 1.24 -0.11 -0.22 0.00 -0.31 0.00 0.00 62.40 63.00 2a3t h SER 248 CO 0.62 1.03 -0.57 -1.00 -0.87 0.00 0.00 176.83 176.04 2a3t s HIS 249 N -3.39 0.07 -0.16 4.77 3.76 -1.16 -4.81 115.29 114.38 2a3t s HIS 249 Ca -0.04 -0.16 -0.04 0.00 -0.15 0.00 0.00 55.06 54.67 2a3t s HIS 249 Cb 0.10 -0.07 0.05 0.00 1.11 0.00 0.00 32.58 33.78 2a3t s HIS 249 CO 0.83 -0.22 0.06 0.42 -0.85 0.00 0.00 174.74 174.99 2a3t s ILE 250 N -1.13 0.12 0.18 0.60 1.01 0.00 -0.71 121.20 121.27 2a3t s ILE 250 Ca -0.12 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.39 2a3t s ILE 250 Cb -0.07 -0.66 -0.05 0.00 0.01 0.00 0.00 42.46 41.69 2a3t s ILE 250 CO 0.01 -0.18 -0.13 0.68 0.00 0.00 0.00 174.94 175.32 2a3t s VAL 251 N 2.05 1.54 -0.11 2.92 -7.23 -0.24 -1.29 120.40 118.04 2a3t s VAL 251 Ca 0.02 -2.15 -0.02 0.00 -1.81 0.00 0.00 61.98 58.02 2a3t s VAL 251 Cb -0.16 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 2a3t s VAL 251 CO -0.08 -0.64 -0.02 -0.36 -0.31 0.00 0.00 175.10 173.69 2a3t s PHE 252 N -3.06 3.08 -1.65 2.82 0.08 -1.26 -1.13 117.98 116.87 2a3t s PHE 252 Ca 0.20 -0.01 -0.03 0.00 0.12 0.00 0.00 56.93 57.22 2a3t s PHE 252 Cb 0.00 -1.85 0.00 0.00 -0.57 0.00 0.00 43.02 40.60 2a3t s PHE 252 CO 0.05 0.26 0.37 -1.71 -0.10 0.00 0.00 175.22 174.08 2a3t n ASN 253 N 2.72 -6.02 0.00 1.36 4.05 -0.64 -3.51 115.26 113.21 2a3t n ASN 253 Ca -0.18 -0.18 0.00 0.00 0.45 0.00 0.00 54.58 54.67 2a3t n ASN 253 Cb 0.53 -4.92 0.00 0.00 1.23 0.00 0.00 39.78 36.62 2a3t n ASN 253 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2a3t n GLY 254 N -1.32 1.13 3.51 8.20 0.00 -0.54 -4.77 105.19 111.40 2a3t n GLY 254 Ca -0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.71 2a3t n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3t s ALA 255 N -3.21 -1.78 0.25 4.61 0.00 -1.23 -4.65 121.76 115.75 2a3t s ALA 255 Ca 0.00 1.18 -0.31 0.00 0.00 0.00 0.00 51.96 52.83 2a3t s ALA 255 Cb 0.00 0.07 -0.11 0.00 0.00 0.00 0.00 23.12 23.08 2a3t s ALA 255 CO 0.00 -0.47 1.61 0.08 0.00 0.00 0.00 175.76 176.97 2a3t s VAL 256 N -1.91 2.20 0.00 0.00 1.01 0.77 -2.04 120.40 120.43 2a3t s VAL 256 Ca -0.05 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2a3t s VAL 256 Cb -0.00 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.27 2a3t s VAL 256 CO 0.01 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2a3t n GLY 257 N 2.87 0.31 0.35 4.51 0.00 -1.26 -4.88 105.19 107.09 2a3t n GLY 257 Ca 0.11 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.19 2a3t n GLY 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3t h ALA 258 N 0.00 1.70 -0.56 4.61 0.00 -1.63 -1.91 119.26 121.47 2a3t h ALA 258 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.61 2a3t h ALA 258 Cb 0.39 -0.20 -0.17 0.00 0.00 0.00 0.00 17.79 17.82 2a3t h ALA 258 CO 0.00 0.20 0.16 1.28 0.00 0.00 0.00 179.25 180.89 2a3t n LEU 259 N -4.47 5.00 -4.58 0.00 4.77 -1.26 -4.19 117.00 112.26 2a3t n LEU 259 Ca 0.10 -3.68 -0.27 0.00 -0.03 0.00 0.00 56.01 52.12 2a3t n LEU 259 Cb 0.20 -0.70 -0.09 0.00 -2.33 0.00 0.00 43.42 40.50 2a3t n LEU 259 CO 0.34 1.16 -0.25 0.42 -1.33 0.00 0.00 177.39 177.74 2a3t s THR 260 N -3.24 1.15 0.00 -5.08 -4.23 -0.72 -1.33 115.64 102.19 2a3t s THR 260 Ca 0.49 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 2a3t s THR 260 Cb 0.43 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.74 2a3t s THR 260 CO 0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 2a3t n GLY 261 N -0.96 3.59 0.25 3.99 0.00 -1.26 -0.93 105.19 109.88 2a3t n GLY 261 Ca -0.08 0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2a3t n GLY 261 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2a3t h GLU 262 N 0.00 0.00 -0.25 1.61 5.08 -1.92 -2.17 114.58 116.92 2a3t h GLU 262 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2a3t h GLU 262 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2a3t h GLU 262 CO 0.00 0.16 0.00 0.41 -1.00 0.00 0.00 179.01 178.58 2a3t n GLY 263 N -0.42 0.70 3.72 -3.84 0.00 -0.10 -4.98 105.19 100.27 2a3t n GLY 263 Ca -0.01 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.11 2a3t n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3t n ALA 264 N 0.64 1.45 -1.42 4.61 0.00 -0.82 -4.18 120.51 120.79 2a3t n ALA 264 Ca 0.16 0.22 -0.31 0.00 0.00 0.00 0.00 53.44 53.52 2a3t n ALA 264 Cb 0.39 -2.30 0.07 0.00 0.00 0.00 0.00 19.45 17.62 2a3t n ALA 264 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2a3t s LEU 265 N -2.24 3.02 0.03 0.00 1.43 0.67 -4.86 118.68 116.73 2a3t s LEU 265 Ca 0.64 1.68 0.03 0.00 -1.03 0.00 0.00 54.13 55.44 2a3t s LEU 265 Cb -0.47 -4.44 -0.02 0.00 0.03 0.00 0.00 46.19 41.29 2a3t s LEU 265 CO 0.56 -1.78 -0.09 -0.54 0.23 0.00 0.00 176.35 174.73 2a3t s LYS 266 N -4.99 0.59 0.35 1.70 1.02 -1.26 -0.43 119.74 116.72 2a3t s LYS 266 Ca 0.60 -0.62 -0.15 0.00 0.02 0.00 0.00 55.97 55.82 2a3t s LYS 266 Cb -0.16 -0.47 0.04 0.00 -0.52 0.00 0.00 37.83 36.72 2a3t s LYS 266 CO 0.55 0.11 0.72 0.00 -0.92 0.00 0.00 175.35 175.81 2a3t s ALA 267 N -0.95 -0.60 0.15 5.17 0.00 -0.69 -4.91 121.76 119.93 2a3t s ALA 267 Ca -0.04 -0.78 0.08 0.00 0.00 0.00 0.00 51.96 51.22 2a3t s ALA 267 Cb -0.08 0.80 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 2a3t s ALA 267 CO 0.00 -0.96 -0.18 0.15 0.00 0.00 0.00 175.76 174.77 2a3t s LYS 268 N -2.82 1.23 0.21 0.00 1.02 -1.26 -1.81 119.74 116.32 2a3t s LYS 268 Ca 0.17 -1.36 -0.32 0.00 0.02 0.00 0.00 55.97 54.47 2a3t s LYS 268 Cb -0.04 -1.29 -0.13 0.00 -0.52 0.00 0.00 37.83 35.85 2a3t s LYS 268 CO 0.12 0.26 1.54 0.28 -0.92 0.00 0.00 175.35 176.63 2a3t n VAL 269 N 0.40 0.49 0.00 3.17 0.31 0.16 -1.51 118.33 121.35 2a3t n VAL 269 Ca -0.14 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2a3t n VAL 269 Cb 0.57 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 2a3t n VAL 269 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2a3t n GLY 270 N 2.84 3.21 3.73 2.92 0.00 0.96 -4.99 105.19 113.87 2a3t n GLY 270 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2a3t n GLY 270 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a3t s ASP 271 N -0.50 6.68 -0.39 1.61 -0.00 -0.57 -4.69 116.67 118.82 2a3t s ASP 271 Ca 0.00 2.59 -0.19 0.00 -0.00 0.00 0.00 52.55 54.95 2a3t s ASP 271 Cb 0.00 -2.61 0.01 0.00 -0.00 0.00 0.00 42.92 40.32 2a3t s ASP 271 CO 0.00 -0.71 0.53 0.20 -0.00 0.00 0.00 175.17 175.19 2a3t s ASN 272 N 0.67 6.30 -0.16 0.27 0.01 -1.26 -1.59 114.94 119.17 2a3t s ASN 272 Ca 0.63 -0.22 -0.02 0.00 -0.71 0.00 0.00 52.86 52.54 2a3t s ASN 272 Cb -0.41 -2.27 -0.02 0.00 0.41 0.00 0.00 41.25 38.96 2a3t s ASN 272 CO 0.38 -0.58 -0.08 -0.69 -1.51 0.00 0.00 177.10 174.62 2a3t s VAL 273 N 2.46 3.35 -0.25 1.60 1.01 -0.06 -0.00 120.40 128.50 2a3t s VAL 273 Ca 0.19 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.46 2a3t s VAL 273 Cb -0.15 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 2a3t s VAL 273 CO 0.15 0.49 0.45 -0.22 0.00 0.00 0.00 175.10 175.97 2a3t s LEU 274 N 0.67 4.06 -0.43 3.92 2.96 0.31 -1.90 118.68 128.28 2a3t s LEU 274 Ca -0.04 0.45 -0.14 0.00 -0.22 0.00 0.00 54.13 54.17 2a3t s LEU 274 Cb -0.15 -2.57 0.05 0.00 0.50 0.00 0.00 46.19 44.02 2a3t s LEU 274 CO 0.02 -0.22 0.32 -0.36 -1.32 0.00 0.00 176.35 174.79 2a3t s PHE 275 N 2.09 3.25 -0.19 5.38 0.40 0.54 -0.63 117.98 128.82 2a3t s PHE 275 Ca 0.19 -0.84 -0.17 0.00 -0.60 0.00 0.00 56.93 55.51 2a3t s PHE 275 Cb -0.16 -2.83 -0.04 0.00 0.51 0.00 0.00 43.02 40.51 2a3t s PHE 275 CO 0.09 -0.70 0.46 0.08 0.70 0.00 0.00 175.22 175.85 2a3t s VAL 276 N 1.63 5.16 -0.11 -0.44 1.01 -0.37 -1.48 120.40 125.79 2a3t s VAL 276 Ca 0.04 0.85 -0.00 0.00 0.00 0.00 0.00 61.98 62.86 2a3t s VAL 276 Cb -0.21 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.40 2a3t s VAL 276 CO 0.08 0.23 -0.07 -2.28 0.00 0.00 0.00 175.10 173.05 2a3t s HIS 277 N 1.38 1.46 0.03 5.22 2.46 -0.13 -0.17 115.29 125.55 2a3t s HIS 277 Ca 0.22 -0.73 0.04 0.00 0.47 0.00 0.00 55.06 55.06 2a3t s HIS 277 Cb -0.15 -1.22 -0.04 0.00 -0.13 0.00 0.00 32.58 31.04 2a3t s HIS 277 CO 0.09 -0.51 -0.04 -1.54 -2.47 0.00 0.00 174.74 170.27 2a3t s SER 278 N 1.72 4.80 -0.24 9.88 1.04 -0.87 -0.99 113.70 129.04 2a3t s SER 278 Ca 0.05 -0.15 -0.03 0.00 0.48 0.00 0.00 55.95 56.30 2a3t s SER 278 Cb -0.13 -1.14 0.10 0.00 0.10 0.00 0.00 66.02 64.95 2a3t s SER 278 CO -0.08 0.25 0.18 -1.58 0.98 0.00 0.00 173.24 172.99 2a3t s GLN 279 N -1.73 0.19 0.00 4.02 -0.44 -0.74 -1.48 119.66 119.48 2a3t s GLN 279 Ca 0.20 -0.14 0.29 0.00 -2.50 0.00 0.00 55.36 53.20 2a3t s GLN 