#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wss s THR 10 N 0.00 2.94 0.15 4.28 -1.32 -1.26 -3.87 115.64 116.55 2wss s THR 10 Ca 0.00 -0.77 0.04 0.00 -1.21 0.00 0.00 61.69 59.76 2wss s THR 10 Cb 0.00 -2.14 -0.04 0.00 -1.51 0.00 0.00 72.50 68.80 2wss s THR 10 CO 0.00 0.59 -0.10 -0.83 -2.21 0.00 0.00 174.62 172.07 2wss s GLY 11 N -0.66 1.06 0.10 6.08 0.00 -0.83 -4.48 107.32 108.59 2wss s GLY 11 Ca 0.10 -1.49 0.07 0.00 0.00 0.00 0.00 44.72 43.40 2wss s GLY 11 CO 0.01 -1.59 -0.09 0.50 0.00 0.00 0.00 173.10 171.92 2wss s ARG 12 N -3.75 2.17 -0.19 2.90 0.52 -0.02 -0.12 118.95 120.47 2wss s ARG 12 Ca 0.17 -1.00 -0.25 0.00 -0.52 0.00 0.00 55.73 54.12 2wss s ARG 12 Cb 0.03 -2.33 -0.01 0.00 0.52 0.00 0.00 34.95 33.16 2wss s ARG 12 CO 0.00 0.51 0.83 0.42 0.02 0.00 0.00 175.30 177.09 2wss s ILE 13 N -1.21 4.87 -0.20 1.52 1.01 -0.25 0.56 121.20 127.50 2wss s ILE 13 Ca 0.22 1.62 0.03 0.00 0.00 0.00 0.00 60.65 62.52 2wss s ILE 13 Cb -0.11 -4.13 -0.21 0.00 0.01 0.00 0.00 42.46 38.02 2wss s ILE 13 CO 0.14 0.00 0.02 1.33 0.00 0.00 0.00 174.94 176.43 2wss n VAL 14 N 4.85 1.55 -4.11 2.92 0.24 -0.52 -0.59 118.33 122.68 2wss n VAL 14 Ca 0.05 -0.65 -0.18 0.00 -2.04 0.00 0.00 64.34 61.51 2wss n VAL 14 Cb 0.48 -1.31 -0.16 0.00 -1.47 0.00 0.00 33.84 31.39 2wss n VAL 14 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wss s ALA 15 N -2.53 0.51 0.03 2.33 0.00 -1.06 -4.77 121.76 116.28 2wss s ALA 15 Ca -0.26 -0.04 0.05 0.00 0.00 0.00 0.00 51.96 51.72 2wss s ALA 15 Cb 0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2wss s ALA 15 CO 0.69 0.01 -0.15 0.14 0.00 0.00 0.00 175.76 176.45 2wss s VAL 16 N 0.65 1.22 -0.11 0.00 -7.23 -1.26 0.06 120.40 113.73 2wss s VAL 16 Ca -0.08 -0.96 -0.05 0.00 -1.81 0.00 0.00 61.98 59.09 2wss s VAL 16 Cb -0.11 -1.08 0.05 0.00 0.56 0.00 0.00 36.38 35.80 2wss s VAL 16 CO -0.00 0.11 0.23 -0.51 -0.31 0.00 0.00 175.10 174.61 2wss s ILE 17 N -0.74 -0.20 0.00 -0.62 1.10 -0.68 -5.05 121.20 115.01 2wss s ILE 17 Ca 0.03 0.23 0.00 0.00 -0.51 0.00 0.00 60.65 60.40 2wss s ILE 17 Cb -0.08 -0.37 0.00 0.00 0.15 0.00 0.00 42.46 42.16 2wss s ILE 17 CO 0.01 0.09 0.00 0.61 -2.11 0.00 0.00 174.94 173.54 2wss n GLY 18 N 4.77 2.47 1.43 1.50 0.00 -1.26 -0.49 105.19 113.61 2wss n GLY 18 Ca -0.16 0.20 0.08 0.00 0.00 0.00 0.00 46.02 46.14 2wss n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wss n ALA 19 N 9.34 3.10 -3.41 4.61 0.00 -1.26 -4.67 120.51 128.21 2wss n ALA 19 Ca 0.00 -1.36 -0.34 0.00 0.00 0.00 0.00 53.44 51.73 2wss n ALA 19 Cb 0.00 -1.04 -0.14 0.00 0.00 0.00 0.00 19.45 18.27 2wss n ALA 19 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wss s VAL 20 N -1.89 3.27 -0.01 0.00 1.01 0.35 -0.34 120.40 122.79 2wss s VAL 20 Ca 0.43 -0.54 0.07 0.00 0.00 0.00 0.00 61.98 61.94 2wss s VAL 20 Cb 0.29 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 2wss s VAL 20 CO 0.20 0.46 -0.22 -0.69 0.00 0.00 0.00 175.10 174.85 2wss s VAL 21 N 1.15 2.43 -0.26 2.92 1.01 0.47 -1.69 120.40 126.43 2wss s VAL 21 Ca 0.02 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 60.93 2wss s VAL 21 Cb -0.14 -1.92 0.04 0.00 0.00 0.00 0.00 36.38 34.36 2wss s VAL 21 CO -0.02 0.52 -0.06 -1.81 0.00 0.00 0.00 175.10 173.73 2wss s ASP 22 N -0.85 4.43 -0.05 3.32 1.01 0.11 -0.01 116.67 124.63 2wss s ASP 22 Ca 0.11 -1.06 0.04 0.00 0.71 0.00 0.00 52.55 52.35 2wss s ASP 22 Cb -0.10 -1.65 -0.02 0.00 1.01 0.00 0.00 42.92 42.15 2wss s ASP 22 CO 0.01 -0.17 -0.15 0.68 0.21 0.00 0.00 175.17 175.75 2wss s VAL 23 N 1.27 3.01 -0.10 -1.27 -7.23 -0.48 -1.43 120.40 114.15 2wss s VAL 23 Ca -0.03 -0.74 -0.05 0.00 -1.81 0.00 0.00 61.98 59.35 2wss s VAL 23 Cb -0.18 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.55 2wss s VAL 23 CO -0.04 0.59 0.10 -1.58 -0.31 0.00 0.00 175.10 173.86 2wss s GLN 24 N -0.68 3.30 -0.17 4.82 0.74 0.19 -0.14 119.66 127.73 2wss s GLN 24 Ca 0.10 -0.22 -0.01 0.00 0.05 0.00 0.00 55.36 55.29 2wss s GLN 24 Cb -0.11 -3.07 0.04 0.00 1.10 0.00 0.00 33.01 30.98 2wss s GLN 24 CO 0.01 0.75 -0.05 -0.06 -0.55 0.00 0.00 175.29 175.39 2wss s PHE 25 N -1.00 1.69 0.06 1.67 2.99 -0.54 -0.84 117.98 122.01 2wss s PHE 25 Ca 0.15 -1.09 -0.25 0.00 0.00 0.00 0.00 56.93 55.74 2wss s PHE 25 Cb -0.12 -1.31 -0.17 0.00 0.00 0.00 0.00 43.02 41.43 2wss s PHE 25 CO 0.04 -0.62 1.58 -0.44 -0.00 0.00 0.00 175.22 175.78 2wss h ASP 26 N 8.12 -0.13 -4.29 1.36 3.32 -1.83 -3.44 116.42 119.52 2wss h ASP 26 Ca -0.24 -0.11 -0.49 0.00 0.02 0.00 0.00 57.03 56.22 2wss h ASP 26 Cb 1.11 0.03 -0.26 0.00 0.22 0.00 0.00 39.33 40.44 2wss h ASP 26 CO 0.40 0.03 -0.81 -1.61 -1.72 0.00 0.00 179.24 175.53 2wss s GLU 27 N -5.63 1.09 -0.27 3.56 2.02 -1.26 -5.00 118.70 113.21 2wss s GLU 27 Ca -0.14 -0.77 -0.03 0.00 0.02 0.00 0.00 54.97 54.06 2wss s GLU 27 Cb 0.04 -1.12 0.00 0.00 0.10 0.00 0.00 34.13 33.16 2wss s GLU 27 CO 0.65 0.28 0.10 0.41 0.02 0.00 0.00 175.26 176.72 2wss n GLY 28 N 2.02 -3.51 3.76 -1.39 0.00 -1.26 -4.81 105.19 100.00 2wss n GLY 28 Ca -0.17 0.47 -0.40 0.00 0.00 0.00 0.00 46.02 45.92 2wss n GLY 28 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wss s LEU 29 N -1.53 4.55 0.32 0.99 1.02 -1.26 -4.96 118.68 117.81 2wss s LEU 29 Ca 0.04 1.64 -0.28 0.00 0.02 0.00 0.00 54.13 55.55 2wss s LEU 29 Cb -0.01 -3.34 -0.09 0.00 0.02 0.00 0.00 46.19 42.76 2wss s LEU 29 CO 0.64 0.13 1.15 -2.84 0.02 0.00 0.00 176.35 175.45 2wss s PRO 30 N -0.75 4.43 0.75 1.29 0.02 -1.26 -5.01 135.00 134.48 2wss s PRO 30 Ca 0.38 1.87 -0.15 0.00 0.02 0.00 0.00 61.00 63.12 2wss s PRO 30 Cb -0.23 -3.01 0.01 0.00 0.02 0.00 0.00 34.50 31.29 2wss s PRO 30 CO 0.26 0.00 0.87 -2.30 -0.33 0.00 0.00 177.00 175.51 2wss n PRO 31 N 0.79 0.37 -1.76 5.54 -0.02 -1.26 -4.85 135.00 133.81 2wss n PRO 31 Ca 0.01 0.18 -0.43 0.00 -2.02 0.00 0.00 63.50 61.24 2wss n PRO 31 Cb 0.45 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 2wss n PRO 31 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2wss s ILE 32 N -1.92 3.19 0.00 4.25 1.01 -1.26 -2.36 121.20 124.11 2wss s ILE 32 Ca 0.71 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.57 2wss s ILE 32 Cb -0.33 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 38.93 2wss s ILE 32 CO 0.53 -0.10 0.00 0.18 0.00 0.00 0.00 174.94 175.55 2wss n LEU 33 N 9.91 0.00 -4.65 2.97 4.77 -0.77 -4.98 117.00 124.26 2wss n LEU 33 Ca 0.25 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.80 2wss n LEU 33 Cb 0.44 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 2wss n LEU 33 CO 0.66 0.00 1.05 0.20 -1.33 0.00 0.00 177.39 177.97 2wss s ASN 34 N -0.68 6.90 -0.01 -1.43 -0.87 -1.00 -3.76 114.94 114.10 2wss s ASN 34 Ca 0.00 1.41 -0.30 0.00 -1.57 0.00 0.00 52.86 52.40 2wss s ASN 34 Cb 0.00 -2.54 -0.08 0.00 -0.02 0.00 0.00 41.25 38.61 2wss s ASN 34 CO 0.00 -0.85 2.02 0.00 -2.57 0.00 0.00 177.10 175.70 2wss n ALA 35 N 6.87 1.61 -1.96 0.60 0.00 0.88 -2.61 120.51 125.91 2wss n ALA 35 Ca 0.13 0.14 -0.24 0.00 0.00 0.00 0.00 53.44 53.48 2wss n ALA 35 Cb 0.46 -2.72 0.07 0.00 0.00 0.00 0.00 19.45 17.26 2wss n ALA 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wss s LEU 36 N 5.09 3.01 -0.12 0.00 1.43 0.48 -2.66 118.68 125.90 2wss s LEU 36 Ca 0.91 0.10 -0.02 0.00 -1.03 0.00 0.00 54.13 54.09 2wss s LEU 36 Cb -0.42 -2.75 0.04 0.00 0.03 0.00 0.00 46.19 43.09 2wss s LEU 36 CO 0.41 -1.54 0.02 -1.61 0.23 0.00 0.00 176.35 173.87 2wss s GLU 37 N -5.07 0.58 0.17 1.70 0.41 -0.49 -2.42 118.70 113.57 2wss s GLU 37 Ca 0.61 -0.10 -0.30 0.00 -0.41 0.00 0.00 54.97 54.77 2wss s GLU 37 Cb -0.09 -1.46 -0.07 0.00 -1.78 0.00 0.00 34.13 30.72 2wss s GLU 37 CO 0.43 -0.46 1.11 0.08 -0.49 0.00 0.00 175.26 175.93 2wss s VAL 38 N 1.94 3.85 -0.44 2.63 1.01 -1.14 -1.28 120.40 126.98 2wss s VAL 38 Ca 0.03 1.58 -0.06 0.00 0.00 0.00 0.00 61.98 63.52 2wss s VAL 38 Cb -0.14 -4.01 0.11 0.00 0.00 0.00 0.00 36.38 32.34 2wss s VAL 38 CO -0.07 0.26 0.27 -1.10 0.00 0.00 0.00 175.10 174.47 2wss s GLN 39 N -0.28 2.26 0.00 2.72 -1.52 -0.84 -4.60 119.66 117.41 2wss s GLN 39 Ca 0.50 -1.77 0.00 0.00 -1.95 0.00 0.00 55.36 52.15 2wss s GLN 39 Cb -0.30 -3.75 0.00 0.00 -0.22 0.00 0.00 33.01 28.75 2wss s GLN 39 CO 0.35 -1.12 0.00 0.41 -0.25 0.00 0.00 175.29 174.68 2wss n GLY 40 N 4.76 -0.22 3.12 3.09 0.00 -1.26 -4.12 105.19 110.56 2wss n GLY 40 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 2wss n GLY 40 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wss s ARG 41 N 0.00 0.70 0.00 1.61 1.70 -1.26 -5.01 118.95 116.69 2wss s ARG 41 Ca 0.00 -1.01 0.00 0.00 -0.47 0.00 0.00 55.73 54.25 2wss s ARG 41 Cb 0.00 -0.38 0.00 0.00 -0.57 0.00 0.00 34.95 34.00 2wss s ARG 41 CO 0.00 0.05 0.45 0.39 -1.08 0.00 0.00 175.30 175.11 2wss n GLU 42 N 0.88 0.71 -3.66 3.89 1.02 -1.26 -4.66 120.64 117.55 2wss n GLU 42 Ca -0.19 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.86 2wss n GLU 42 Cb 0.57 -1.26 -0.10 0.00 -0.02 0.00 0.00 31.44 30.62 2wss n GLU 42 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2wss s THR 43 N -1.26 -0.57 -0.42 2.62 -4.23 -1.26 -5.09 115.64 105.42 2wss s THR 43 Ca 0.00 0.19 -0.33 0.00 -1.18 0.00 0.00 61.69 60.37 2wss s THR 43 Cb 0.00 -0.62 -0.11 0.00 1.34 0.00 0.00 72.50 73.11 2wss s THR 43 CO 0.00 0.08 2.28 -1.14 -0.54 0.00 0.00 174.62 175.29 2wss n ARG 44 N 5.33 1.05 -3.52 3.99 0.63 -1.26 -4.84 116.66 118.03 2wss n ARG 44 Ca -0.09 0.24 -0.37 0.00 -0.92 0.00 0.00 57.85 56.71 2wss n ARG 44 Cb 0.50 -2.59 -0.05 0.00 0.45 0.00 0.00 32.46 30.77 2wss n ARG 44 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2wss n LEU 45 N 10.99 4.54 -4.72 6.15 7.94 -1.26 -4.93 117.00 135.71 2wss n LEU 45 Ca 0.42 -5.16 -0.42 0.00 -1.11 0.00 0.00 56.01 49.74 2wss n LEU 45 Cb 0.28 -1.12 -0.03 0.00 0.53 0.00 0.00 43.42 43.08 2wss n LEU 45 CO 0.76 1.60 1.29 -0.69 -1.11 0.00 0.00 177.39 179.24 2wss s VAL 46 N -1.62 2.41 0.41 1.96 1.01 -1.26 -2.89 120.40 120.42 2wss s VAL 46 Ca 0.30 0.28 0.08 0.00 0.00 0.00 0.00 61.98 62.63 2wss s VAL 46 Cb -0.04 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2wss s VAL 46 CO -0.09 0.02 0.52 -0.76 0.00 0.00 0.00 175.10 174.79 2wss s LEU 47 N 1.24 3.63 -0.14 3.92 1.43 -1.02 -1.86 118.68 125.88 2wss s LEU 47 Ca 0.72 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 53.32 2wss s LEU 47 Cb -0.46 -2.54 0.06 0.00 0.03 0.00 0.00 46.19 43.28 2wss s LEU 47 CO 0.32 -0.70 0.11 -0.70 0.23 0.00 0.00 176.35 175.60 2wss s GLU 48 N -4.28 0.05 0.29 1.70 2.12 -0.97 -0.39 118.70 117.22 2wss s GLU 48 Ca 0.52 0.10 -0.30 0.00 0.36 0.00 0.00 54.97 55.66 2wss s GLU 48 Cb -0.09 -1.36 -0.12 0.00 0.26 0.00 0.00 34.13 32.83 2wss s GLU 48 CO 0.32 -0.57 1.57 0.28 -0.54 0.00 0.00 175.26 176.32 2wss