279 Cb -0.11 -1.21 1.29 0.00 -1.64 0.00 0.00 33.01 31.34 2a3t s GLN 279 CO 0.11 -0.84 1.94 -0.35 0.50 0.00 0.00 175.29 176.65 2a3t n PRO 280 N 5.29 0.12 0.00 1.67 -0.04 -1.26 0.24 135.00 141.02 2a3t n PRO 280 Ca -0.05 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 2a3t n PRO 280 Cb 0.47 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 2a3t n PRO 280 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2a3t n ASN 281 N -1.44 0.49 -3.78 3.54 2.85 -1.26 -3.20 115.26 112.45 2a3t n ASN 281 Ca 0.09 0.00 -0.13 0.00 -0.11 0.00 0.00 54.58 54.43 2a3t n ASN 281 Cb 0.30 0.09 -0.09 0.00 1.24 0.00 0.00 39.78 41.33 2a3t n ASN 281 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2a3t s ARG 282 N -0.25 0.65 0.67 1.20 3.52 -1.26 -4.72 118.95 118.75 2a3t s ARG 282 Ca 0.00 -0.28 -0.16 0.00 -0.13 0.00 0.00 55.73 55.16 2a3t s ARG 282 Cb 0.00 0.28 0.00 0.00 -1.56 0.00 0.00 34.95 33.68 2a3t s ARG 282 CO 0.00 -0.18 1.17 -0.51 -0.81 0.00 0.00 175.30 174.97 2a3t s ASP 283 N -1.44 4.79 0.06 -2.12 1.01 -1.26 -3.60 116.67 114.10 2a3t s ASP 283 Ca -0.13 2.24 -0.00 0.00 0.71 0.00 0.00 52.55 55.37 2a3t s ASP 283 Cb -0.05 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 2a3t s ASP 283 CO 0.03 -1.86 -0.04 -0.55 0.21 0.00 0.00 175.17 172.96 2a3t s SER 284 N -2.09 0.63 -0.54 0.27 0.15 0.43 -4.88 113.70 107.67 2a3t s SER 284 Ca 0.73 -0.94 0.05 0.00 0.70 0.00 0.00 55.95 56.48 2a3t s SER 284 Cb -0.26 0.16 0.17 0.00 -1.71 0.00 0.00 66.02 64.38 2a3t s SER 284 CO 0.40 -0.53 0.42 -2.11 1.20 0.00 0.00 173.24 172.62 2a3t n ARG 285 N 0.25 0.94 -1.92 5.44 1.85 -1.26 -0.55 116.66 121.41 2a3t n ARG 285 Ca -0.15 -3.75 -0.38 0.00 -1.00 0.00 0.00 57.85 52.57 2a3t n ARG 285 Cb 0.60 -1.92 0.03 0.00 -1.05 0.00 0.00 32.46 30.12 2a3t n ARG 285 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 2a3t s PRO 286 N -0.68 3.28 -0.17 2.89 0.02 -1.14 -0.62 135.00 138.58 2a3t s PRO 286 Ca 0.30 2.09 -0.10 0.00 0.02 0.00 0.00 61.00 63.31 2a3t s PRO 286 Cb 0.01 -2.27 0.06 0.00 0.02 0.00 0.00 34.50 32.32 2a3t s PRO 286 CO -0.18 -1.03 0.42 -1.58 -0.33 0.00 0.00 177.00 174.29 2a3t s HIS 287 N -1.38 -0.59 -0.45 6.54 2.46 -0.10 -1.53 115.29 120.24 2a3t s HIS 287 Ca 0.70 1.28 -0.17 0.00 0.47 0.00 0.00 55.06 57.33 2a3t s HIS 287 Cb -0.37 0.26 0.04 0.00 -0.13 0.00 0.00 32.58 32.38 2a3t s HIS 287 CO 0.43 -0.33 0.46 -1.17 -2.47 0.00 0.00 174.74 171.66 2a3t s LEU 288 N 1.23 5.09 -0.12 8.88 2.96 -1.26 -0.89 118.68 134.56 2a3t s LEU 288 Ca -0.08 -0.90 -0.29 0.00 -0.22 0.00 0.00 54.13 52.63 2a3t s LEU 288 Cb -0.08 -2.33 -0.05 0.00 0.50 0.00 0.00 46.19 44.24 2a3t s LEU 288 CO -0.11 -0.66 1.72 -0.63 -1.32 0.00 0.00 176.35 175.35 2a3t s ILE 289 N 2.09 3.52 0.00 6.68 1.01 0.12 -1.51 121.20 133.11 2a3t s ILE 289 Ca 0.10 0.61 0.00 0.00 0.00 0.00 0.00 60.65 61.36 2a3t s ILE 289 Cb -0.19 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.81 2a3t s ILE 289 CO 0.11 -0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.52 2a3t n GLY 290 N 4.51 0.04 0.00 6.18 0.00 -1.26 -3.62 105.19 111.04 2a3t n GLY 290 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2a3t n GLY 290 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3t n GLY 291 N -1.95 6.22 3.53 -0.02 0.00 -0.57 -5.01 105.19 107.39 2a3t n GLY 291 Ca 0.00 -1.65 -0.12 0.00 0.00 0.00 0.00 46.02 44.25 2a3t n GLY 291 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2a3t s HIS 292 N -0.09 0.71 -0.43 1.61 0.09 -1.26 -4.77 115.29 111.14 2a3t s HIS 292 Ca 0.00 -1.02 -0.17 0.00 -0.00 0.00 0.00 55.06 53.87 2a3t s HIS 292 Cb 0.00 0.05 0.03 0.00 -0.00 0.00 0.00 32.58 32.66 2a3t s HIS 292 CO 0.00 -1.06 0.44 0.20 -0.00 0.00 0.00 174.74 174.33 2a3t s GLY 293 N -3.12 1.90 0.07 -2.22 0.00 -0.09 -4.70 107.32 99.16 2a3t s GLY 293 Ca 0.27 -1.60 -0.21 0.00 0.00 0.00 0.00 44.72 43.18 2a3t s GLY 293 CO 0.14 1.17 1.58 -0.55 0.00 0.00 0.00 173.10 175.44 2a3t h ASP 294 N 8.75 0.20 -3.34 1.64 3.32 -1.17 -1.16 116.42 124.66 2a3t h ASP 294 Ca -0.27 -0.20 -0.47 0.00 0.02 0.00 0.00 57.03 56.11 2a3t h ASP 294 Cb 1.11 -0.05 -0.35 0.00 0.22 0.00 0.00 39.33 40.26 2a3t h ASP 294 CO 0.81 0.35 -0.79 -0.76 -1.72 0.00 0.00 179.24 177.13 2a3t s LEU 295 N -9.76 1.25 -0.08 1.55 1.43 -1.01 -3.25 118.68 108.81 2a3t s LEU 295 Ca -0.14 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 2a3t s LEU 295 Cb 0.06 -0.64 0.02 0.00 0.03 0.00 0.00 46.19 45.66 2a3t s LEU 295 CO 0.70 -0.07 -0.11 -0.69 0.23 0.00 0.00 176.35 176.41 2a3t s VAL 296 N 1.23 1.07 -0.83 -1.59 1.01 0.33 -0.47 120.40 121.16 2a3t s VAL 296 Ca -0.05 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.46 2a3t s VAL 296 Cb -0.14 -1.01 0.21 0.00 0.00 0.00 0.00 36.38 35.44 2a3t s VAL 296 CO -0.02 0.35 0.72 0.26 0.00 0.00 0.00 175.10 176.41 2a3t s TRP 297 N 0.97 3.76 0.25 5.22 0.51 0.39 -1.07 118.94 128.96 2a3t s TRP 297 Ca -0.09 -2.65 0.15 0.00 -2.12 0.00 0.00 56.10 51.39 2a3t s TRP 297 Cb -0.15 -3.44 0.60 0.00 -0.81 0.00 0.00 33.47 29.67 2a3t s TRP 297 CO 0.00 -0.86 1.72 1.05 -0.51 0.00 0.00 176.95 178.35 2a3t h GLU 298 N 6.82 0.00 -0.00 4.98 4.11 -1.87 -0.30 114.58 128.32 2a3t h GLU 298 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.53 2a3t h GLU 298 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2a3t h GLU 298 CO 0.81 0.45 -0.17 0.25 0.07 0.00 0.00 179.01 180.42 2a3t n THR 299 N -3.72 0.00 -0.86 -1.06 -2.24 -1.26 -4.17 114.28 100.96 2a3t n THR 299 Ca -0.01 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2a3t n THR 299 Cb 0.52 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 2a3t n THR 299 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a3t n GLY 300 N 1.48 0.52 3.12 3.38 0.00 -0.20 -4.75 105.19 108.75 2a3t n GLY 300 Ca 0.07 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.27 2a3t n GLY 300 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a3t s LYS 301 N -0.96 2.73 0.28 1.61 -0.14 -1.26 -0.48 119.74 121.51 2a3t s LYS 301 Ca 0.00 -1.02 0.25 0.00 -1.36 0.00 0.00 55.97 53.84 2a3t s LYS 301 Cb 0.00 -2.77 0.94 0.00 -1.68 0.00 0.00 37.83 34.33 2a3t s LYS 301 CO 0.00 -0.36 1.75 0.74 -0.76 0.00 0.00 175.35 176.72 2a3t h PHE 302 N 7.90 0.00 -0.00 3.18 0.04 -1.89 -2.19 116.94 123.98 2a3t h PHE 302 Ca -0.34 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.43 2a3t h PHE 302 Cb 1.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.25 2a3t h PHE 302 CO 0.55 0.00 -0.15 0.72 -0.60 0.00 0.00 178.31 178.83 2a3t n HIS 303 N -2.37 0.00 -2.85 -0.55 8.25 -1.26 -4.78 115.22 111.67 2a3t n HIS 303 Ca 0.03 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.14 2a3t n HIS 303 Cb 0.31 -0.42 -0.07 0.00 1.12 0.00 0.00 29.99 30.93 2a3t n HIS 303 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2a3t s ASN 304 N -2.99 7.14 0.22 0.41 0.01 -0.82 -5.02 114.94 113.89 2a3t s ASN 304 Ca 0.13 1.71 -0.30 0.00 -0.71 0.00 0.00 52.86 53.69 2a3t s ASN 304 Cb 0.19 -2.54 -0.10 0.00 0.41 0.00 0.00 41.25 39.21 2a3t s ASN 304 CO 0.58 -0.17 1.42 0.00 -1.51 0.00 0.00 177.10 177.42 2a3t s ALA 305 N -1.83 3.62 0.59 0.60 0.00 -1.26 -4.97 121.76 118.50 2a3t s ALA 305 Ca 0.54 1.26 -0.15 0.00 0.00 0.00 0.00 51.96 53.61 2a3t s ALA 305 Cb -0.15 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 2a3t s ALA 305 CO 0.19 -0.69 1.05 -1.25 0.00 0.00 0.00 175.76 175.06 2a3t s PRO 306 N -0.03 3.40 0.44 0.00 0.04 -1.26 -4.94 135.00 132.64 2a3t s PRO 306 Ca 0.60 1.14 -0.09 0.00 0.04 0.00 0.00 61.00 62.69 2a3t s PRO 306 Cb -0.40 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.03 2a3t s PRO 306 CO 0.40 -0.74 0.79 -1.21 0.04 0.00 0.00 177.00 176.28 2a3t s GLU 307 N -4.15 3.72 0.13 4.56 2.02 -0.24 -4.61 118.70 120.13 2a3t s GLU 307 Ca 0.62 0.43 0.10 0.00 0.02 0.00 0.00 54.97 56.15 2a3t s GLU 307 Cb -0.15 -2.36 -0.04 0.00 0.10 0.00 0.00 34.13 31.68 2a3t s GLU 307 CO 0.37 -0.11 -0.22 1.03 0.02 0.00 0.00 175.26 176.35 2a3t s ARG 308 N -4.14 1.63 -1.12 1.61 3.00 -1.26 -0.51 118.95 118.15 2a3t s ARG 308 Ca 0.51 -1.27 0.00 0.00 0.00 0.00 0.00 55.73 54.96 2a3t s ARG 308 Cb -0.10 -2.01 0.00 0.00 0.00 0.00 0.00 34.95 32.83 2a3t s ARG 308 CO 0.36 0.46 0.00 -0.25 0.00 0.00 0.00 175.30 175.87 2a3t n ASP 309 N 0.77 -4.09 -4.78 0.23 8.00 -0.55 -4.97 116.55 111.17 2a3t n ASP 309 Ca -0.16 -0.01 -0.36 0.00 0.71 0.00 0.00 54.79 54.97 2a3t n ASP 309 Cb 0.53 -3.27 -0.02 0.00 -0.02 0.00 0.00 41.12 38.34 2a3t n ASP 309 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2a3t s LEU 310 N -3.74 4.00 -0.10 0.64 1.43 -0.57 -4.77 118.68 115.58 2a3t