n VAL 49 N 5.29 1.04 0.00 3.70 0.31 -1.07 -1.32 118.33 126.29 2wss n VAL 49 Ca -0.06 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 2wss n VAL 49 Cb 0.49 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 2wss n VAL 49 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wss n ALA 50 N 2.07 1.15 -2.97 3.52 0.00 0.23 -1.85 120.51 122.66 2wss n ALA 50 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.43 2wss n ALA 50 Cb 0.36 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.70 2wss n ALA 50 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2wss s GLN 51 N -1.11 0.26 -0.44 0.00 -0.21 0.05 -4.93 119.66 113.29 2wss s GLN 51 Ca 0.00 -0.43 -0.13 0.00 0.02 0.00 0.00 55.36 54.82 2wss s GLN 51 Cb 0.00 0.10 0.06 0.00 1.00 0.00 0.00 33.01 34.17 2wss s GLN 51 CO 0.00 -0.05 0.32 -1.01 -2.12 0.00 0.00 175.29 172.43 2wss s HIS 52 N -1.10 3.27 -0.84 0.91 3.76 -1.26 0.43 115.29 120.46 2wss s HIS 52 Ca -0.12 -1.08 0.24 0.00 -0.15 0.00 0.00 55.06 53.95 2wss s HIS 52 Cb -0.07 -2.94 0.93 0.00 1.11 0.00 0.00 32.58 31.61 2wss s HIS 52 CO -0.00 -0.77 1.74 1.28 -0.85 0.00 0.00 174.74 176.13 2wss n LEU 53 N 5.08 0.33 0.00 0.89 4.77 -0.44 -4.99 117.00 122.65 2wss n LEU 53 Ca -0.11 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 2wss n LEU 53 Cb 0.44 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2wss n LEU 53 CO 0.43 -0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.88 2wss n GLY 54 N 0.80 -1.82 3.86 -0.72 0.00 -1.22 -4.94 105.19 101.16 2wss n GLY 54 Ca 0.05 -1.75 -0.32 0.00 0.00 0.00 0.00 46.02 44.01 2wss n GLY 54 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wss n GLU 55 N 0.00 -1.08 -3.99 1.61 1.02 -1.26 -0.31 120.64 116.62 2wss n GLU 55 Ca 0.00 0.10 -0.38 0.00 -0.02 0.00 0.00 57.16 56.86 2wss n GLU 55 Cb 0.00 -4.13 0.00 0.00 -0.02 0.00 0.00 31.44 27.30 2wss n GLU 55 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2wss n SER 56 N -1.95 -3.24 -4.04 1.62 7.64 -1.26 -4.87 113.62 107.52 2wss n SER 56 Ca 0.09 -1.19 -0.14 0.00 1.01 0.00 0.00 58.87 58.64 2wss n SER 56 Cb 0.40 -2.29 -0.12 0.00 -1.01 0.00 0.00 64.21 61.19 2wss n SER 56 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2wss s THR 57 N -3.69 0.54 0.21 0.44 2.01 0.57 -1.46 115.64 114.26 2wss s THR 57 Ca 0.36 -0.85 0.09 0.00 0.31 0.00 0.00 61.69 61.59 2wss s THR 57 Cb -0.17 -0.56 -0.05 0.00 0.01 0.00 0.00 72.50 71.73 2wss s THR 57 CO 0.94 -0.23 -0.17 0.68 -0.69 0.00 0.00 174.62 175.15 2wss s VAL 58 N -1.02 1.93 -0.12 3.82 -7.23 0.81 -1.32 120.40 117.26 2wss s VAL 58 Ca -0.06 -2.17 0.01 0.00 -1.81 0.00 0.00 61.98 57.95 2wss s VAL 58 Cb -0.08 -2.04 -0.01 0.00 0.56 0.00 0.00 36.38 34.81 2wss s VAL 58 CO 0.00 -0.47 -0.16 -0.60 -0.31 0.00 0.00 175.10 173.57 2wss s ARG 59 N -3.36 3.29 0.09 4.82 3.52 0.17 -1.38 118.95 126.11 2wss s ARG 59 Ca 0.22 -0.73 0.07 0.00 -0.13 0.00 0.00 55.73 55.16 2wss s ARG 59 Cb -0.03 -2.55 -0.03 0.00 -1.56 0.00 0.00 34.95 30.78 2wss s ARG 59 CO 0.09 0.21 -0.19 0.95 -0.81 0.00 0.00 175.30 175.55 2wss s THR 60 N 0.33 1.53 -0.31 4.11 -4.23 0.99 0.76 115.64 118.83 2wss s THR 60 Ca -0.13 -1.48 -0.11 0.00 -1.18 0.00 0.00 61.69 58.79 2wss s THR 60 Cb -0.16 -1.41 -0.03 0.00 1.34 0.00 0.00 72.50 72.23 2wss s THR 60 CO 0.06 -0.11 0.20 -0.63 -0.54 0.00 0.00 174.62 173.60 2wss s ILE 61 N -1.21 5.14 1.19 2.99 1.01 -0.43 -0.40 121.20 129.50 2wss s ILE 61 Ca 0.04 -0.08 -0.17 0.00 0.00 0.00 0.00 60.65 60.44 2wss s ILE 61 Cb -0.10 -3.54 0.23 0.00 0.01 0.00 0.00 42.46 39.05 2wss s ILE 61 CO 0.04 0.13 0.53 0.00 0.00 0.00 0.00 174.94 175.63 2wss n ALA 62 N 5.06 -3.60 -1.12 9.38 0.00 0.53 -2.28 120.51 128.48 2wss n ALA 62 Ca -0.14 -1.35 0.03 0.00 0.00 0.00 0.00 53.44 51.98 2wss n ALA 62 Cb 0.51 -1.64 0.05 0.00 0.00 0.00 0.00 19.45 18.36 2wss n ALA 62 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2wss n MET 63 N -3.70 1.02 -3.87 0.00 0.00 -0.78 -4.23 117.12 105.57 2wss n MET 63 Ca 0.03 -1.54 -0.02 0.00 0.00 0.00 0.00 57.70 56.17 2wss n MET 63 Cb 0.56 -0.93 0.01 0.00 0.00 0.00 0.00 33.22 32.86 2wss n MET 63 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2wss s ASP 64 N -1.45 -0.02 0.52 7.83 -1.08 -1.26 -4.54 116.67 116.67 2wss s ASP 64 Ca 0.11 -0.55 -0.20 0.00 -0.52 0.00 0.00 52.55 51.39 2wss s ASP 64 Cb 0.09 0.43 -0.10 0.00 -1.46 0.00 0.00 42.92 41.89 2wss s ASP 64 CO 0.01 -0.85 0.59 0.61 0.52 0.00 0.00 175.17 176.05 2wss n GLY 65 N -0.69 -1.34 0.03 2.66 0.00 -1.26 -4.90 105.19 99.68 2wss n GLY 65 Ca -0.03 -0.09 0.03 0.00 0.00 0.00 0.00 46.02 45.94 2wss n GLY 65 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wss n THR 66 N -1.38 1.19 -1.64 2.61 -2.24 -1.26 -5.02 114.28 106.54 2wss n THR 66 Ca 0.11 -1.31 -0.39 0.00 -2.27 0.00 0.00 64.05 60.19 2wss n THR 66 Cb 0.45 0.30 0.03 0.00 -2.10 0.00 0.00 70.33 69.01 2wss n THR 66 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2wss n GLU 67 N -0.75 1.28 0.00 -0.78 0.00 -1.26 -2.97 120.64 116.17 2wss n GLU 67 Ca 0.05 0.47 0.00 0.00 0.00 0.00 0.00 57.16 57.68 2wss n GLU 67 Cb 0.39 -2.20 0.00 0.00 0.00 0.00 0.00 31.44 29.63 2wss n GLU 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wss n GLY 68 N 1.13 2.67 2.48 -1.84 0.00 -1.26 -5.04 105.19 103.34 2wss n GLY 68 Ca 0.11 -0.63 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 2wss n GLY 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wss n LEU 69 N 0.00 -1.96 -4.12 0.99 4.77 -1.16 -4.98 117.00 110.54 2wss n LEU 69 Ca 0.00 0.65 -0.15 0.00 -0.03 0.00 0.00 56.01 56.48 2wss n LEU 69 Cb 0.00 -0.67 -0.11 0.00 -2.33 0.00 0.00 43.42 40.31 2wss n LEU 69 CO 0.00 -3.00 -0.42 -0.69 -1.33 0.00 0.00 177.39 171.94 2wss s VAL 70 N -1.18 0.81 -0.20 4.08 1.01 -1.26 -5.07 120.40 118.58 2wss s VAL 70 Ca 0.45 -1.27 -0.28 0.00 0.00 0.00 0.00 61.98 60.87 2wss s VAL 70 Cb -0.51 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 2wss s VAL 70 CO 0.46 -0.37 2.05 -0.13 0.00 0.00 0.00 175.10 177.11 2wss s ARG 71 N -1.89 3.37 0.00 2.72 0.52 -1.26 -3.40 118.95 119.00 2wss s ARG 71 Ca -0.04 1.96 0.00 0.00 -0.52 0.00 0.00 55.73 57.13 2wss s ARG 71 Cb -0.08 -4.28 0.00 0.00 0.52 0.00 0.00 34.95 31.11 2wss s ARG 71 CO 0.01 -1.83 0.00 0.41 0.02 0.00 0.00 175.30 173.91 2wss n GLY 72 N 5.43 0.78 0.98 -3.53 0.00 0.25 -5.01 105.19 104.09 2wss n GLY 72 Ca 0.26 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2wss n GLY 72 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2wss n GLN 73 N 0.00 0.00 -2.63 1.61 7.27 -1.22 -1.09 117.38 121.32 2wss n GLN 73 Ca 0.00 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.76 2wss n GLN 73 Cb 0.00 -0.33 -0.03 0.00 2.41 0.00 0.00 30.24 32.30 2wss n GLN 73 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 2wss s LYS 74 N -0.15 3.79 -0.01 3.69 -0.14 -1.26 -2.36 119.74 123.29 2wss s LYS 74 Ca 0.00 0.59 -0.00 0.00 -1.36 0.00 0.00 55.97 55.20 2wss s LYS 74 Cb 0.00 -2.30 0.02 0.00 -1.68 0.00 0.00 37.83 33.87 2wss s LYS 74 CO 0.00 -0.16 0.02 0.08 -0.76 0.00 0.00 175.35 174.54 2wss s VAL 75 N -2.54 -0.03 -0.18 3.17 1.01 0.83 -1.98 120.40 120.68 2wss s VAL 75 Ca 0.53 0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.57 2wss s VAL 75 Cb -0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 36.38 36.18 2wss s VAL 75 CO 0.34 0.05 0.04 -0.76 0.00 0.00 0.00 175.10 174.77 2wss s LEU 76 N 0.63 3.67 0.40 3.92 1.43 -0.41 -1.97 118.68 126.35 2wss s LEU 76 Ca -0.05 0.02 -0.27 0.00 -1.03 0.00 0.00 54.13 52.81 2wss s LEU 76 Cb -0.08 -1.92 -0.09 0.00 0.03 0.00 0.00 46.19 44.13 2wss s LEU 76 CO -0.02 0.17 1.35 -0.62 0.23 0.00 0.00 176.35 177.46 2wss s ASP 77 N 0.39 6.31 0.00 2.29 -1.08 -1.25 -1.40 116.67 121.93 2wss s ASP 77 Ca 0.01 2.76 0.24 0.00 -0.52 0.00 0.00 52.55 55.04 2wss s ASP 77 Cb -0.13 -2.65 0.34 0.00 -1.46 0.00 0.00 42.92 39.02 2wss s ASP 77 CO 0.01 -0.86 1.31 -1.54 0.52 0.00 0.00 175.17 174.61 2wss n SER 78 N 0.22 1.91 0.00 -0.34 3.41 -1.09 -4.89 113.62 112.84 2wss n SER 78 Ca 0.03 -1.45 0.00 0.00 -0.26 0.00 0.00 58.87 57.19 2wss n SER 78 Cb 0.42 0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 2wss n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wss n GLY 79 N 1.36 0.27 3.20 5.00 0.00 -1.26 -4.92 105.19 108.84 2wss n GLY 79 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 2wss n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wss s ALA 80 N -1.79 0.48 1.07 4.61 0.00 -1.26 -5.05 121.76 119.82 2wss s ALA 80 Ca 0.00 -1.20 -0.22 0.00 0.00 0.00 0.00 51.96 50.54 2wss s ALA 80 Cb 0.00 0.75 -0.02 0.00 0.00 0.00 0.00 23.12 23.85 2wss s ALA 80 CO 0.00 -0.52 -0.64 -2.30 0.00 0.00 0.00 175.76 172.30 2wss n PRO 81 N -0.10 -0.89 -2.01 0.00 -0.02 -1.25 -0.08 135.00 130.65 2wss n PRO 81 Ca -0.08 -0.25 -0.42 0.00 -2.02 0.00 0.00 63.50 60.73 2wss n PRO 81 Cb 0.63 -1.40 -0.03 0.00 -0.02 0.00 0.00 33.50 32.68 2wss n PRO 81 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2wss s ILE 82 N -2.14 3.49 0.03 4.25 1.01 -1.26 -4.22 121.20 122.37 2wss s ILE 82 Ca 0.48 0.70 0.09 0.00 0.00 0.00 0.00 60.65 61.91 2wss s ILE 82 Cb -0.03 -3.45 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 2wss s ILE 82 CO 0.67 -0.04 -0.26 -0.60 0.00 0.00 0.00 174.94 174.70 2wss s ARG 83 N 3.62 1.81 0.14 2.79 3.52 -1.26 -1.80 118.95 127.77 2wss s ARG 83 Ca 0.73 -1.07 0.02 0.00 -0.13 0.00 0.00 55.73 55.29 2wss s ARG 83 Cb -0.34 -1.95 -0.04 0.00 -1.56 0.00 0.00 34.95 31.06 2wss s ARG 83 CO 0.30 0.51 -0.05 0.96 -0.81 0.00 0.00 175.30 176.21 2wss s ILE 84 N -0.77 0.82 0.20 4.11 -4.36 0.19 -4.74 121.20 116.64 2wss s ILE 84 Ca 0.11 -1.99 -0.32 0.00 -0.26 0.00 0.00 60.65 58.19 2wss s ILE 84 Cb -0.10 -1.90 -0.14 0.00 1.25 0.00 0.00 42.46 41.57 2wss s ILE 84 CO 0.02 -0.69 1.36 -2.65 0.24 0.00 0.00 174.94 173.22 2wss n PRO 85 N -0.16 1.74 -4.20 0.37 -0.02 -1.26 -2.01 135.00 129.46 2wss n PRO 85 Ca -0.09 0.62 -0.12 0.00 -2.02 0.00 0.00 63.50 61.89 2wss n PRO 85 Cb 0.62 -2.25 -0.10 0.00 -0.02 0.00 0.00 33.50 31.75 2wss n PRO 85 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wss s VAL 86 N 0.07 0.19 0.00 -1.45 0.11 -1.24 -4.85 120.40 113.24 2wss s VAL 86 Ca 0.72 -1.96 0.00 0.00 -2.93 0.00 0.00 61.98 57.81 2wss s VAL 86 Cb -0.73 -2.30 0.00 0.00 -1.53 0.00 0.00 36.38 31.81 2wss s VAL 86 CO 0.49 -0.23 0.00 0.61 -3.33 0.00 0.00 175.10 172.64 2wss n GLY 87 N -0.23 -0.07 0.10 6.54 0.00 -1.26 -4.49 105.19 105.78 2wss n GLY 87 Ca -0.02 -2.28 0.13 0.00 0.00 0.00 0.00 46.02 43.85 2wss n GLY 87 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wss n PRO 88 N -0.39 0.27 0.00 1.61 -0.02 -1.26 -3.21 135.00 132.00 2wss n PRO 88 Ca 0.00 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2wss n PRO 88 Cb 0.00 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 2wss n PRO 88 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2wss n GLU 89 N -2.26 0.81 -0.12 -0.52 0.00 -1.26 -2.78 120.64 114.51 2wss n GLU 89 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 57.16 57.03 2wss n GLU 89 Cb 0.43 -1.29 -0.11 0.00 0.00 0.00 0.00 31.44 30.47 2wss n GLU 89 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2wss n THR 90 N -0.07 1.40 -1.73 3.84 -2.24 -1.20 -4.78 114.28 109.49 2wss n THR 90 Ca 0.00 -0.52 -0.64 0.00 -2.27 0.00 0.00 64.05 60.63 2wss n THR 90 Cb 0.15 -1.41 -0.09 0.00 -2.10 0.00 0.00 70.33 66.88 2wss n THR 90 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2wss n LEU 91 N -3.30 1.71 0.00 3.22 4.77 -1.12 -0.33 117.00 121.94 2wss n LEU 91 Ca -0.44 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.68 2wss n LEU 91 Cb 0.95 -0.99 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2wss n LEU 91 CO 0.22 -0.67 0.00 0.61 -1.33 0.00 0.00 177.39 176.23 2wss n GLY 92 N 4.09 1.80 3.89 -0.72 0.00 0.21 -4.75 105.19 109.70 2wss n GLY 92 Ca 0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 2wss n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wss s ARG 93 N -0.92 3.37 -0.25 1.61 1.81 0.54 -4.89 118.95 120.23 2wss s ARG 93 Ca 0.00 -0.38 -0.11 0.00 -1.72 0.00 0.00 55.73 53.52 2wss s ARG 93 Cb 0.00 -3.04 -0.05 0.00 -0.45 0.00 0.00 34.95 31.41 2wss s ARG 93 CO 0.00 0.66 0.20 0.42 -0.68 0.00 0.00 175.30 175.90 2wss s ILE 94 N -1.34 5.32 0.10 1.52 1.01 -1.26 -2.48 121.20 124.06 2wss s ILE 94 Ca 0.28 0.25 0.09 0.00 0.00 0.00 0.00 60.65 61.27 2wss s ILE 94 Cb -0.13 -3.54 -0.03 0.00 0.01 0.00 0.00 42.46 38.77 2wss s ILE 94 CO 0.20 0.30 -0.22 0.00 0.00 0.00 0.00 174.94 175.22 2wss s MET 95 N 1.30 1.22 0.00 2.79 0.23 0.09 -1.08 119.30 123.85 2wss s MET 95 Ca 0.09 -1.17 0.00 0.00 -1.03 0.00 0.00 55.69 53.58 2wss s MET 95 Cb -0.14 -1.51 0.00 0.00 -1.53 0.00 0.00 34.83 31.64 2wss s MET 95 CO 0.07 0.36 0.00 0.27 -2.03 0.00 0.00 175.02 173.68 2wss n ASN 96 N 1.16 0.00 0.07 -1.18 2.04 -0.25 -1.93 115.26 115.18 2wss n ASN 96 Ca -0.19 -0.94 0.03 0.00 -0.44 0.00 0.00 54.58 53.03 2wss n ASN 96 Cb 0.53 0.00 0.40 0.00 -2.53 0.00 0.00 39.78 38.18 2wss n ASN 96 CO 0.00 0.00 0.00 -0.37 -0.44 0.00 0.00 177.26 176.45 2wss h VAL 97 N -0.68 1.14 -0.64 3.53 -1.51 -1.88 -2.52 116.25 113.68 2wss h VAL 97 Ca 0.00 -0.54 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 2wss h VAL 97 Cb 0.00 0.93 0.00 0.00 -2.13 0.00 0.00 31.29 30.09 2wss h VAL 97 CO 0.00 0.19 0.00 2.30 -1.23 0.00 0.00 177.57 178.83 2wss n ILE 98 N -4.36 1.50 0.00 7.19 -5.35 -1.26 -4.69 119.36 112.39 2wss n ILE 98 Ca 0.01 -1.06 0.00 0.00 -0.27 0.00 0.00 62.75 61.43 2wss n ILE 98 Cb 0.19 0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.29 2wss n ILE 98 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wss n GLY 99 N 1.26 2.86 3.31 3.28 0.00 -0.95 -4.61 105.19 110.34 2wss n GLY 99 Ca 0.24 -0.20 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 2wss n GLY 99 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wss n GLU 100 N 0.00 0.00 -3.36 1.61 1.02 -1.26 -4.49 120.64 114.16 2wss n GLU 100 Ca 0.00 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.86 2wss n GLU 100 Cb 0.00 -0.99 -0.03 0.00 -0.02 0.00 0.00 31.44 30.41 2wss n GLU 100 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 2wss s PRO 101 N -0.99 3.59 -0.01 3.49 0.02 -1.26 -1.09 135.00 138.76 2wss s PRO 101 Ca 0.61 -0.08 0.01 0.00 0.02 0.00 0.00 61.00 61.56 2wss s PRO 101 Cb -0.80 -2.66 0.02 0.00 0.02 0.00 0.00 34.50 31.08 2wss s PRO 101 CO 0.58 0.21 0.88 0.44 -0.33 0.00 0.00 177.00 178.78 2wss n ILE 102 N -1.08 0.12 -0.38 2.83 -5.35 -0.24 -4.71 119.36 110.55 2wss n ILE 102 Ca -0.02 -0.14 0.07 0.00 -0.27 0.00 0.00 62.75 62.38 2wss n ILE 102 Cb 0.54 0.59 0.31 0.00 -1.74 0.00 0.00 39.64 39.34 2wss n ILE 102 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2wss n ASP 103 N -0.09 4.44 -2.53 7.28 5.75 -1.23 -4.93 116.55 125.25 2wss n ASP 103 Ca 0.01 -2.56 -0.10 0.00 -0.01 0.00 0.00 54.79 52.13 2wss n ASP 103 Cb 0.64 -0.59 -0.00 0.00 -1.03 0.00 0.00 41.12 40.13 2wss n ASP 103 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2wss n GLU 104 N 0.71 -2.51 -2.99 0.11 1.02 -1.26 -4.87 120.64 110.84 2wss n GLU 104 Ca 0.22 0.42 -0.32 0.00 -0.02 0.00 0.00 57.16 57.46 2wss n GLU 104 Cb 0.89 -5.00 -0.03 0.00 -0.02 0.00 0.00 31.44 27.28 2wss n GLU 104 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2wss n ARG 105 N -2.78 3.73 0.00 3.49 1.74 -1.26 -5.07 116.66 116.51 2wss n ARG 105 Ca -0.10 -4.74 0.00 0.00 -0.77 0.00 0.00 57.85 52.24 2wss n ARG 105 Cb 0.57 -2.33 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 2wss n ARG 105 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wss n GLY 106 N 0.24 0.95 3.99 -0.13 0.00 -1.26 -4.81 105.19 104.17 2wss n GLY 106 Ca 0.34 -0.78 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 2wss n GLY 106 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wss s PRO 107 N 0.00 2.36 -0.84 1.61 0.05 -1.26 -4.78 135.00 132.13 2wss s PRO 107 Ca 0.00 -1.04 -0.04 0.00 0.05 0.00 0.00 61.00 59.97 2wss s PRO 107 Cb 0.00 -2.52 0.21 0.00 0.05 0.00 0.00 34.50 32.25 2wss s PRO 107 CO 0.00 -0.83 0.72 0.42 0.05 0.00 0.00 177.00 177.36 2wss s ILE 108 N -2.77 4.46 -0.06 0.56 1.01 -1.26 -5.03 121.20 118.11 2wss s ILE 108 Ca 0.60 -3.47 -0.30 0.00 0.00 0.00 0.00 60.65 57.48 2wss s ILE 108 Cb -0.09 -3.79 -0.06 0.00 0.01 0.00 0.00 42.46 38.54 2wss s ILE 108 CO 0.39 -1.04 1.78 -0.54 0.00 0.00 0.00 174.94 175.53 2wss s LYS 109 N -0.87 4.04 -0.03 2.79 1.02 -1.26 -4.95 119.74 120.47 2wss s LYS 109 Ca 0.24 2.23 -0.09 0.00 0.02 0.00 0.00 55.97 58.38 2wss s LYS 109 Cb -0.11 -4.07 0.01 0.00 -0.52 0.00 0.00 37.83 33.14 2wss s LYS 109 CO -0.09 -1.03 0.20 -0.08 -0.92 0.00 0.00 175.35 173.43 2wss s THR 110 N 4.62 0.05 0.00 2.17 -1.32 -1.26 -4.79 115.64 115.11 2wss s THR 110 Ca 0.80 -0.40 0.00 0.00 -1.21 0.00 0.00 61.69 60.88 2wss s THR 110 Cb -0.35 -0.43 0.00 0.00 -1.51 0.00 0.00 72.50 70.21 2wss s THR 110 CO 0.33 -0.22 0.98 0.29 -2.21 0.00 0.00 174.62 173.80 2wss n LYS 111 N 1.96 0.00 -3.11 7.08 5.02 -1.26 -4.89 118.16 122.96 2wss n LYS 111 Ca -0.19 0.61 -0.19 0.00 -2.02 0.00 0.00 58.31 56.52 2wss n LYS 111 Cb 0.57 -1.48 0.04 0.00 -0.02 0.00 0.00 35.03 34.13 2wss n LYS 111 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2wss s GLN 112 N -2.94 2.43 0.16 1.97 1.11 -1.26 -5.09 119.66 116.05 2wss s GLN 112 Ca 0.00 -1.57 0.02 0.00 0.01 0.00 0.00 55.36 53.82 2wss s GLN 112 Cb 0.00 -2.63 -0.05 0.00 -1.01 0.00 0.00 33.01 29.33 2wss s GLN 112 CO 0.00 -0.69 -0.01 -0.06 0.01 0.00 0.00 175.29 174.54 2wss s PHE 113 N -2.60 1.18 0.11 0.91 2.99 -1.26 -3.68 117.98 115.63 2wss s PHE 113 Ca 0.58 -0.99 0.01 0.00 0.00 0.00 0.00 56.93 56.53 2wss s PHE 113 Cb -0.06 -0.67 -0.04 0.00 0.00 0.00 0.00 43.02 42.24 2wss s PHE 113 CO 0.36 -0.19 -0.03 0.00 -0.00 0.00 0.00 175.22 175.36 2wss s ALA 114 N -3.63 0.95 0.25 5.36 0.00 -0.85 -4.90 121.76 118.93 2wss s ALA 114 Ca 0.22 -1.39 -0.02 0.00 0.00 0.00 0.00 51.96 50.78 2wss s ALA 114 Cb 0.06 0.34 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 2wss s ALA 114 CO 0.03 -0.31 0.47 0.00 0.00 0.00 0.00 175.76 175.95 2wss s ALA 115 N -3.74 3.74 0.17 0.00 0.00 -1.26 -0.64 121.76 120.04 2wss s ALA 115 Ca 0.15 -0.74 -0.03 0.00 0.00 0.00 0.00 51.96 51.33 2wss s ALA 115 Cb 0.06 -2.11 0.06 0.00 0.00 0.00 0.00 23.12 21.12 2wss s ALA 115 CO -0.03 0.31 1.44 -0.84 0.00 0.00 0.00 175.76 176.65 2wss h ILE 116 N 1.39 1.35 -3.81 0.00 3.07 -1.70 -3.44 117.51 114.36 2wss h ILE 116 Ca -0.48 -2.01 -0.50 0.00 1.55 0.00 0.00 64.86 63.43 2wss h ILE 116 Cb 1.19 1.98 0.04 0.00 -0.27 0.00 0.00 36.82 39.77 2wss h ILE 116 CO 0.66 0.61 0.20 -1.00 -1.05 0.00 0.00 178.15 177.58 2wss s HIS 117 N -3.76 3.58 0.00 0.16 3.76 -1.26 -4.69 115.29 113.08 2wss s HIS 117 Ca -0.07 0.97 0.00 0.00 -0.15 0.00 0.00 55.06 55.82 2wss s HIS 117 Cb 0.11 -2.44 0.00 0.00 1.11 0.00 0.00 32.58 31.36 2wss s HIS 117 CO 0.85 -0.39 0.00 0.00 -0.85 0.00 0.00 174.74 174.35 2wss n ALA 118 N -2.33 0.00 -0.88 -1.40 0.00 -1.26 -5.12 120.51 109.52 2wss n ALA 118 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 2wss n ALA 118 Cb 0.55 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.17 2wss n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2wss s GLU 119 N -0.91 0.72 -0.04 0.00 0.41 -1.26 -4.99 118.70 112.64 2wss s GLU 119 Ca 0.00 1.09 -0.01 0.00 -0.41 0.00 0.00 54.97 55.64 2wss s GLU 119 Cb 0.00 -1.73 -0.04 0.00 -1.78 0.00 0.00 34.13 30.59 2wss s GLU 119 CO 0.00 -2.69 0.04 0.00 -0.49 0.00 0.00 175.26 172.12 2wss s ALA 120 N -2.72 3.43 -0.43 5.21 0.00 -1.26 -4.98 121.76 121.01 2wss s ALA 120 Ca 0.65 -0.85 -0.16 0.00 0.00 0.00 0.00 51.96 51.60 2wss s ALA 120 Cb -0.21 -1.52 -0.10 0.00 0.00 0.00 0.00 23.12 21.29 2wss s ALA 120 CO 0.59 0.64 1.23 -2.30 0.00 0.00 0.00 175.76 175.92 2wss n PRO 121 N 1.61 0.00 -0.78 0.00 -0.02 -1.26 -4.92 135.00 129.62 2wss n PRO 121 Ca -0.16 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 60.99 2wss n PRO 121 Cb 0.53 -0.71 0.13 0.00 -0.02 0.00 0.00 33.50 33.43 2wss n PRO 121 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wss n GLU 122 N 3.93 -0.58 0.13 -0.52 -0.58 -1.26 -4.79 120.64 116.97 2wss n GLU 122 Ca 0.30 -0.14 0.03 0.00 -0.42 0.00 0.00 57.16 56.93 2wss n GLU 122 Cb 0.01 -1.74 0.40 0.00 -0.57 0.00 0.00 31.44 29.54 2wss n GLU 122 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 2wss h PHE 123 N -1.63 0.22 0.00 -0.32 3.57 -2.00 -1.05 116.94 115.73 2wss h PHE 123 Ca -0.46 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 60.98 2wss h PHE 123 Cb 1.30 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.98 2wss h PHE 123 CO 0.31 0.34 -0.16 -0.39 -2.23 0.00 0.00 178.31 176.18 2wss h VAL 124 N 0.20 0.83 0.00 1.41 -1.51 -2.02 -2.82 116.25 112.33 2wss h VAL 124 Ca 0.04 -0.62 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 2wss h VAL 124 Cb 0.36 1.37 0.00 0.00 -2.13 0.00 0.00 31.29 30.89 2wss h VAL 124 CO 0.02 0.16 -0.13 -0.62 -1.23 0.00 0.00 177.57 175.77 2wss n GLU 125 N -3.93 0.15 -1.20 5.19 1.02 -0.40 -4.89 120.64 116.58 2wss n GLU 125 Ca -0.02 0.10 -0.33 0.00 -0.02 0.00 0.00 57.16 56.89 2wss n GLU 125 Cb 0.25 -1.65 0.12 0.00 -0.02 0.00 0.00 31.44 30.14 2wss n GLU 125 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2wss s MET 126 N -3.06 1.81 -0.02 3.49 -1.94 -1.07 -1.36 119.30 117.14 2wss s MET 126 Ca 0.11 1.65 0.02 0.00 -1.71 0.00 0.00 55.69 55.76 2wss s MET 126 Cb 0.15 -1.81 0.00 0.00 2.01 0.00 0.00 34.83 35.19 2wss s