s LEU 310 Ca 0.00 2.13 -0.15 0.00 -1.03 0.00 0.00 54.13 55.07 2a3t s LEU 310 Cb 0.00 -4.31 -0.27 0.00 0.03 0.00 0.00 46.19 41.64 2a3t s LEU 310 CO 0.00 -0.77 0.57 1.05 0.23 0.00 0.00 176.35 177.43 2a3t h GLU 311 N 2.04 0.25 -3.34 1.70 4.11 -1.91 -0.20 114.58 117.23 2a3t h GLU 311 Ca -0.49 -0.43 -0.19 0.00 0.07 0.00 0.00 59.36 58.32 2a3t h GLU 311 Cb 1.23 0.16 -0.27 0.00 0.50 0.00 0.00 28.75 30.38 2a3t h GLU 311 CO 0.60 1.21 -0.53 0.99 0.07 0.00 0.00 179.01 181.35 2a3t s THR 312 N -2.48 -0.00 0.31 -1.06 2.01 -1.26 -4.30 115.64 108.86 2a3t s THR 312 Ca -0.20 0.00 0.01 0.00 0.31 0.00 0.00 61.69 61.82 2a3t s THR 312 Cb 0.04 -0.23 -0.00 0.00 0.01 0.00 0.00 72.50 72.32 2a3t s THR 312 CO 0.77 0.00 0.03 -2.67 -0.69 0.00 0.00 174.62 172.06 2a3t n TRP 313 N 3.02 0.54 -3.76 4.92 2.14 -0.58 -5.00 117.44 118.72 2a3t n TRP 313 Ca -0.13 -1.65 -0.25 0.00 2.07 0.00 0.00 57.50 57.54 2a3t n TRP 313 Cb 0.59 -0.15 -0.17 0.00 -0.81 0.00 0.00 31.31 30.77 2a3t n TRP 313 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 2a3t s PHE 314 N -2.31 0.82 -0.36 -2.67 5.36 -1.26 -2.86 117.98 114.70 2a3t s PHE 314 Ca 0.04 -0.42 -0.14 0.00 -0.96 0.00 0.00 56.93 55.45 2a3t s PHE 314 Cb 0.00 -0.90 -0.01 0.00 -0.34 0.00 0.00 43.02 41.78 2a3t s PHE 314 CO 0.03 -0.43 0.27 0.42 -1.46 0.00 0.00 175.22 174.05 2a3t s ILE 315 N 1.92 5.27 0.24 3.12 -1.09 0.29 -4.58 121.20 126.37 2a3t s ILE 315 Ca 0.03 -0.34 -0.30 0.00 -2.23 0.00 0.00 60.65 57.82 2a3t s ILE 315 Cb -0.14 -3.79 -0.09 0.00 -1.58 0.00 0.00 42.46 36.86 2a3t s ILE 315 CO -0.06 -0.11 1.24 -0.13 -1.23 0.00 0.00 174.94 174.64 2a3t s ARG 316 N 1.73 4.46 0.20 2.79 0.52 -1.26 -0.43 118.95 126.97 2a3t s ARG 316 Ca 0.06 1.99 -0.33 0.00 -0.52 0.00 0.00 55.73 56.93 2a3t s ARG 316 Cb -0.18 -3.18 -0.14 0.00 0.52 0.00 0.00 34.95 31.98 2a3t s ARG 316 CO 0.10 -0.10 1.52 0.41 0.02 0.00 0.00 175.30 177.25 2a3t n GLY 317 N 1.77 1.01 0.96 -3.53 0.00 -1.24 -1.98 105.19 102.17 2a3t n GLY 317 Ca 0.03 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.63 2a3t n GLY 317 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a3t n GLY 318 N 2.87 0.91 3.53 -0.02 0.00 0.14 -4.76 105.19 107.85 2a3t n GLY 318 Ca 0.14 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.58 2a3t n GLY 318 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a3t s SER 319 N -2.48 -0.07 0.03 1.61 1.04 -0.84 -4.79 113.70 108.20 2a3t s SER 319 Ca 0.00 -0.95 0.07 0.00 0.48 0.00 0.00 55.95 55.55 2a3t s SER 319 Cb 0.00 0.56 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 2a3t s SER 319 CO 0.00 -1.09 -0.21 0.00 0.98 0.00 0.00 173.24 172.92 2a3t s ALA 320 N -4.02 1.74 0.42 5.32 0.00 -1.26 -1.80 121.76 122.16 2a3t s ALA 320 Ca 0.23 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 51.22 2a3t s ALA 320 Cb 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 2a3t s ALA 320 CO 0.08 0.40 0.05 0.20 0.00 0.00 0.00 175.76 176.49 2a3t s GLY 321 N -0.97 2.60 -0.06 0.00 0.00 -0.16 -3.57 107.32 105.16 2a3t s GLY 321 Ca 0.08 -1.38 -0.06 0.00 0.00 0.00 0.00 44.72 43.36 2a3t s GLY 321 CO 0.01 -2.00 0.16 0.00 0.00 0.00 0.00 173.10 171.27 2a3t s ALA 322 N -3.02 -0.40 -0.03 3.20 0.00 -0.76 -0.95 121.76 119.80 2a3t s ALA 322 Ca 0.23 0.42 0.01 0.00 0.00 0.00 0.00 51.96 52.63 2a3t s ALA 322 Cb 0.05 -0.24 0.02 0.00 0.00 0.00 0.00 23.12 22.94 2a3t s ALA 322 CO 0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 175.76 175.76 2a3t s ALA 323 N 0.00 0.49 -0.13 0.00 0.00 -0.55 -0.46 121.76 121.11 2a3t s ALA 323 Ca -0.01 -0.02 -0.05 0.00 0.00 0.00 0.00 51.96 51.88 2a3t s ALA 323 Cb -0.02 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 2a3t s ALA 323 CO 0.00 0.01 0.06 -1.17 0.00 0.00 0.00 175.76 174.66 2a3t s LEU 324 N 0.67 3.89 -0.02 0.00 2.96 0.38 -0.34 118.68 126.23 2a3t s LEU 324 Ca -0.08 0.21 0.01 0.00 -0.22 0.00 0.00 54.13 54.05 2a3t s LEU 324 Cb -0.11 -1.94 0.01 0.00 0.50 0.00 0.00 46.19 44.65 2a3t s LEU 324 CO -0.00 0.31 -0.02 -0.47 -1.32 0.00 0.00 176.35 174.85 2a3t s TYR 325 N -0.47 0.31 -0.32 5.38 5.04 -0.80 -0.60 117.35 125.89 2a3t s TYR 325 Ca 0.10 -0.03 -0.17 0.00 -2.44 0.00 0.00 57.07 54.53 2a3t s TYR 325 Cb -0.12 -0.30 -0.02 0.00 0.35 0.00 0.00 41.96 41.88 2a3t s TYR 325 CO 0.02 -0.07 0.45 0.21 -1.34 0.00 0.00 175.55 174.82 2a3t s LYS 326 N 0.45 3.74 0.21 4.97 2.20 -1.26 -0.88 119.74 129.17 2a3t s LYS 326 Ca -0.04 -0.12 -0.31 0.00 -0.36 0.00 0.00 55.97 55.14 2a3t s LYS 326 Cb -0.07 -3.76 -0.10 0.00 -1.51 0.00 0.00 37.83 32.39 2a3t s LYS 326 CO -0.01 -0.50 1.45 -0.06 -0.36 0.00 0.00 175.35 175.87 2a3t s PHE 327 N 2.23 3.08 -0.00 4.03 0.08 -0.62 -4.89 117.98 121.89 2a3t s PHE 327 Ca 0.17 0.95 0.01 0.00 0.12 0.00 0.00 56.93 58.18 2a3t s PHE 327 Cb -0.16 -3.80 -0.02 0.00 -0.57 0.00 0.00 43.02 38.47 2a3t s PHE 327 CO 0.12 -2.72 0.03 1.28 -0.10 0.00 0.00 175.22 173.83 2a3t n LEU 328 N 2.93 0.00 -4.15 -0.37 4.77 -1.26 -0.03 117.00 118.90 2a3t n LEU 328 Ca 0.09 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.84 2a3t n LEU 328 Cb 0.40 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.35 2a3t n LEU 328 CO 0.60 0.00 -0.49 -1.10 -1.33 0.00 0.00 177.39 175.08 2a3t s GLN 329 N -2.08 1.21 0.87 3.23 -1.52 -1.26 -4.72 119.66 115.38 2a3t s GLN 329 Ca -0.00 -0.65 -0.12 0.00 -1.95 0.00 0.00 55.36 52.64 2a3t s GLN 329 Cb 0.01 -1.20 0.11 0.00 -0.22 0.00 0.00 33.01 31.72 2a3t s GLN 329 CO 0.05 0.32 1.13 -1.25 -0.25 0.00 0.00 175.29 175.29 2a3t s PRO 330 N -0.63 1.47 0.00 2.91 0.04 -1.26 -4.84 135.00 132.68 2a3t s PRO 330 Ca 0.05 0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.47 2a3t s PRO 330 Cb -0.07 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2a3t s PRO 330 CO 0.00 -1.99 0.00 0.41 0.04 0.00 0.00 177.00 175.46 2a3t n GLY 331 N -2.26 0.58 3.84 0.56 0.00 0.13 -4.94 105.19 103.10 2a3t n GLY 331 Ca 0.07 -2.18 -0.37 0.00 0.00 0.00 0.00 46.02 43.54 2a3t n GLY 331 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a3t s VAL 332 N -0.77 5.40 0.17 1.61 1.01 -1.26 -0.84 120.40 125.71 2a3t s VAL 332 Ca 0.00 0.35 0.11 0.00 0.00 0.00 0.00 61.98 62.44 2a3t s VAL 332 Cb 0.00 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2a3t s VAL 332 CO 0.00 0.58 -0.24 -0.31 0.00 0.00 0.00 175.10 175.12 2a3t s TYR 333 N -0.77 2.25 -0.10 5.22 1.51 0.01 -4.98 117.35 120.49 2a3t s TYR 333 Ca 0.16 -0.37 0.03 0.00 -1.01 0.00 0.00 57.07 55.87 2a3t s TYR 333 Cb -0.13 -1.15 -0.01 0.00 -0.11 0.00 0.00 41.96 40.56 2a3t s TYR 333 CO 0.05 0.43 -0.18 0.00 -1.11 0.00 0.00 175.55 174.74 2a3t s ALA 334 N -1.50 2.42 -0.26 3.71 0.00 -1.24 -0.84 121.76 124.06 2a3t s ALA 334 Ca 0.18 -0.95 -0.08 0.00 0.00 0.00 0.00 51.96 51.11 2a3t s ALA 334 Cb -0.08 -0.97 -0.03 0.00 0.00 0.00 0.00 23.12 22.03 2a3t s ALA 334 CO 0.08 0.33 0.09 -0.47 0.00 0.00 0.00 175.76 175.80 2a3t s TYR 335 N 0.10 3.11 0.05 0.00 5.04 0.37 0.15 117.35 126.16 2a3t s TYR 335 Ca -0.09 -0.35 0.01 0.00 -2.44 0.00 0.00 57.07 54.20 2a3t s TYR 335 Cb -0.15 -2.26 -0.03 0.00 0.35 0.00 0.00 41.96 39.86 2a3t s TYR 335 CO 0.05 -0.33 -0.05 0.14 -1.34 0.00 0.00 175.55 174.02 2a3t s VAL 336 N 1.64 0.37 -0.20 3.14 -7.23 -0.07 -0.44 120.40 117.61 2a3t s VAL 336 Ca 0.06 -1.33 -0.29 0.00 -1.81 0.00 0.00 61.98 58.61 2a3t s VAL 336 Cb -0.15 -0.89 -0.01 0.00 0.56 0.00 0.00 36.38 35.89 2a3t s VAL 336 CO 0.05 -0.63 1.24 0.21 -0.31 0.00 0.00 175.10 175.66 2a3t s ASN 337 N -2.08 6.91 -0.08 4.85 3.84 -0.88 -0.92 114.94 126.57 2a3t s ASN 337 Ca -0.04 1.56 0.04 0.00 0.21 0.00 0.00 52.86 54.62 2a3t s ASN 337 Cb -0.04 -2.54 0.25 0.00 -0.55 0.00 0.00 41.25 38.37 2a3t s ASN 337 CO -0.03 -0.81 0.94 1.57 -2.79 0.00 0.00 177.10 175.98 2a3t n HIS 338 N 6.77 0.68 -2.81 0.43 -0.00 0.20 -3.58 115.22 116.91 2a3t n HIS 338 Ca 0.14 -0.32 -0.43 0.00 -0.00 0.00 0.00 57.72 57.11 2a3t n HIS 338 Cb 0.45 -0.26 -0.04 0.00 -0.00 0.00 0.00 29.99 30.14 2a3t n HIS 338 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2a3t s ASN 339 N -0.16 6.34 0.53 0.26 3.04 -1.26 -4.93 114.94 118.76 2a3t s ASN 339 Ca 0.17 -0.35 0.30 0.00 0.04 0.00 0.00 52.86 53.02 2a3t s ASN 339 Cb 0.13 -2.45 1.48 0.00 -1.54 0.00 0.00 41.25 38.88 2a3t s ASN 339 CO 0.05 -1.27 2.06 -0.07 -3.04 0.00 0.00 177.10 174.83 2a3t h LEU 340 N 11.10 0.00 -0.42 3.21 3.38 -1.99 0.21 115.31 130.80 2a3t h LEU 340 Ca -0.26 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 2a3t h LEU 340 Cb 1.