MET 126 CO 0.60 -2.06 -0.07 0.45 -0.01 0.00 0.00 175.02 173.92 2wss s SER 127 N -2.34 1.03 -0.33 3.03 0.15 -1.26 -4.62 113.70 109.36 2wss s SER 127 Ca 0.71 -0.16 0.09 0.00 0.70 0.00 0.00 55.95 57.29 2wss s SER 127 Cb -0.26 -0.28 0.71 0.00 -1.71 0.00 0.00 66.02 64.48 2wss s SER 127 CO 0.50 0.05 1.79 1.33 1.20 0.00 0.00 173.24 178.10 2wss n VAL 128 N 3.34 2.88 -2.07 4.45 0.24 -1.26 -4.93 118.33 120.98 2wss n VAL 128 Ca -0.18 -1.59 -0.39 0.00 -2.04 0.00 0.00 64.34 60.14 2wss n VAL 128 Cb 0.54 -0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 32.49 2wss n VAL 128 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2wss s GLU 129 N -2.92 2.72 -0.44 7.34 0.41 -1.26 -4.94 118.70 119.61 2wss s GLU 129 Ca 0.53 0.63 -0.06 0.00 -0.41 0.00 0.00 54.97 55.66 2wss s GLU 129 Cb 0.43 -4.36 0.11 0.00 -1.78 0.00 0.00 34.13 28.53 2wss s GLU 129 CO 0.13 -2.63 0.27 -0.65 -0.49 0.00 0.00 175.26 171.89 2wss s GLN 130 N 6.85 2.29 -0.05 1.61 -0.21 -1.26 -4.93 119.66 123.96 2wss s GLN 130 Ca 0.67 -1.75 0.06 0.00 0.02 0.00 0.00 55.36 54.35 2wss s GLN 130 Cb -0.13 -3.76 -0.01 0.00 1.00 0.00 0.00 33.01 30.11 2wss s GLN 130 CO 0.22 -1.11 -0.23 -2.00 -2.12 0.00 0.00 175.29 170.05 2wss s GLU 131 N 1.27 2.32 0.33 2.91 2.12 -1.26 -5.05 118.70 121.34 2wss s GLU 131 Ca 0.06 -0.82 -0.29 0.00 0.36 0.00 0.00 54.97 54.28 2wss s GLU 131 Cb -0.24 -1.99 -0.11 0.00 0.26 0.00 0.00 34.13 32.05 2wss s GLU 131 CO -0.02 0.35 1.47 -1.50 -0.54 0.00 0.00 175.26 175.01 2wss s ILE 132 N -0.12 2.28 -0.38 -3.70 2.07 -1.26 -0.64 121.20 119.45 2wss s ILE 132 Ca -0.03 0.27 -0.03 0.00 -1.41 0.00 0.00 60.65 59.45 2wss s ILE 132 Cb -0.13 -3.17 0.09 0.00 0.13 0.00 0.00 42.46 39.38 2wss s ILE 132 CO 0.03 0.06 0.16 -0.22 -1.91 0.00 0.00 174.94 173.05 2wss s LEU 133 N -1.43 4.93 0.16 8.50 2.96 0.11 -4.58 118.68 129.33 2wss s LEU 133 Ca 0.55 -1.83 -0.30 0.00 -0.22 0.00 0.00 54.13 52.33 2wss s LEU 133 Cb -0.45 -1.80 -0.08 0.00 0.50 0.00 0.00 46.19 44.36 2wss s LEU 133 CO 0.55 -0.47 1.17 -0.69 -1.32 0.00 0.00 176.35 175.58 2wss s VAL 134 N 1.17 3.73 -0.09 1.68 1.01 -1.26 -4.02 120.40 122.62 2wss s VAL 134 Ca 0.05 1.43 0.17 0.00 0.00 0.00 0.00 61.98 63.64 2wss s VAL 134 Cb -0.22 -3.91 -0.26 0.00 0.00 0.00 0.00 36.38 31.99 2wss s VAL 134 CO -0.03 0.22 0.26 0.35 0.00 0.00 0.00 175.10 175.89 2wss n THR 135 N 2.67 0.53 -1.02 3.92 -2.24 -1.26 -4.98 114.28 111.90 2wss n THR 135 Ca 0.04 -0.57 -0.01 0.00 -2.27 0.00 0.00 64.05 61.25 2wss n THR 135 Cb 0.45 -0.20 -0.00 0.00 -2.10 0.00 0.00 70.33 68.48 2wss n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wss n GLY 136 N 1.65 0.48 3.44 3.38 0.00 -1.26 -4.87 105.19 108.01 2wss n GLY 136 Ca -0.14 -0.45 -0.38 0.00 0.00 0.00 0.00 46.02 45.04 2wss n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wss s ILE 137 N -1.99 4.60 0.16 -0.61 1.01 -1.26 -2.50 121.20 120.62 2wss s ILE 137 Ca 0.00 -0.41 -0.23 0.00 0.00 0.00 0.00 60.65 60.01 2wss s ILE 137 Cb 0.00 -3.34 0.05 0.00 0.01 0.00 0.00 42.46 39.18 2wss s ILE 137 CO 0.00 0.08 1.60 0.11 0.00 0.00 0.00 174.94 176.72 2wss h LYS 138 N 8.35 -0.26 -0.30 2.79 1.57 -1.85 -1.63 116.57 125.24 2wss h LYS 138 Ca -0.32 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.50 2wss h LYS 138 Cb 1.15 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 2wss h LYS 138 CO 0.61 -0.17 0.12 -0.39 -0.57 0.00 0.00 179.45 179.05 2wss h VAL 139 N -0.27 0.95 0.54 0.50 -1.51 -1.94 0.39 116.25 114.91 2wss h VAL 139 Ca 0.17 -0.09 -0.03 0.00 -1.23 0.00 0.00 66.70 65.52 2wss h VAL 139 Cb 0.54 0.66 0.01 0.00 -2.13 0.00 0.00 31.29 30.37 2wss h VAL 139 CO -0.53 0.05 -0.26 0.58 -1.23 0.00 0.00 177.57 176.17 2wss h VAL 140 N 0.27 0.46 0.85 7.19 2.07 -1.73 -1.39 116.25 123.97 2wss h VAL 140 Ca 0.13 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.58 2wss h VAL 140 Cb 0.08 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2wss h VAL 140 CO -0.12 0.00 -0.48 0.44 0.02 0.00 0.00 177.57 177.44 2wss h ASP 141 N -0.75 -1.19 -0.88 0.57 3.32 -1.25 -0.80 116.42 115.45 2wss h ASP 141 Ca -0.07 0.06 0.05 0.00 0.02 0.00 0.00 57.03 57.08 2wss h ASP 141 Cb 0.57 0.33 -0.05 0.00 0.22 0.00 0.00 39.33 40.40 2wss h ASP 141 CO 0.12 -0.76 0.58 0.25 -1.72 0.00 0.00 179.24 177.71 2wss h LEU 142 N -1.23 0.93 0.00 1.55 5.85 -0.97 -3.35 115.31 118.09 2wss h LEU 142 Ca -0.12 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.46 2wss h LEU 142 Cb 0.97 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 2wss h LEU 142 CO 0.14 0.62 -1.64 0.18 -0.34 0.00 0.00 178.44 177.41 2wss n LEU 143 N -4.46 0.00 -2.83 2.25 4.77 -0.52 -4.51 117.00 111.70 2wss n LEU 143 Ca 0.12 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.01 2wss n LEU 143 Cb 0.14 0.19 0.01 0.00 -2.33 0.00 0.00 43.42 41.43 2wss n LEU 143 CO 0.34 0.19 0.09 0.00 -1.33 0.00 0.00 177.39 176.68 2wss n ALA 144 N -2.26 -1.04 -1.78 -1.18 0.00 -0.35 -4.63 120.51 109.27 2wss n ALA 144 Ca -0.13 -1.50 -0.36 0.00 0.00 0.00 0.00 53.44 51.44 2wss n ALA 144 Cb 0.70 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.81 2wss n ALA 144 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2wss s PRO 145 N 0.59 3.75 0.59 0.00 0.02 -0.91 -4.61 135.00 134.44 2wss s PRO 145 Ca 0.31 1.67 -0.17 0.00 0.02 0.00 0.00 61.00 62.83 2wss s PRO 145 Cb 0.11 -2.33 -0.04 0.00 0.02 0.00 0.00 34.50 32.26 2wss s PRO 145 CO -0.15 -0.53 1.09 0.71 -0.33 0.00 0.00 177.00 177.79 2wss s TYR 146 N -1.64 2.77 -0.13 6.54 4.12 -1.26 -4.81 117.35 122.95 2wss s TYR 146 Ca 0.65 1.54 0.02 0.00 0.02 0.00 0.00 57.07 59.30 2wss s TYR 146 Cb -0.26 -3.15 -0.00 0.00 -1.52 0.00 0.00 41.96 37.03 2wss s TYR 146 CO 0.31 -1.40 -0.19 0.00 0.02 0.00 0.00 175.55 174.29 2wss s ALA 147 N -2.15 2.38 0.06 3.71 0.00 -1.26 -0.71 121.76 123.79 2wss s ALA 147 Ca 0.68 -0.99 -0.37 0.00 0.00 0.00 0.00 51.96 51.27 2wss s ALA 147 Cb -0.20 -1.05 -0.17 0.00 0.00 0.00 0.00 23.12 21.70 2wss s ALA 147 CO 0.33 0.14 1.29 1.63 0.00 0.00 0.00 175.76 179.15 2wss n LYS 148 N 3.76 0.91 -1.17 0.00 5.02 0.18 0.10 118.16 126.97 2wss n LYS 148 Ca -0.19 0.33 -0.06 0.00 -2.02 0.00 0.00 58.31 56.37 2wss n LYS 148 Cb 0.52 -1.94 -0.02 0.00 -0.02 0.00 0.00 35.03 33.57 2wss n LYS 148 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wss n GLY 149 N 2.35 0.68 3.93 0.72 0.00 -1.26 -4.64 105.19 106.96 2wss n GLY 149 Ca 0.19 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2wss n GLY 149 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wss s GLY 150 N -2.33 1.61 -0.08 -0.02 0.00 0.12 -4.19 107.32 102.43 2wss s GLY 150 Ca 0.00 -0.85 -0.20 0.00 0.00 0.00 0.00 44.72 43.67 2wss s GLY 150 CO 0.00 -0.60 0.58 0.54 0.00 0.00 0.00 173.10 173.62 2wss s LYS 151 N -4.86 4.37 0.00 2.90 1.02 -1.26 -1.00 119.74 120.91 2wss s LYS 151 Ca 0.53 0.66 0.07 0.00 0.02 0.00 0.00 55.97 57.25 2wss s LYS 151 Cb -0.10 -3.42 -0.02 0.00 -0.52 0.00 0.00 37.83 33.77 2wss s LYS 151 CO 0.43 0.17 -0.23 0.42 -0.92 0.00 0.00 175.35 175.22 2wss s ILE 152 N 0.51 1.81 -0.04 2.17 1.01 0.50 -1.35 121.20 125.82 2wss s ILE 152 Ca 0.31 -1.08 0.03 0.00 0.00 0.00 0.00 60.65 59.91 2wss s ILE 152 Cb -0.17 -1.53 0.00 0.00 0.01 0.00 0.00 42.46 40.78 2wss s ILE 152 CO 0.14 0.42 -0.13 -0.83 0.00 0.00 0.00 174.94 174.55 2wss s GLY 153 N -0.77 0.74 -0.36 6.18 0.00 -0.82 -0.75 107.32 111.54 2wss s GLY 153 Ca 0.09 -0.50 -0.02 0.00 0.00 0.00 0.00 44.72 44.29 2wss s GLY 153 CO 0.00 -0.17 0.11 1.08 0.00 0.00 0.00 173.10 174.12 2wss s LEU 154 N 0.20 4.70 -0.10 0.66 1.43 0.44 -0.18 118.68 125.83 2wss s LEU 154 Ca -0.05 -1.75 -0.16 0.00 -1.03 0.00 0.00 54.13 51.14 2wss s LEU 154 Cb -0.11 -1.77 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 2wss s LEU 154 CO 0.02 -0.42 0.39 -0.36 0.23 0.00 0.00 176.35 176.20 2wss s PHE 155 N 1.16 3.55 -0.15 0.29 0.40 0.11 0.57 117.98 123.92 2wss s PHE 155 Ca 0.03 0.80 -0.28 0.00 -0.60 0.00 0.00 56.93 56.88 2wss s PHE 155 Cb -0.21 -2.40 0.08 0.00 0.51 0.00 0.00 43.02 41.00 2wss s PHE 155 CO -0.03 0.33 0.76 0.20 0.70 0.00 0.00 175.22 177.17 2wss s GLY 156 N 0.10 -0.49 0.83 4.36 0.00 -0.66 -0.29 107.32 111.17 2wss s GLY 156 Ca 0.22 1.75 -0.11 0.00 0.00 0.00 0.00 44.72 46.58 2wss s GLY 156 CO 0.09 1.29 1.17 -0.32 0.00 0.00 0.00 173.10 175.33 2wss s GLY 157 N -0.56 1.69 -0.17 0.20 0.00 -1.26 -1.19 107.32 106.02 2wss s GLY 157 Ca -0.05 -0.99 -0.34 0.00 0.00 0.00 0.00 44.72 43.33 2wss s GLY 157 CO 0.05 -0.42 1.96 0.00 0.00 0.00 0.00 173.10 174.69 2wss n ALA 158 N -3.34 0.89 -0.51 3.20 0.00 -1.26 -2.72 120.51 116.77 2wss n ALA 158 Ca 0.11 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.73 2wss n ALA 158 Cb 0.60 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.53 2wss n ALA 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wss n GLY 159 N 4.93 0.71 0.30 0.00 0.00 -1.26 -4.95 105.19 104.92 2wss n GLY 159 Ca 0.27 -0.36 0.11 0.00 0.00 0.00 0.00 46.02 46.04 2wss n GLY 159 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wss n VAL 160 N -2.51 0.00 0.00 1.61 0.24 -1.10 -4.95 118.33 111.62 2wss n VAL 160 Ca 0.00 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 2wss n VAL 160 Cb 0.00 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.53 2wss n VAL 160 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wss n GLY 161 N 1.45 1.43 0.34 7.63 0.00 -1.26 -4.43 105.19 110.35 2wss n GLY 161 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 2wss n GLY 161 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wss h LYS 162 N 0.00 -0.83 -0.73 1.61 1.57 -1.92 -2.62 116.57 113.65 2wss h LYS 162 Ca 0.00 0.06 0.14 0.00 -1.87 0.00 0.00 60.65 58.98 2wss h LYS 162 Cb 0.00 0.19 -0.10 0.00 0.08 0.00 0.00 32.23 32.40 2wss h LYS 162 CO 0.00 -0.55 0.26 1.15 -0.57 0.00 0.00 179.45 179.74 2wss h THR 163 N -0.90 0.64 -0.57 -0.16 2.02 -1.98 0.35 112.91 112.31 2wss h THR 163 Ca -0.09 -0.13 0.07 0.00 0.77 0.00 0.00 66.41 67.02 2wss h THR 163 Cb 0.66 0.21 -0.06 0.00 -1.74 0.00 0.00 68.15 67.22 2wss h THR 163 CO 0.14 0.07 0.26 0.58 0.37 0.00 0.00 175.52 176.95 2wss h VAL 164 N 0.39 0.88 -0.57 3.16 2.07 -1.98 -1.37 116.25 118.83 2wss h VAL 164 Ca 0.40 -0.17 -0.09 0.00 0.82 0.00 0.00 66.70 67.66 2wss h VAL 164 Cb 0.62 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2wss h VAL 164 CO -0.42 0.09 -0.00 0.25 0.02 0.00 0.00 177.57 177.51 2wss h LEU 165 N 0.49 0.95 -0.89 2.57 5.85 -0.03 0.05 115.31 124.31 2wss h LEU 165 Ca 0.27 -0.26 -0.09 0.00 0.84 0.00 0.00 57.88 58.64 2wss h LEU 165 Cb 0.24 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2wss h LEU 165 CO -0.22 1.01 -0.10 -0.29 -0.34 0.00 0.00 178.44 178.50 2wss h ILE 166 N 0.90 1.25 -0.11 4.05 2.10 -0.48 -1.74 117.51 123.47 2wss h ILE 166 Ca 0.16 -1.12 -0.01 0.00 1.08 0.00 0.00 64.86 64.98 2wss h ILE 166 Cb 0.53 1.04 -0.00 0.00 -1.09 0.00 0.00 36.82 37.30 2wss h ILE 166 CO 0.03 0.38 0.03 0.24 -1.08 0.00 0.00 178.15 177.74 2wss h MET 167 N 0.65 0.18 -0.63 2.19 2.86 -0.61 0.24 114.93 119.82 2wss h MET 167 Ca 0.12 -0.04 0.05 0.00 -2.06 0.00 0.00 59.70 57.76 2wss h MET 167 Cb 0.55 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 2wss h MET 167 CO 0.03 0.36 0.41 1.49 1.06 0.00 0.00 176.91 180.26 2wss h GLU 168 N -0.02 0.65 -0.09 1.72 4.57 -0.87 -0.05 114.58 120.49 2wss h GLU 168 Ca 0.04 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2wss h GLU 168 Cb 0.25 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.70 2wss h GLU 168 CO 0.00 0.43 -0.06 -0.07 -1.18 0.00 0.00 179.01 178.13 2wss h LEU 169 N 0.67 0.20 -1.87 1.64 3.38 -0.93 0.13 115.31 118.53 2wss h LEU 169 Ca 0.26 -0.44 0.24 0.00 0.09 0.00 0.00 57.88 58.03 2wss h LEU 169 Cb 0.19 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2wss h LEU 169 CO -0.08 0.60 0.62 0.40 0.09 0.00 0.00 178.44 180.07 2wss h ILE 170 N -0.19 0.59 0.00 1.22 2.04 -0.30 -0.44 117.51 120.43 2wss h ILE 170 Ca 0.02 -0.04 -0.10 0.00 1.00 0.00 0.00 64.86 65.74 2wss h ILE 170 Cb 0.53 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2wss h ILE 170 CO 0.02 0.02 -0.57 -1.13 0.00 0.00 0.00 178.15 176.48 2wss h ASN 171 N 0.10 0.00 0.00 1.72 -1.24 -0.53 -1.95 115.58 113.68 2wss h ASN 171 Ca 0.43 -0.71 0.00 0.00 0.71 0.00 0.00 56.30 56.73 2wss h ASN 171 Cb 1.55 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.60 2wss h ASN 171 CO -0.05 1.19 0.00 0.59 -1.29 0.00 0.00 177.43 177.86 2wss n ASN 172 N -4.54 0.00 0.05 1.15 3.02 0.42 -3.92 115.26 111.43 2wss n ASN 172 Ca -0.19 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 2wss n ASN 172 Cb 0.54 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 2wss n ASN 172 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2wss n VAL 173 N -1.00 0.37 1.62 2.41 0.31 -0.19 -4.90 118.33 116.95 2wss n VAL 173 Ca 0.16 0.12 0.05 0.00 -0.01 0.00 0.00 64.34 64.66 2wss n VAL 173 Cb 0.07 -0.88 0.22 0.00 -0.91 0.00 0.00 33.84 32.34 2wss n VAL 173 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wss n ALA 174 N -3.00 2.51 -0.10 3.52 0.00 -0.74 -3.61 120.51 119.09 2wss n ALA 174 Ca 0.00 -0.25 -0.20 0.00 0.00 0.00 0.00 53.44 52.99 2wss n ALA 174 Cb 0.00 -1.07 -0.11 0.00 0.00 0.00 0.00 19.45 18.26 2wss n ALA 174 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2wss h LYS 175 N 0.81 0.00 -2.98 0.00 6.56 -1.68 -3.39 116.57 115.90 2wss h LYS 175 Ca 0.00 0.00 -0.81 0.00 -1.06 0.00 0.00 60.65 58.78 2wss h LYS 175 Cb 0.18 0.00 -0.28 0.00 -0.57 0.00 0.00 32.23 31.57 2wss h LYS 175 CO 0.00 0.95 0.80 0.00 -2.06 0.00 0.00 179.45 179.14 2wss n ALA 176 N -3.32 5.13 -3.47 3.86 0.00 -1.24 -4.93 120.51 116.54 2wss n ALA 176 Ca -0.28 -4.79 -0.20 0.00 0.00 0.00 0.00 53.44 48.18 2wss n ALA 176 Cb 0.63 -2.38 -0.12 0.00 0.00 0.00 0.00 19.45 17.59 2wss n ALA 176 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2wss s HIS 177 N -2.61 -0.23 -0.65 0.00 5.04 -1.26 -4.99 115.29 110.59 2wss s HIS 177 Ca 0.31 -0.11 -0.26 0.00 -1.54 0.00 0.00 55.06 53.46 2wss s HIS 177 Cb 0.04 -0.49 -0.03 0.00 0.04 0.00 0.00 32.58 32.14 2wss s HIS 177 CO 0.09 -0.75 1.92 0.20 -2.34 0.00 0.00 174.74 173.87 2wss s GLY 178 N 2.30 0.14 0.00 1.59 0.00 -1.26 -4.80 107.32 105.28 2wss s GLY 178 Ca 0.08 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 44.06 2wss s GLY 178 CO -0.23 3.49 0.00 0.61 0.00 0.00 0.00 173.10 176.97 2wss n GLY 179 N 5.91 3.49 3.77 0.20 0.00 -1.26 -4.87 105.19 112.43 2wss n GLY 179 Ca 0.25 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.86 2wss n GLY 179 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wss s TYR 180 N -2.00 3.48 -0.04 1.61 1.51 -1.15 -4.93 117.35 115.84 2wss s TYR 180 Ca 0.00 1.70 0.04 0.00 -1.01 0.00 0.00 57.07 57.80 2wss s TYR 180 Cb 0.00 -3.18 -0.00 0.00 -0.11 0.00 0.00 41.96 38.66 2wss s TYR 180 CO 0.00 -0.48 -0.15 -1.12 -1.11 0.00 0.00 175.55 172.68 2wss s SER 181 N -1.21 1.94 -0.09 2.29 0.01 -0.33 -1.04 113.70 115.27 2wss s SER 181 Ca 0.50 -0.31 0.02 0.00 1.31 0.00 0.00 55.95 57.47 2wss s SER 181 Cb -0.27 -0.50 -0.02 0.00 0.21 0.00 0.00 66.02 65.45 2wss s SER 181 CO 0.34 0.14 -0.16 -0.69 0.41 0.00 0.00 173.24 173.28 2wss s VAL 182 N 0.02 2.81 -0.28 3.43 1.01 0.33 -1.14 120.40 126.59 2wss s VAL 182 Ca -0.02 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.20 2wss s VAL 182 Cb -0.10 -2.13 0.06 0.00 0.00 0.00 0.00 36.38 34.21 2wss s VAL 182 CO 0.01 0.55 -0.07 0.12 0.00 0.00 0.00 175.10 175.72 2wss s PHE 183 N -0.06 3.28 -0.44 5.22 5.36 -0.11 -0.81 117.98 130.42 2wss s PHE 183 Ca -0.04 -2.20 -0.16 0.00 -0.96 0.00 0.00 56.93 53.57 2wss s PHE 183 Cb -0.14 -2.01 0.03 0.00 -0.34 0.00 0.00 43.02 40.56 2wss s PHE 183 CO 0.04 -0.86 0.41 0.00 -1.46 0.00 0.00 175.22 173.35 2wss s ALA 184 N 1.15 3.46 -0.74 11.12 0.00 0.22 -1.54 121.76 135.43 2wss s ALA 184 Ca -0.07 -1.72 -0.25 0.00 0.00 0.00 0.00 51.96 49.92 2wss s ALA 184 Cb -0.20 -3.04 0.05 0.00 0.00 0.00 0.00 23.12 19.93 2wss s ALA 184 CO -0.04 -1.62 1.19 0.20 0.00 0.00 0.00 175.76 175.50 2wss s GLY 185 N 2.01 1.07 -0.25 0.00 0.00 -0.38 -1.98 107.32 107.79 2wss s GLY 185 Ca 0.09 -1.59 -0.14 0.00 0.00 0.00 0.00 44.72 43.08 2wss s GLY 185 CO 0.11 2.47 0.31 0.14 0.00 0.00 0.00 173.10 176.13 2wss s VAL 186 N 5.14 5.23 -0.79 1.40 1.01 -0.85 -1.20 120.40 130.34 2wss s VAL 186 Ca 0.32 0.47 -0.04 0.00 0.00 0.00 0.00 61.98 62.72 2wss s VAL 186 Cb -0.10 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.68 2wss s VAL 186 CO 0.12 0.23 0.10 0.61 0.00 0.00 0.00 175.10 176.15 2wss n GLY 187 N 4.51 -0.10 0.00 4.51 0.00 0.16 -0.53 105.19 113.74 2wss n GLY 187 Ca -0.10 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2wss n GLY 187 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wss n GLU 188 N -2.54 3.59 -2.82 1.61 -0.58 -1.26 -3.85 120.64 114.78 2wss n GLU 188 Ca -0.09 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.24 2wss n GLU 188 Cb 0.29 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.13 2wss n GLU 188 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2wss s ARG 189 N 3.75 4.45 0.19 3.49 0.52 -1.26 -0.75 118.95 129.35 2wss s ARG 189 Ca 0.00 1.21 -0.09 0.00 -0.52 0.00 0.00 55.73 56.32 2wss s ARG 189 Cb 0.00 -3.49 0.11 0.00 0.52 0.00 0.00 34.95 32.09 2wss s ARG 189 CO 0.00 -0.13 1.73 1.15 0.02 0.00 0.00 175.30 178.08 2wss h THR 190 N 4.92 1.25 0.00 0.02 2.02 -1.98 -0.61 112.91 118.54 2wss h THR 190 Ca -0.37 -0.86 0.00 0.00 0.77 0.00 0.00 66.41 65.96 2wss h THR 190 Cb 1.18 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2wss h THR 190 CO 0.79 0.33 0.03 0.08 0.37 0.00 0.00 175.52 177.12 2wss h ARG 191 N 1.01 0.00 0.00 6.66 0.11 -2.00 0.13 114.38 120.29 2wss h ARG 191 Ca 0.23 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.31 2wss h ARG 191 Cb 0.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.36 2wss h ARG 191 CO -0.01 0.00 -0.07 0.39 0.10 0.00 0.00 179.97 180.38 2wss n GLU 192 N -2.40 0.25 -0.08 0.08 1.02 -0.24 -2.10 120.64 117.16 2wss n GLU 192 Ca -0.02 0.19 -0.09 0.00 -0.02 0.00 0.00 57.16 57.22 2wss n GLU 192 Cb 0.06 -1.77 -0.04 0.00 -0.02 0.00 0.00 31.44 29.67 2wss n GLU 192 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2wss h GLY 193 N 4.56 0.00 -0.90 0.62 0.00 -0.77 -2.02 103.07 104.56 2wss h GLY 193 Ca 0.00 0.00 0.33 0.00 0.00 0.00 0.00 47.33 47.66 2wss h GLY 193 CO 0.00 0.00 0.30 -0.57 0.00 0.00 0.00 176.54 176.27 2wss h ASN 194 N -1.00 -0.03 -0.54 0.19 -1.24 -1.58 0.35 115.58 111.74 2wss h ASN 194 Ca -0.10 0.26 -0.08 0.00 0.71 0.00 0.00 56.30 57.09 2wss h ASN 194 Cb 0.70 0.35 -0.02 0.00 0.73 0.00 0.00 38.32 40.08 2wss h ASN 194 CO -0.06 -0.36 0.02 0.44 -1.29 0.00 0.00 177.43 176.18 2wss h ASP 195 N 0.05 0.92 0.45 1.15 5.19 -1.47 -2.58 116.42 120.14 2wss h ASP 195 Ca 0.71 -0.30 -0.02 0.00 -0.62 0.00 0.00 57.03 56.80 2wss h ASP 195 Cb 1.68 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.95 2wss h ASP 195 CO -0.81 0.99 -0.22 0.25 -3.12 0.00 0.00 179.24 176.33 2wss h LEU 196 N 0.82 -0.52 0.00 1.55 5.85 0.35 -1.92 115.31 121.44 2wss h LEU 196 Ca 0.16 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2wss h LEU 196 Cb 0.51 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.67 2wss h LEU 196 CO 0.02 -0.15 0.00 0.00 -0.34 0.00 0.00 178.44 177.97 2wss n TYR 197 N -5.23 0.00 -0.22 1.25 9.36 0.25 -0.69 117.16 121.88 2wss n TYR 197 Ca -0.10 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.14 2wss n TYR 197 Cb 0.30 -0.43 0.13 0.00 -0.63 0.00 0.00 39.34 38.71 2wss n TYR 197 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2wss h HIS 198 N 0.00 0.01 0.00 2.98 3.86 -1.55 -0.62 115.15 119.84 2wss h HIS 198 Ca 0.00 0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 2wss h HIS 198 Cb 0.00 0.10 -0.00 0.00 1.06 0.00 0.00 27.41 28.57 2wss h HIS 198 CO -0.81 -0.17 -0.02 1.49 0.86 0.00 0.00 177.93 179.29 2wss h GLU 199 N 0.14 0.00 -0.00 2.45 4.81 -0.13 -1.37 114.58 120.48 2wss h GLU 199 Ca 0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.59 2wss h GLU 199 Cb 0.59 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.97 2wss h GLU 199 CO -0.55 0.02 -0.77 -1.33 -0.73 0.00 0.00 179.01 175.64 2wss n MET 200 N -3.76 0.28 -0.10 1.92 2.81 0.13 -2.79 117.12 115.61 2wss n MET 200 Ca -0.03 -0.22 -0.20 0.00 -1.81 0.00 0.00 57.70 55.45 2wss n MET 200 Cb 0.10 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.01 2wss n MET 200 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 2wss h ILE 201 N 0.53 0.87 -0.11 2.02 2.04 -0.52 0.18 117.51 122.53 2wss h ILE 201 Ca 0.00 -2.08 0.04 0.00 1.00 0.00 0.00 64.86 63.82 2wss h ILE 201 Cb 0.55 2.07 -0.06 0.00 -0.74 0.00 0.00 36.82 38.64 2wss h ILE 201 CO 0.00 0.30 -0.40 -0.33 0.00 0.00 0.00 178.15 177.71 2wss h GLU 202 N -1.00 -0.47 0.00 2.37 5.08 -1.45 -0.60 114.58 118.52 2wss h GLU 202 Ca -0.30 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 2wss h GLU 202 Cb 1.22 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.57 2wss h GLU 202 CO -0.18 -0.31 -0.03 0.66 -1.00 0.00 0.00 179.01 178.14 2wss h SER 203 N -0.49 0.00 -1.22 1.42 4.64 -1.69 -3.47 113.55 112.75 2wss h SER 203 Ca 0.08 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 2wss h SER 203 Cb 0.62 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.72 2wss h SER 203 CO -0.38 0.03 -0.05 0.61 -0.87 0.00 0.00 176.83 176.18 2wss n GLY 204 N -0.38 0.80 0.10 -0.77 0.00 -0.23 -4.95 105.19 99.76 2wss n GLY 204 Ca -0.01 -0.64 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 2wss n GLY 204 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wss h VAL 205 N -0.17 1.03 -2.88 1.61 2.07 -0.98 -3.44 116.25 113.50 2wss h VAL 205 Ca -0.04 -2.76 -0.63 0.00 0.82 0.00 0.00 66.70 64.09 2wss h VAL 205 Cb 1.03 2.62 -0.07 0.00 -1.52 0.00 0.00 31.29 33.35 2wss h VAL 205 CO 0.04 0.74 -0.35 -0.63 0.02 0.00 0.00 177.57 177.39 2wss s ILE 206 N -2.61 5.28 -0.12 4.57 1.01 -0.11 -1.32 121.20 127.90 2wss s ILE 206 Ca -0.09 0.51 -0.01 0.00 0.00 0.00 0.00 60.65 61.07 2wss s ILE 206 Cb 0.07 -3.56 0.03 0.00 0.01 0.00 0.00 42.46 39.02 2wss s ILE 206 CO 0.83 0.58 -0.04 0.21 0.00 0.00 0.00 174.94 176.51 2wss s ASN 207 N -0.87 2.22 0.30 3.58 3.84 -1.26 -4.39 114.94 118.36 2wss s ASN 207 Ca 0.19 -0.36 0.11 0.00 0.21 0.00 0.00 52.86 53.01 2wss s ASN 207 Cb -0.14 -0.74 0.44 0.00 -0.55 0.00 0.00 41.25 40.26 2wss s ASN 207 CO 0.08 -0.16 1.66 -0.07 -2.79 0.00 0.00 177.10 175.81 2wss h LEU 208 N 8.21 0.00 -0.25 3.21 3.38 -1.96 -3.21 115.31 124.69 2wss h LEU 208 Ca -0.25 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.63 2wss h LEU 208 Cb 1.