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2a3t h LEU 340 CO 1.10 0.10 -0.01 0.40 0.09 0.00 0.00 178.44 180.13 2a3t h ILE 341 N 0.00 1.26 -0.43 1.22 2.04 -1.91 0.94 117.51 120.64 2a3t h ILE 341 Ca -0.00 -1.04 -0.10 0.00 1.00 0.00 0.00 64.86 64.72 2a3t h ILE 341 Cb 0.38 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2a3t h ILE 341 CO 0.01 0.36 -0.13 -0.33 0.00 0.00 0.00 178.15 178.06 2a3t h GLU 342 N 0.59 0.78 -0.10 2.37 5.08 -1.03 0.13 114.58 122.40 2a3t h GLU 342 Ca 0.12 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 2a3t h GLU 342 Cb 0.50 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 2a3t h GLU 342 CO 0.02 0.87 0.04 0.00 -1.00 0.00 0.00 179.01 178.95 2a3t h ALA 343 N 1.15 0.13 0.00 3.43 0.00 -0.63 -1.56 119.26 121.79 2a3t h ALA 343 Ca 0.11 -0.10 -0.43 0.00 0.00 0.00 0.00 54.91 54.49 2a3t h ALA 343 Cb 0.62 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.30 2a3t h ALA 343 CO 0.04 -0.27 -2.51 0.28 0.00 0.00 0.00 179.25 176.79 2a3t n VAL 344 N -4.91 1.51 0.05 0.00 0.31 0.31 -2.03 118.33 113.57 2a3t n VAL 344 Ca -0.06 -0.47 -0.08 0.00 -0.01 0.00 0.00 64.34 63.72 2a3t n VAL 344 Cb 0.12 -1.67 -0.13 0.00 -0.91 0.00 0.00 33.84 31.25 2a3t n VAL 344 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2a3t h HIS 345 N -0.54 0.04 0.00 3.52 3.86 -0.91 -3.37 115.15 117.74 2a3t h HIS 345 Ca -0.65 -0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 58.42 2a3t h HIS 345 Cb 1.75 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 30.19 2a3t h HIS 345 CO -0.03 1.03 -1.97 1.63 0.86 0.00 0.00 177.93 179.44 2a3t n LYS 346 N -3.30 0.66 0.00 2.45 4.76 -0.80 -4.98 118.16 116.95 2a3t n LYS 346 Ca -0.04 -0.08 0.00 0.00 -2.87 0.00 0.00 58.31 55.32 2a3t n LYS 346 Cb 0.97 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 32.59 2a3t n LYS 346 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2a3t n GLY 347 N 1.40 1.06 2.46 0.72 0.00 -0.95 -0.81 105.19 109.06 2a3t n GLY 347 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2a3t n GLY 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3t n ALA 348 N -0.05 6.93 -3.70 4.61 0.00 -0.41 -4.19 120.51 123.70 2a3t n ALA 348 Ca 0.00 -3.82 -0.19 0.00 0.00 0.00 0.00 53.44 49.43 2a3t n ALA 348 Cb 0.00 -3.15 -0.17 0.00 0.00 0.00 0.00 19.45 16.13 2a3t n ALA 348 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2a3t s THR 349 N 0.96 0.26 0.20 0.00 2.01 -1.23 -2.08 115.64 115.77 2a3t s THR 349 Ca 0.60 0.08 0.10 0.00 0.31 0.00 0.00 61.69 62.77 2a3t s THR 349 Cb 0.17 -0.36 -0.04 0.00 0.01 0.00 0.00 72.50 72.28 2a3t s THR 349 CO -0.07 0.18 -0.13 0.00 -0.69 0.00 0.00 174.62 173.91 2a3t s ALA 350 N 1.24 2.85 0.05 7.40 0.00 0.41 -4.64 121.76 129.07 2a3t s ALA 350 Ca -0.07 -1.57 0.07 0.00 0.00 0.00 0.00 51.96 50.39 2a3t s ALA 350 Cb -0.13 -0.60 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 2a3t s ALA 350 CO -0.02 0.42 -0.16 -1.01 0.00 0.00 0.00 175.76 174.99 2a3t s HIS 351 N -1.85 2.62 -0.15 0.00 3.76 -0.44 -0.48 115.29 118.76 2a3t s HIS 351 Ca 0.25 -0.22 0.02 0.00 -0.15 0.00 0.00 55.06 54.97 2a3t s HIS 351 Cb -0.08 -1.47 0.01 0.00 1.11 0.00 0.00 32.58 32.15 2a3t s HIS 351 CO 0.14 0.30 -0.21 0.08 -0.85 0.00 0.00 174.74 174.20 2a3t s VAL 352 N -0.98 2.08 -0.24 -0.90 1.01 -0.02 -0.23 120.40 121.12 2a3t s VAL 352 Ca 0.16 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 61.09 2a3t s VAL 352 Cb -0.11 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2a3t s VAL 352 CO 0.07 0.55 0.12 -0.76 0.00 0.00 0.00 175.10 175.07 2a3t s LEU 353 N 0.92 3.83 -0.11 3.92 1.43 0.43 -0.81 118.68 128.28 2a3t s LEU 353 Ca -0.04 -0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.07 2a3t s LEU 353 Cb -0.15 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.05 2a3t s LEU 353 CO -0.04 0.04 -0.23 -0.69 0.23 0.00 0.00 176.35 175.65 2a3t s VAL 354 N 1.22 2.03 0.07 -1.59 1.01 -0.02 -1.70 120.40 121.42 2a3t s VAL 354 Ca 0.06 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.07 2a3t s VAL 354 Cb -0.14 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 2a3t s VAL 354 CO 0.05 0.55 0.13 -1.83 0.00 0.00 0.00 175.10 174.00 2a3t s GLU 355 N 0.52 3.12 0.00 2.72 -1.05 -0.75 -0.70 118.70 122.57 2a3t s GLU 355 Ca -0.14 -0.58 0.00 0.00 -0.15 0.00 0.00 54.97 54.09 2a3t s GLU 355 Cb -0.17 -2.86 0.00 0.00 -0.44 0.00 0.00 34.13 30.66 2a3t s GLU 355 CO 0.05 