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2wss h LEU 208 CO 0.36 0.56 -0.19 0.11 0.09 0.00 0.00 178.44 179.38 2wss h LYS 209 N 0.00 0.57 0.00 1.13 1.79 -2.03 -3.48 116.57 114.56 2wss h LYS 209 Ca -0.01 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.19 2wss h LYS 209 Cb 1.00 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.65 2wss h LYS 209 CO 0.07 0.86 0.00 -0.25 -1.08 0.00 0.00 179.45 179.05 2wss n ASP 210 N -4.41 0.38 -0.84 0.86 8.00 -1.21 -5.02 116.55 114.31 2wss n ASP 210 Ca -0.04 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.51 2wss n ASP 210 Cb 0.40 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.61 2wss n ASP 210 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wss n ALA 211 N -3.00 2.81 1.69 2.24 0.00 -1.26 -4.80 120.51 118.19 2wss n ALA 211 Ca 0.00 -2.60 0.06 0.00 0.00 0.00 0.00 53.44 50.91 2wss n ALA 211 Cb 0.00 -0.51 0.31 0.00 0.00 0.00 0.00 19.45 19.25 2wss n ALA 211 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wss n THR 212 N -0.45 0.11 -2.25 0.00 -2.24 -1.26 -4.92 114.28 103.27 2wss n THR 212 Ca 0.12 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.35 2wss n THR 212 Cb 0.85 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.04 2wss n THR 212 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2wss s SER 213 N -1.33 6.95 0.00 3.42 0.01 -1.26 -4.86 113.70 116.63 2wss s SER 213 Ca 0.20 2.47 0.11 0.00 1.31 0.00 0.00 55.95 60.04 2wss s SER 213 Cb 0.10 -2.63 0.29 0.00 0.21 0.00 0.00 66.02 63.99 2wss s SER 213 CO 0.16 -0.43 1.23 0.29 0.41 0.00 0.00 173.24 174.90 2wss n LYS 214 N 1.60 2.74 -3.84 12.44 4.76 -0.44 -4.74 118.16 130.68 2wss n LYS 214 Ca 0.02 -1.99 -0.12 0.00 -2.87 0.00 0.00 58.31 53.35 2wss n LYS 214 Cb 0.43 -1.26 -0.12 0.00 -1.84 0.00 0.00 35.03 32.24 2wss n LYS 214 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wss s VAL 215 N -1.00 0.03 0.02 -0.18 1.01 -1.26 -1.18 120.40 117.84 2wss s VAL 215 Ca 0.22 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 62.02 2wss s VAL 215 Cb 0.12 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.19 2wss s VAL 215 CO 0.15 -0.13 -0.12 0.00 0.00 0.00 0.00 175.10 175.01 2wss s ALA 216 N -0.39 2.80 -0.14 5.51 0.00 -0.29 0.64 121.76 129.89 2wss s ALA 216 Ca -0.05 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.84 2wss s ALA 216 Cb -0.03 -0.94 0.01 0.00 0.00 0.00 0.00 23.12 22.15 2wss s ALA 216 CO 0.01 0.59 -0.21 -0.51 0.00 0.00 0.00 175.76 175.63 2wss s LEU 217 N -1.39 2.16 -0.13 0.00 1.43 -1.04 -0.94 118.68 118.77 2wss s LEU 217 Ca 0.16 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 2wss s LEU 217 Cb -0.11 -1.46 0.01 0.00 0.03 0.00 0.00 46.19 44.67 2wss s LEU 217 CO 0.06 0.09 -0.18 -0.69 0.23 0.00 0.00 176.35 175.86 2wss s VAL 218 N 0.77 1.76 -0.07 -1.59 1.01 -0.59 -0.74 120.40 120.95 2wss s VAL 218 Ca -0.08 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2wss s VAL 218 Cb -0.16 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.66 2wss s VAL 218 CO -0.01 0.49 -0.06 -0.31 0.00 0.00 0.00 175.10 175.21 2wss s TYR 219 N 1.05 1.07 -0.33 5.22 1.51 -0.81 -1.24 117.35 123.81 2wss s TYR 219 Ca -0.04 -0.40 -0.01 0.00 -1.01 0.00 0.00 57.07 55.61 2wss s TYR 219 Cb -0.15 -0.92 0.13 0.00 -0.11 0.00 0.00 41.96 40.92 2wss s TYR 219 CO -0.04 -0.31 0.20 0.20 -1.11 0.00 0.00 175.55 174.49 2wss s GLY 220 N 1.22 0.62 0.48 0.71 0.00 -0.34 -4.25 107.32 105.75 2wss s GLY 220 Ca -0.05 -1.48 -0.02 0.00 0.00 0.00 0.00 44.72 43.16 2wss s GLY 220 CO -0.02 2.16 0.66 -1.06 0.00 0.00 0.00 173.10 174.84 2wss n GLN 221 N 4.49 -0.01 0.00 2.90 1.13 -1.26 0.36 117.38 124.99 2wss n GLN 221 Ca 0.06 -1.61 0.00 0.00 -1.94 0.00 0.00 57.00 53.51 2wss n GLN 221 Cb 0.40 -0.49 0.00 0.00 0.11 0.00 0.00 30.24 30.25 2wss n GLN 221 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wss n MET 222 N -2.25 0.63 -0.00 -1.09 0.00 0.07 -1.79 117.12 112.69 2wss n MET 222 Ca 0.10 0.00 0.03 0.00 0.00 0.00 0.00 57.70 57.84 2wss n MET 222 Cb 0.36 -1.32 -0.04 0.00 0.00 0.00 0.00 33.22 32.22 2wss n MET 222 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 2wss n ASN 223 N 0.19 1.42 -4.87 3.17 2.04 -1.26 -5.02 115.26 110.93 2wss n ASN 223 Ca 0.00 -0.42 -0.32 0.00 -0.44 0.00 0.00 54.58 53.39 2wss n ASN 223 Cb 0.16 1.11 -0.06 0.00 -2.53 0.00 0.00 39.78 38.47 2wss n ASN 223 CO 0.00 0.00 0.00 -1.61 -0.44 0.00 0.00 177.26 175.21 2wss s GLU 224 N -1.95 3.84 1.00 -3.83 0.41 -0.74 -5.07 118.70 112.37 2wss s GLU 224 Ca 0.01 0.34 -0.18 0.00 -0.41 0.00 0.00 54.97 54.73 2wss s GLU 224 Cb 0.05 -2.64 -0.13 0.00 -1.78 0.00 0.00 34.13 29.63 2wss s GLU 224 CO 0.28 0.31 -0.72 -2.30 -0.49 0.00 0.00 175.26 172.35 2wss n PRO 225 N -0.09 -0.07 0.18 0.39 -0.02 -1.26 -4.61 135.00 129.52 2wss n PRO 225 Ca 0.00 -0.02 -0.15 0.00 -2.02 0.00 0.00 63.50 61.32 2wss n PRO 225 Cb 0.52 -1.13 -0.08 0.00 -0.02 0.00 0.00 33.50 32.80 2wss n PRO 225 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2wss h PRO 226 N -1.10 -0.71 -0.88 0.52 0.11 -1.94 -2.21 132.00 125.79 2wss h PRO 226 Ca -0.44 0.05 0.12 0.00 0.11 0.00 0.00 66.00 65.84 2wss h PRO 226 Cb 1.31 0.16 -0.13 0.00 0.11 0.00 0.00 31.00 32.45 2wss h PRO 226 CO 0.25 -0.47 -0.46 0.78 -0.21 0.00 0.00 178.00 177.88 2wss h GLY 227 N -0.73 -0.35 0.58 -0.55 0.00 -1.89 1.39 103.07 101.52 2wss h GLY 227 Ca -0.01 0.62 0.06 0.00 0.00 0.00 0.00 47.33 48.00 2wss h GLY 227 CO -0.15 -0.11 0.11 0.00 0.00 0.00 0.00 176.54 176.39 2wss h ALA 228 N 0.90 0.45 -0.52 3.60 0.00 -1.65 -0.90 119.26 121.15 2wss h ALA 228 Ca 0.24 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 2wss h ALA 228 Cb 0.53 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2wss h ALA 228 CO -0.89 -0.29 -0.15 0.00 0.00 0.00 0.00 179.25 177.93 2wss h ARG 229 N 0.26 1.01 -1.01 0.00 3.08 -0.52 -0.80 114.38 116.39 2wss h ARG 229 Ca 0.19 -0.39 0.24 0.00 0.07 0.00 0.00 59.98 60.09 2wss h ARG 229 Cb 0.20 -0.05 -0.10 0.00 0.08 0.00 0.00 29.97 30.09 2wss h ARG 229 CO -0.22 1.07 0.63 0.00 -1.07 0.00 0.00 179.97 180.39 2wss h ALA 230 N 0.93 2.01 0.00 0.04 0.00 0.29 -3.34 119.26 119.19 2wss h ALA 230 Ca 0.13 0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.81 2wss h ALA 230 Cb 0.72 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.46 2wss h ALA 230 CO 0.06 -0.41 -2.02 0.54 0.00 0.00 0.00 179.25 177.41 2wss n ARG 231 N -4.71 0.39 -0.65 0.00 5.12 -0.45 -4.54 116.66 111.83 2wss n ARG 231 Ca 0.25 0.17 0.49 0.00 -1.93 0.00 0.00 57.85 56.83 2wss n ARG 231 Cb 0.77 -1.16 0.76 0.00 -1.16 0.00 0.00 32.46 31.66 2wss n ARG 231 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2wss n VAL 232 N -3.78 -0.01 0.09 1.55 0.31 -0.34 0.31 118.33 116.47 2wss n VAL 232 Ca -0.36 1.38 0.16 0.00 -0.01 0.00 0.00 64.34 65.51 2wss n VAL 232 Cb 0.76 -2.30 0.69 0.00 -0.91 0.00 0.00 33.84 32.08 2wss n VAL 232 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wss h ALA 233 N 0.93 2.31 0.11 3.52 0.00 -1.80 -2.64 119.26 121.69 2wss h ALA 233 Ca 0.87 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 55.50 2wss h ALA 233 Cb 3.47 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 21.29 2wss h ALA 233 CO -0.02 -0.44 -1.35 -0.07 0.00 0.00 0.00 179.25 177.37 2wss h LEU 234 N 0.00 0.37 0.00 0.00 3.38 0.45 -2.89 115.31 116.63 2wss h LEU 234 Ca 0.17 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.28 2wss h LEU 234 Cb 0.68 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2wss h LEU 234 CO -0.00 1.59 0.00 0.41 0.09 0.00 0.00 178.44 180.53 2wss n THR 235 N -3.95 0.00 -0.15 0.22 -1.04 -1.02 0.52 114.28 108.85 2wss n THR 235 Ca -0.24 1.40 0.28 0.00 -2.04 0.00 0.00 64.05 63.45 2wss n THR 235 Cb 0.89 -1.94 0.72 0.00 -1.82 0.00 0.00 70.33 68.17 2wss n THR 235 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2wss h GLY 236 N 0.00 0.00 0.74 3.41 0.00 -1.66 0.12 103.07 105.68 2wss h GLY 236 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2wss h GLY 236 CO 0.00 0.00 -0.36 -2.00 0.00 0.00 0.00 176.54 174.18 2wss h LEU 237 N 0.00 -0.84 -0.84 3.11 5.85 -0.07 -2.96 115.31 119.56 2wss h LEU 237 Ca 0.41 0.03 0.20 0.00 0.84 0.00 0.00 57.88 59.36 2wss h LEU 237 Cb 1.82 0.22 -0.15 0.00 0.37 0.00 0.00 40.66 42.92 2wss h LEU 237 CO -0.00 -0.59 0.01 0.74 -0.34 0.00 0.00 178.44 178.26 2wss h THR 238 N -1.02 0.24 0.14 1.05 2.02 0.28 -1.33 112.91 114.29 2wss h THR 238 Ca -0.10 -0.03 0.02 0.00 0.77 0.00 0.00 66.41 67.07 2wss h THR 238 Cb 0.76 0.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.27 2wss h THR 238 CO 0.17 0.01 -0.46 0.58 0.37 0.00 0.00 175.52 176.19 2wss h VAL 239 N 0.08 0.09 -0.87 3.16 2.07 -1.51 -1.40 116.25 117.87 2wss h VAL 239 Ca 0.47 0.00 0.16 0.00 0.82 0.00 0.00 66.70 68.16 2wss h VAL 239 Cb 0.88 0.09 -0.07 0.00 -1.52 0.00 0.00 31.29 30.68 2wss h VAL 239 CO -0.75 0.00 0.57 0.00 0.02 0.00 0.00 177.57 177.41 2wss h ALA 240 N -0.33 1.97 0.24 1.67 0.00 -1.12 -2.73 119.26 118.96 2wss h ALA 240 Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wss h ALA 240 Cb 0.72 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2wss h ALA 240 CO -0.25 -0.23 -0.22 0.93 0.00 0.00 0.00 179.25 179.48 2wss h GLU 241 N 0.57 -0.47 -0.07 0.00 5.08 -0.23 -2.64 114.58 116.82 2wss h GLU 241 Ca 0.45 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.85 2wss h GLU 241 Cb 0.87 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.20 2wss h GLU 241 CO -0.19 -0.32 -0.27 -0.92 -1.00 0.00 0.00 179.01 176.31 2wss h TYR 242 N -0.49 -0.81 -0.42 4.33 3.20 -1.08 -1.26 116.97 120.43 2wss h TYR 242 Ca -0.01 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.02 2wss h TYR 242 Cb 0.45 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.07 2wss h TYR 242 CO -0.15 -0.27 0.86 0.74 -1.64 0.00 0.00 178.16 177.70 2wss h PHE 243 N -0.29 0.00 0.00 -3.82 -1.00 -1.42 0.18 116.94 110.58 2wss h PHE 243 Ca 0.02 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.74 2wss h PHE 243 Cb 0.34 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.89 2wss h PHE 243 CO -0.51 0.00 -0.37 -0.09 -1.61 0.00 0.00 178.31 175.73 2wss h ARG 244 N 0.00 0.00 0.00 1.51 2.43 -0.91 -3.04 114.38 114.37 2wss h ARG 244 Ca 0.20 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 2wss h ARG 244 Cb 1.93 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.48 2wss h ARG 244 CO -0.00 0.58 0.00 -0.25 -1.51 0.00 0.00 179.97 178.79 2wss n ASP 245 N -4.62 0.00 -2.89 -3.80 8.00 -0.04 -1.21 116.55 111.99 2wss n ASP 245 Ca -0.12 0.34 -0.20 0.00 0.71 0.00 0.00 54.79 55.53 2wss n ASP 245 Cb 0.37 -0.29 -0.05 0.00 -0.02 0.00 0.00 41.12 41.13 2wss n ASP 245 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wss n GLN 246 N -1.38 2.04 0.00 -1.24 1.13 -0.68 -2.09 117.38 115.17 2wss n GLN 246 Ca 0.00 -1.30 0.00 0.00 -1.94 0.00 0.00 57.00 53.76 2wss n GLN 246 Cb 0.00 -2.30 0.00 0.00 0.11 0.00 0.00 30.24 28.05 2wss n GLN 246 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2wss n GLU 247 N 3.67 0.00 -3.70 -1.09 2.13 -1.26 -4.75 120.64 115.65 2wss n GLU 247 Ca 0.44 0.00 -0.20 0.00 0.66 0.00 0.00 57.16 58.05 2wss n GLU 247 Cb 0.28 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.00 2wss n GLU 247 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wss n GLY 248 N 0.00 -0.48 3.69 8.31 0.00 -0.35 -4.88 105.19 111.48 2wss n GLY 248 Ca 0.00 0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 2wss n GLY 248 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wss s GLN 249 N -5.46 2.08 -0.63 1.61 2.00 -1.14 -4.84 119.66 113.28 2wss s GLN 249 Ca 0.18 -2.12 -0.21 0.00 -2.00 0.00 0.00 55.36 51.20 2wss s GLN 249 Cb -0.10 -1.70 0.08 0.00 0.80 0.00 0.00 33.01 32.09 2wss s GLN 249 CO 0.47 -0.16 0.84 -0.51 -0.50 0.00 0.00 175.29 175.44 2wss s ASP 250 N -3.81 6.18 -0.11 6.67 1.01 -1.26 -2.49 116.67 122.85 2wss s ASP 250 Ca 0.29 -1.18 -0.10 0.00 0.71 0.00 0.00 52.55 52.28 2wss s ASP 250 Cb 0.06 -2.37 -0.05 0.00 1.01 0.00 0.00 42.92 41.58 2wss s ASP 250 CO 0.16 -1.29 0.22 -0.69 0.21 0.00 0.00 175.17 173.78 2wss s VAL 251 N 3.43 5.36 -0.31 -1.27 1.01 0.96 -2.91 120.40 126.66 2wss s VAL 251 Ca 0.17 0.40 -0.05 0.00 0.00 0.00 0.00 61.98 62.51 2wss s VAL 251 Cb -0.20 -3.52 0.03 0.00 0.00 0.00 0.00 36.38 32.70 2wss s VAL 251 CO 0.09 0.54 0.06 -0.76 0.00 0.00 0.00 175.10 175.03 2wss s LEU 252 N -0.57 4.03 -0.28 3.92 1.43 -0.21 -1.19 118.68 125.80 2wss s LEU 252 Ca 0.16 -1.07 -0.08 0.00 -1.03 0.00 0.00 54.13 52.12 2wss s LEU 252 Cb -0.13 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 2wss s LEU 252 CO 0.05 -0.27 0.10 -0.22 0.23 0.00 0.00 176.35 176.25 2wss s LEU 253 N 1.38 3.78 -0.20 1.79 2.96 -0.69 0.12 118.68 127.82 2wss s LEU 253 Ca -0.02 -0.44 -0.04 0.00 -0.22 0.00 0.00 54.13 53.41 2wss s LEU 253 Cb -0.19 -1.94 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 2wss s LEU 253 CO 0.01 -0.13 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.53 2wss s PHE 254 N 1.59 3.01 0.06 5.38 0.40 0.01 -1.13 117.98 127.29 2wss s PHE 254 Ca 0.05 -0.56 0.08 0.00 -0.60 0.00 0.00 56.93 55.90 2wss s PHE 254 Cb -0.16 -2.07 -0.03 0.00 0.51 0.00 0.00 43.02 41.27 2wss s PHE 254 CO 0.04 -0.29 -0.22 0.42 0.70 0.00 0.00 175.22 175.88 2wss s ILE 255 N 1.02 2.53 -0.30 0.64 1.01 -0.89 -0.61 121.20 124.61 2wss s ILE 255 Ca 0.01 -1.34 0.05 0.00 0.00 0.00 0.00 60.65 59.37 2wss s ILE 255 Cb -0.14 -2.06 0.19 0.00 0.01 0.00 0.00 42.46 40.46 2wss s ILE 255 CO 0.01 0.30 0.55 -0.62 0.00 0.00 0.00 174.94 175.18 2wss s ASP 256 N -1.50 -1.15 -0.12 3.58 3.68 -0.84 -1.90 116.67 118.42 2wss s ASP 256 Ca 0.14 -0.00 -0.01 0.00 2.13 0.00 0.00 52.55 54.80 2wss s ASP 256 Cb -0.10 1.81 0.03 0.00 -1.45 0.00 0.00 42.92 43.21 2wss s ASP 256 CO 0.05 -0.31 -0.02 0.21 0.13 0.00 0.00 175.17 175.23 2wss s ASN 257 N 2.71 2.14 0.59 -0.34 3.84 0.32 -2.00 114.94 122.19 2wss s ASN 257 Ca 0.10 -0.35 0.29 0.00 0.21 0.00 0.00 52.86 53.11 2wss s ASN 257 Cb -0.10 -0.63 1.52 0.00 -0.55 0.00 0.00 41.25 41.49 2wss s ASN 257 CO -0.26 -0.19 1.94 -0.29 -2.79 0.00 0.00 177.10 175.50 2wss h ILE 258 N 6.33 0.36 -0.97 -5.21 6.09 -1.56 0.40 117.51 122.95 2wss h ILE 258 Ca -0.22 0.00 0.02 0.00 -1.37 0.00 0.00 64.86 63.29 2wss h ILE 258 Cb 1.12 0.66 -0.05 0.00 0.47 0.00 0.00 36.82 39.02 2wss h ILE 258 CO 0.33 0.00 0.64 0.15 -3.07 0.00 0.00 178.15 176.20 2wss h PHE 259 N 0.00 1.20 0.00 2.19 3.57 -1.89 -2.32 116.94 119.69 2wss h PHE 259 Ca 0.17 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2wss h PHE 259 Cb 1.01 -0.40 0.00 0.00 2.79 0.00 0.00 35.95 39.34 2wss h PHE 259 CO 0.00 0.73 0.00 0.54 -2.23 0.00 0.00 178.31 177.35 2wss n ARG 260 N -4.43 0.13 -0.03 1.11 5.12 0.14 -1.44 116.66 117.25 2wss n ARG 260 Ca 0.12 0.55 -0.15 0.00 -1.93 0.00 0.00 57.85 56.44 2wss n ARG 260 Cb 0.04 -1.85 -0.10 0.00 -1.16 0.00 0.00 32.46 29.39 2wss n ARG 260 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 2wss h PHE 261 N 0.00 0.31 -0.23 -1.55 3.57 -1.54 -0.61 116.94 116.88 2wss h PHE 261 Ca 0.00 -0.14 -0.12 0.00 3.53 0.00 0.00 57.97 61.24 2wss h PHE 261 Cb 0.10 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 2wss h PHE 261 CO 0.00 0.86 -0.38 1.15 -2.23 0.00 0.00 178.31 177.71 2wss h THR 262 N -0.34 1.30 0.27 4.41 2.02 -1.35 -2.09 112.91 117.12 2wss h THR 262 Ca -0.02 -1.52 -0.01 0.00 0.77 0.00 0.00 66.41 65.63 2wss h THR 262 Cb 0.89 1.53 0.00 0.00 -1.74 0.00 0.00 68.15 68.83 2wss h THR 262 CO 0.05 0.48 -0.13 -0.61 0.37 0.00 0.00 175.52 175.67 2wss h GLN 263 N 0.44 -0.35 -0.59 6.66 4.15 -1.33 -1.17 115.11 122.93 2wss h GLN 263 Ca 0.04 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.56 2wss h GLN 263 Cb 0.86 0.08 -0.06 0.00 0.21 0.00 0.00 27.48 28.56 2wss h GLN 263 CO 0.07 -0.09 0.25 0.00 -1.93 0.00 0.00 178.83 177.13 2wss h ALA 264 N 0.10 0.76 -0.44 3.38 0.00 -1.14 -1.11 119.26 120.80 2wss h ALA 264 Ca -0.04 0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2wss h ALA 264 Cb 0.42 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 2wss h ALA 264 CO 0.06 -0.15 -0.26 0.41 0.00 0.00 0.00 179.25 179.31 2wss n GLY 265 N -1.28 -2.88 0.33 0.00 0.00 -0.79 -0.91 105.19 99.66 2wss n GLY 265 Ca 0.07 0.85 0.24 0.00 0.00 0.00 0.00 46.02 47.19 2wss n GLY 265 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2wss h SER 266 N 0.00 0.23 0.43 1.61 0.87 0.03 0.12 113.55 116.84 2wss h SER 266 Ca 0.07 0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.83 2wss h SER 266 Cb 0.18 0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 2wss h SER 266 CO -0.42 -0.29 -0.17 -0.33 -0.53 0.00 0.00 176.83 175.09 2wss h GLU 267 N 0.14 0.00 0.01 2.24 5.08 -0.35 -3.18 114.58 118.52 2wss h GLU 267 Ca 0.74 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.72 2wss h GLU 267 Cb 1.76 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.95 2wss h GLU 267 CO -0.72 0.17 -2.38 1.33 -1.00 0.00 0.00 179.01 176.41 2wss n VAL 268 N -3.71 1.50 -0.23 3.13 0.24 0.27 -4.33 118.33 115.20 2wss n VAL 268 Ca -0.02 -0.65 0.31 0.00 -2.04 0.00 0.00 64.34 61.95 2wss n VAL 268 Cb 0.29 -1.23 0.73 0.00 -1.47 0.00 0.00 33.84 32.16 2wss n VAL 268 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2wss h SER 269 N 0.01 0.00 -0.06 -1.34 0.87 -1.12 0.11 113.55 112.02 2wss h SER 269 Ca -0.55 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.04 2wss h SER 269 Cb 2.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.93 2wss h SER 269 CO -0.04 0.00 -0.09 0.00 -0.53 0.00 0.00 176.83 176.18 2wss h ALA 270 N 1.45 -0.04 0.00 6.23 0.00 -1.75 -3.01 119.26 122.14 2wss h ALA 270 Ca 0.48 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.33 2wss h ALA 270 Cb 1.97 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 2wss h ALA 270 CO -0.01 -0.56 -1.62 1.28 0.00 0.00 0.00 179.25 178.34 2wss n LEU 271 N -5.22 0.44 -0.07 0.00 4.32 0.27 -3.01 117.00 113.74 2wss n LEU 271 Ca -0.05 0.18 0.25 0.00 -0.02 0.00 0.00 56.01 56.38 2wss n LEU 271 Cb 0.14 0.06 0.71 0.00 -1.62 0.00 0.00 43.42 42.71 2wss n LEU 271 CO 0.27 0.04 1.23 -0.07 -1.22 0.00 0.00 177.39 177.64 2wss h LEU 272 N 0.00 0.00 0.00 2.23 3.38 -1.34 -3.46 115.31 116.12 2wss h LEU 272 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2wss h LEU 272 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2wss h LEU 272 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2wss n GLY 273 N -1.62 0.87 3.64 0.83 0.00 -1.16 -5.09 105.19 102.66 2wss n GLY 273 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 2wss n GLY 273 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wss n ARG 274 N -2.14 0.01 -2.99 1.61 3.00 -1.14 -5.01 116.66 110.01 2wss n ARG 274 Ca 0.00 0.08 -0.40 0.00 -0.01 0.00 0.00 57.85 57.52 2wss n ARG 274 Cb 0.00 -2.31 -0.04 0.00 0.00 0.00 0.00 32.46 30.11 2wss n ARG 274 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2wss s ILE 275 N -2.24 5.01 0.32 0.55 1.01 -1.26 -4.80 121.20 119.79 2wss s ILE 275 Ca 0.70 1.55 -0.27 0.00 0.00 0.00 0.00 60.65 62.63 2wss s ILE 275 Cb -0.28 -4.09 -0.13 0.00 0.01 0.00 0.00 42.46 37.97 2wss s ILE 275 CO 0.55 0.23 0.96 -0.81 0.00 0.00 0.00 174.94 175.86 2wss n PRO 276 N 3.87 1.25 0.00 2.79 -0.04 -1.26 -4.34 135.00 137.27 2wss n PRO 276 Ca 0.00 0.44 0.00 0.00 -0.04 0.00 0.00 63.50 63.90 2wss n PRO 276 Cb 0.51 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 2wss n PRO 276 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wss n SER 277 N 1.12 0.40 -4.70 3.54 2.88 0.15 -4.89 113.62 112.11 2wss n SER 277 Ca 0.10 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.20 2wss n SER 277 Cb 0.34 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.77 2wss n SER 277 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wss n ALA 278 N -3.00 1.77 -1.03 -1.46 0.00 -1.26 -1.52 120.51 114.01 2wss n ALA 278 Ca 0.00 0.41 -0.01 0.00 0.00 0.00 0.00 53.44 53.84 2wss n ALA 278 Cb 0.00 -2.37 -0.00 0.00 0.00 0.00 0.00 19.45 17.07 2wss n ALA 278 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wss n VAL 279 N 2.60 0.00 -0.14 0.00 0.31 -1.26 -2.21 118.33 117.64 2wss n VAL 279 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 2wss n VAL 279 Cb 0.33 -0.71 0.00 0.00 -0.91 0.00 0.00 33.84 32.55 2wss n VAL 279 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wss n GLY 