0.59 0.00 0.41 0.95 0.00 0.00 175.26 177.25 2a3t n GLY 356 N 0.39 0.12 3.84 -3.83 0.00 -1.26 -0.66 105.19 103.79 2a3t n GLY 356 Ca -0.07 -1.68 -0.37 0.00 0.00 0.00 0.00 46.02 43.90 2a3t n GLY 356 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2a3t s GLU 357 N -1.93 3.72 0.34 1.61 -1.05 -1.26 -4.62 118.70 115.51 2a3t s GLU 357 Ca 0.00 0.03 -0.27 0.00 -0.15 0.00 0.00 54.97 54.58 2a3t s GLU 357 Cb 0.00 -3.24 -0.09 0.00 -0.44 0.00 0.00 34.13 30.35 2a3t s GLU 357 CO 0.00 0.66 1.11 -0.46 0.95 0.00 0.00 175.26 177.51 2a3t s TRP 358 N -0.76 3.38 -0.35 4.83 -0.11 -1.26 -4.36 118.94 120.30 2a3t s TRP 358 Ca 0.17 1.65 -0.00 0.00 1.22 0.00 0.00 56.10 59.13 2a3t s TRP 358 Cb -0.13 -3.27 0.09 0.00 -1.50 0.00 0.00 33.47 28.65 2a3t s TRP 358 CO 0.06 -0.76 0.09 0.34 -4.62 0.00 0.00 176.95 172.06 2a3t s ASP 359 N -1.11 4.98 0.54 5.86 -1.08 -1.26 -4.97 116.67 119.63 2a3t s ASP 359 Ca 0.51 -1.85 0.35 0.00 -0.52 0.00 0.00 52.55 51.03 2a3t s ASP 359 Cb -0.29 -1.73 1.54 0.00 -1.46 0.00 0.00 42.92 40.98 2a3t s ASP 359 CO 0.37 -0.41 2.03 0.78 0.52 0.00 0.00 175.17 178.46 2a3t h ASN 360 N 7.89 0.00 -0.40 -0.34 2.35 -1.96 -2.42 115.58 120.70 2a3t h ASN 360 Ca -0.13 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.54 2a3t h ASN 360 Cb 1.04 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.39 2a3t h ASN 360 CO 0.59 0.00 -0.04 -0.78 -1.65 0.00 0.00 177.43 175.55 2a3t h ASP 361 N 0.00 0.79 -0.05 5.81 3.58 -2.02 -3.15 116.42 121.39 2a3t h ASP 361 Ca 0.00 -0.21 -0.22 0.00 0.42 0.00 0.00 57.03 57.02 2a3t h ASP 361 Cb 0.38 -0.21 0.01 0.00 1.72 0.00 0.00 39.33 41.22 2a3t h ASP 361 CO 0.00 0.88 -0.78 -0.07 -2.88 0.00 0.00 179.24 176.39 2a3t h LEU 362 N 0.75 0.84 -7.02 2.28 3.38 -1.87 -3.46 115.31 110.21 2a3t h LEU 362 Ca 0.14 -0.56 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 2a3t h LEU 362 Cb 0.51 -0.25 -0.21 0.00 0.09 0.00 0.00 40.66 40.80 2a3t h LEU 362 CO 0.03 1.34 0.06 -0.32 0.09 0.00 0.00 178.44 179.64 2a3t s MET 363 N -3.70 0.76 -0.11 1.13 0.00 -1.13 -5.15 119.30 111.11 2a3t s MET 363 Ca -0.09 1.06 -0.08 0.00 0.00 0.00 0.00 55.69 56.58 2a3t s MET 363 Cb 0.09 0.29 0.03 0.00 0.00 0.00 0.00 34.83 35.24 2a3t s MET 363 CO 0.89 -0.12 0.27 -2.00 0.00 0.00 0.00 175.02 174.06 2a3t s GLU 364 N 0.88 0.28 -0.58 4.11 2.12 -1.25 -4.14 118.70 120.11 2a3t s GLU 364 Ca -0.04 0.45 -0.26 0.00 0.36 0.00 0.00 54.97 55.48 2a3t s GLU 364 Cb -0.05 0.05 0.04 0.00 0.26 0.00 0.00 34.13 34.42 2a3t s GLU 364 CO -0.07 -0.09 1.08 -1.14 -0.54 0.00 0.00 175.26 174.50 2a3t s GLN 365 N 0.60 3.40 -0.00 4.30 0.74 -1.26 -4.89 119.66 122.55 2a3t s GLN 365 Ca -0.04 -0.04 -0.20 0.00 0.05 0.00 0.00 55.36 55.13 2a3t s GLN 365 Cb -0.05 -4.05 -0.24 0.00 1.10 0.00 0.00 33.01 29.76 2a3t s GLN 365 CO -0.04 -1.63 1.07 0.28 -0.55 0.00 0.00 175.29 174.43 2a3t h VAL 366 N 6.08 1.43 -3.24 1.34 2.07 -2.02 -3.43 116.25 118.48 2a3t h VAL 366 Ca -0.26 -2.14 -0.53 0.00 0.82 0.00 0.00 66.70 64.59 2a3t h VAL 366 Cb 1.06 2.67 -0.37 0.00 -1.52 0.00 0.00 31.29 33.13 2a3t h VAL 366 CO 1.15 0.62 -0.79 -0.69 0.02 0.00 0.00 177.57 177.88 2a3t s VAL 367 N -3.11 0.97 0.67 2.57 1.01 -1.26 -5.13 120.40 116.12 2a3t s VAL 367 Ca -0.13 -0.38 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 2a3t s VAL 367 Cb 0.03 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.34 2a3t s VAL 367 CO 0.83 0.25 1.11 0.00 0.00 0.00 0.00 175.10 177.29 2a3t s ALA 368 N 1.71 2.43 -0.03 5.51 0.00 -1.26 -4.88 121.76 125.25 2a3t s ALA 368 Ca 0.03 0.53 -0.37 0.00 0.00 0.00 0.00 51.96 52.15 2a3t s ALA 368 Cb -0.14 -3.32 -0.16 0.00 0.00 0.00 0.00 23.12 19.51 2a3t s ALA 368 CO -0.08 -1.35 1.51 -2.30 0.00 0.00 0.00 175.76 173.55 2a3t n PRO 369 N -2.54 1.27 -3.78 0.00 -0.02 -1.26 -4.92 135.00 123.76 2a3t n PRO 369 Ca 0.10 0.46 -0.13 0.00 -2.02 0.00 0.00 63.50 61.92 2a3t n PRO 369 Cb 0.52 -2.14 -0.10 0.00 -0.02 0.00 0.00 33.50 31.76 2a3t n PRO 369 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2a3t s VAL 370 N 1.66 0.03 0.00 -1.45 0.11 -1.26 -5.29 120.40 114.20 2a3t s VAL 370 Ca 0.89 -0.26 0.00 0.00 -2.93 0.00 0.00 61.98 59.68 2a3t s VAL 370 Cb -0.96 -0.50 0.00 0.00 -1.53 0.00 0.00 36.38 33.39 2a3t s VAL 370 CO 0.52 -0.14 0.00 0.61 -3.33 0.00 0.00 175.10 172.76