280 N -0.50 0.88 3.61 2.92 0.00 -0.57 -5.06 105.19 106.48 2wss n GLY 280 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 2wss n GLY 280 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wss s TYR 281 N -2.48 1.83 0.50 1.61 4.12 -0.94 -4.51 117.35 117.47 2wss s TYR 281 Ca 0.00 1.15 -0.22 0.00 0.02 0.00 0.00 57.07 58.01 2wss s TYR 281 Cb 0.00 -3.19 -0.06 0.00 -1.52 0.00 0.00 41.96 37.19 2wss s TYR 281 CO 0.00 -3.18 1.25 1.14 0.02 0.00 0.00 175.55 174.78 2wss s GLN 282 N -4.76 3.49 0.61 -0.62 0.00 -1.26 -0.68 119.66 116.44 2wss s GLN 282 Ca 0.66 1.97 0.31 0.00 -0.00 0.00 0.00 55.36 58.31 2wss s GLN 282 Cb -0.21 -2.34 1.78 0.00 0.00 0.00 0.00 33.01 32.24 2wss s GLN 282 CO 0.60 -0.83 2.15 -1.35 0.00 0.00 0.00 175.29 175.86 2wss h PRO 283 N 1.79 0.00 -0.90 9.60 0.11 -1.91 -3.04 132.00 137.65 2wss h PRO 283 Ca -0.50 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 64.98 2wss h PRO 283 Cb 1.27 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 32.03 2wss h PRO 283 CO 0.59 0.00 0.19 0.25 -0.21 0.00 0.00 178.00 178.81 2wss n THR 284 N -3.64 3.19 0.12 -1.15 -2.24 -1.26 -4.71 114.28 104.58 2wss n THR 284 Ca -0.00 -3.47 -0.03 0.00 -2.27 0.00 0.00 64.05 58.29 2wss n THR 284 Cb 0.26 -1.15 0.14 0.00 -2.10 0.00 0.00 70.33 67.48 2wss n THR 284 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2wss h LEU 285 N 2.08 0.09 0.04 3.22 6.46 -1.93 -2.38 115.31 122.89 2wss h LEU 285 Ca 0.51 -0.05 -0.24 0.00 -0.12 0.00 0.00 57.88 57.97 2wss h LEU 285 Cb 1.10 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 41.00 2wss h LEU 285 CO 1.26 0.70 -1.12 0.00 -0.62 0.00 0.00 178.44 178.66 2wss h ALA 286 N 1.30 0.23 0.00 1.25 0.00 -1.89 -2.85 119.26 117.30 2wss h ALA 286 Ca -0.01 -0.88 -0.14 0.00 0.00 0.00 0.00 54.91 53.88 2wss h ALA 286 Cb 1.13 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2wss h ALA 286 CO 0.09 1.08 -1.29 0.25 0.00 0.00 0.00 179.25 179.38 2wss n THR 287 N -3.47 1.49 -0.12 0.00 -2.24 -1.24 -1.40 114.28 107.31 2wss n THR 287 Ca -0.05 0.01 0.01 0.00 -2.27 0.00 0.00 64.05 61.75 2wss n THR 287 Cb 0.97 -2.21 0.03 0.00 -2.10 0.00 0.00 70.33 67.03 2wss n THR 287 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2wss n ASP 288 N -4.44 -0.15 0.00 3.42 9.92 -0.90 0.05 116.55 124.45 2wss n ASP 288 Ca -0.25 0.55 0.00 0.00 -0.53 0.00 0.00 54.79 54.57 2wss n ASP 288 Cb 0.57 -0.15 0.00 0.00 -0.64 0.00 0.00 41.12 40.90 2wss n ASP 288 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 2wss n MET 289 N -4.50 0.00 -0.36 -1.24 1.56 -1.08 -3.81 117.12 107.69 2wss n MET 289 Ca 0.04 0.10 0.29 0.00 -0.27 0.00 0.00 57.70 57.86 2wss n MET 289 Cb 0.15 -0.83 0.46 0.00 2.15 0.00 0.00 33.22 35.15 2wss n MET 289 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2wss n GLY 290 N 1.03 -0.56 0.00 -5.12 0.00 -0.49 0.08 105.19 100.12 2wss n GLY 290 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.47 2wss n GLY 290 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wss n THR 291 N -3.58 0.00 -0.18 2.61 -2.24 0.11 -1.71 114.28 109.29 2wss n THR 291 Ca 0.26 0.88 0.04 0.00 -2.27 0.00 0.00 64.05 62.97 2wss n THR 291 Cb 1.10 -1.70 0.09 0.00 -2.10 0.00 0.00 70.33 67.71 2wss n THR 291 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 2wss n MET 292 N -0.84 -0.04 -0.11 -0.78 0.00 -0.41 -0.94 117.12 114.00 2wss n MET 292 Ca 0.00 0.76 -0.14 0.00 0.00 0.00 0.00 57.70 58.33 2wss n MET 292 Cb 0.00 -1.16 -0.03 0.00 0.00 0.00 0.00 33.22 32.03 2wss n MET 292 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 2wss h GLN 293 N 0.00 0.90 0.00 2.12 1.08 -0.38 -3.02 115.11 115.81 2wss h GLN 293 Ca 0.26 -0.49 0.00 0.00 -1.45 0.00 0.00 58.65 56.96 2wss h GLN 293 Cb 0.44 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 2wss h GLN 293 CO -0.50 1.14 0.00 0.39 -0.95 0.00 0.00 178.83 178.91 2wss n GLU 294 N -4.08 0.06 0.08 1.46 -0.58 -0.12 -1.85 120.64 115.61 2wss n GLU 294 Ca -0.03 0.15 -0.15 0.00 -0.42 0.00 0.00 57.16 56.71 2wss n GLU 294 Cb 0.55 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.84 2wss n GLU 294 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wss h ARG 295 N 0.00 0.40 -5.78 3.49 3.08 -1.42 -3.39 114.38 110.75 2wss h ARG 295 Ca 0.00 -0.50 -0.36 0.00 0.07 0.00 0.00 59.98 59.19 2wss h ARG 295 Cb 0.31 0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.48 2wss h ARG 295 CO 0.00 1.17 0.97 0.42 -1.07 0.00 0.00 179.97 181.45 2wss s ILE 296 N -3.08 3.36 0.08 2.04 1.01 -0.77 -4.88 121.20 118.96 2wss s ILE 296 Ca -0.06 -0.11 -0.26 0.00 0.00 0.00 0.00 60.65 60.23 2wss s ILE 296 Cb 0.08 -3.86 0.08 0.00 0.01 0.00 0.00 42.46 38.77 2wss s ILE 296 CO 0.88 -0.82 0.69 0.28 0.00 0.00 0.00 174.94 175.97 2wss s THR 297 N 10.16 0.00 -0.20 2.92 -1.32 -1.26 -4.98 115.64 120.95 2wss s THR 297 Ca 0.72 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.98 2wss s THR 297 Cb -0.10 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.87 2wss s THR 297 CO 0.09 0.00 0.68 -0.89 -2.21 0.00 0.00 174.62 172.29 2wss s THR 298 N -3.13 4.98 0.43 5.08 2.01 -1.26 -4.23 115.64 119.53 2wss s THR 298 Ca -0.00 1.29 0.04 0.00 0.31 0.00 0.00 61.69 63.33 2wss s THR 298 Cb -0.01 -3.99 0.04 0.00 0.01 0.00 0.00 72.50 68.55 2wss s THR 298 CO -0.08 0.07 0.34 0.35 -0.69 0.00 0.00 174.62 174.61 2wss n THR 299 N 4.79 0.00 -0.19 -0.82 -2.24 -1.20 -4.16 114.28 110.46 2wss n THR 299 Ca 0.00 -1.68 -0.05 0.00 -2.27 0.00 0.00 64.05 60.05 2wss n THR 299 Cb 0.49 -0.17 0.05 0.00 -2.10 0.00 0.00 70.33 68.60 2wss n THR 299 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2wss h LYS 300 N 0.00 0.67 0.00 -0.78 1.57 -1.48 -3.36 116.57 113.19 2wss h LYS 300 Ca -0.27 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2wss h LYS 300 Cb 0.99 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.15 2wss h LYS 300 CO 0.42 0.44 0.00 1.17 -0.57 0.00 0.00 179.45 180.91 2wss n LYS 301 N -4.75 0.00 -0.03 3.15 4.81 -1.26 -4.94 118.16 115.14 2wss n LYS 301 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 2wss n LYS 301 Cb 0.07 -0.68 0.00 0.00 0.02 0.00 0.00 35.03 34.44 2wss n LYS 301 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wss n GLY 302 N 0.10 0.94 3.15 3.14 0.00 -1.16 -4.70 105.19 106.66 2wss n GLY 302 Ca 0.00 -1.90 0.04 0.00 0.00 0.00 0.00 46.02 44.16 2wss n GLY 302 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wss s SER 303 N -1.00 -1.37 -0.28 1.61 0.15 -1.04 -3.21 113.70 108.56 2wss s SER 303 Ca 0.00 0.81 -0.07 0.00 0.70 0.00 0.00 55.95 57.39 2wss s SER 303 Cb 0.00 2.13 -0.00 0.00 -1.71 0.00 0.00 66.02 66.44 2wss s SER 303 CO 0.00 -0.26 0.08 -0.63 1.20 0.00 0.00 173.24 173.63 2wss s ILE 304 N 2.86 4.08 -0.46 6.45 1.01 -1.26 -0.03 121.20 133.85 2wss s ILE 304 Ca 0.20 -0.51 -0.24 0.00 0.00 0.00 0.00 60.65 60.10 2wss s ILE 304 Cb -0.14 -3.03 0.03 0.00 0.01 0.00 0.00 42.46 39.32 2wss s ILE 304 CO -0.21 0.18 0.84 -0.89 0.00 0.00 0.00 174.94 174.85 2wss s THR 305 N 1.54 4.58 -0.07 2.92 2.01 -0.33 -3.94 115.64 122.34 2wss s THR 305 Ca 0.04 0.52 -0.05 0.00 0.31 0.00 0.00 61.69 62.51 2wss s THR 305 Cb -0.16 -4.37 -0.04 0.00 0.01 0.00 0.00 72.50 67.94 2wss s THR 305 CO 0.03 -0.78 0.15 -0.94 -0.69 0.00 0.00 174.62 172.39 2wss s SER 306 N 2.22 6.33 -0.29 3.53 1.04 -0.17 -1.70 113.70 124.65 2wss s SER 306 Ca 0.32 0.41 -0.02 0.00 0.48 0.00 0.00 55.95 57.14 2wss s SER 306 Cb -0.11 -2.01 0.09 0.00 0.10 0.00 0.00 66.02 64.09 2wss s SER 306 CO 0.24 0.35 0.10 -0.69 0.98 0.00 0.00 173.24 174.22 2wss s VAL 307 N -1.14 0.54 -0.20 5.02 1.01 -0.28 -0.37 120.40 124.97 2wss s VAL 307 Ca 0.20 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.04 2wss s VAL 307 Cb -0.12 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 2wss s VAL 307 CO 0.10 -0.63 -0.00 -1.10 0.00 0.00 0.00 175.10 173.46 2wss s GLN 308 N 1.80 3.58 0.02 2.72 -0.21 0.07 -2.09 119.66 125.55 2wss s GLN 308 Ca 0.08 -0.54 -0.30 0.00 0.02 0.00 0.00 55.36 54.62 2wss s GLN 308 Cb -0.17 -3.07 -0.04 0.00 1.00 0.00 0.00 33.01 30.73 2wss s GLN 308 CO -0.27 -0.02 1.00 0.00 -2.12 0.00 0.00 175.29 173.88 2wss s ALA 309 N 1.09 3.19 -0.21 6.09 0.00 -0.80 -0.42 121.76 130.70 2wss s ALA 309 Ca 0.02 0.57 0.01 0.00 0.00 0.00 0.00 51.96 52.57 2wss s ALA 309 Cb -0.14 -3.34 0.04 0.00 0.00 0.00 0.00 23.12 19.68 2wss s ALA 309 CO 0.01 -0.22 -0.12 0.42 0.00 0.00 0.00 175.76 175.85 2wss s ILE 310 N 0.87 1.82 0.40 0.00 1.01 0.19 -1.62 121.20 123.87 2wss s ILE 310 Ca 0.52 -1.11 -0.23 0.00 0.00 0.00 0.00 60.65 59.83 2wss s ILE 310 Cb -0.22 -1.85 -0.10 0.00 0.01 0.00 0.00 42.46 40.30 2wss s ILE 310 CO 0.28 0.21 0.98 -0.47 0.00 0.00 0.00 174.94 175.94 2wss s TYR 311 N 1.32 3.37 -0.27 3.97 5.04 -1.26 -1.65 117.35 127.87 2wss s TYR 311 Ca -0.01 1.66 0.02 0.00 -2.44 0.00 0.00 57.07 56.30 2wss s TYR 311 Cb -0.16 -2.94 0.07 0.00 0.35 0.00 0.00 41.96 39.27 2wss s TYR 311 CO -0.09 -0.19 -0.04 0.08 -1.34 0.00 0.00 175.55 173.97 2wss s VAL 312 N -1.91 1.82 0.20 3.14 1.01 -0.34 -4.61 120.40 119.72 2wss s VAL 312 Ca 0.59 -1.58 -0.31 0.00 0.00 0.00 0.00 61.98 60.68 2wss s VAL 312 Cb -0.15 -2.11 -0.10 0.00 0.00 0.00 0.00 36.38 34.03 2wss s VAL 312 CO 0.19 -0.22 1.47 -2.84 0.00 0.00 0.00 175.10 173.71 2wss s PRO 313 N 1.23 4.26 -1.24 2.72 0.02 -1.26 -1.79 135.00 138.93 2wss s PRO 313 Ca -0.02 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.29 2wss s PRO 313 Cb -0.19 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.19 2wss s PRO 313 CO -0.08 -0.48 0.00 0.00 -0.33 0.00 0.00 177.00 176.11 2wss n ALA 314 N 3.06 -0.59 -1.36 -1.55 0.00 -1.26 -0.15 120.51 118.66 2wss n ALA 314 Ca 0.10 0.14 -0.12 0.00 0.00 0.00 0.00 53.44 53.55 2wss n ALA 314 Cb 0.40 -1.55 -0.05 0.00 0.00 0.00 0.00 19.45 18.25 2wss n ALA 314 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wss n ASP 315 N -1.45 -5.20 -4.45 0.00 9.92 -0.74 -4.91 116.55 109.72 2wss n ASP 315 Ca -0.15 0.31 -0.43 0.00 -0.53 0.00 0.00 54.79 53.98 2wss n ASP 315 Cb 0.57 -3.80 -0.03 0.00 -0.64 0.00 0.00 41.12 37.21 2wss n ASP 315 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2wss s ASP 316 N -2.59 6.33 0.00 -2.24 3.68 0.79 -4.85 116.67 117.79 2wss s ASP 316 Ca 0.00 -1.38 0.10 0.00 2.13 0.00 0.00 52.55 53.40 2wss s ASP 316 Cb 0.00 -2.41 0.58 0.00 -1.45 0.00 0.00 42.92 39.65 2wss s ASP 316 CO 0.00 -1.30 1.13 0.18 0.13 0.00 0.00 175.17 175.32 2wss n LEU 317 N 7.25 0.00 -0.00 -1.34 4.77 -1.26 -0.92 117.00 125.50 2wss n LEU 317 Ca 0.06 0.12 0.07 0.00 -0.03 0.00 0.00 56.01 56.23 2wss n LEU 317 Cb 0.46 -0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 41.35 2wss n LEU 317 CO 0.59 -0.08 -0.05 0.35 -1.33 0.00 0.00 177.39 176.87 2wss n THR 318 N -1.12 0.00 -1.63 -5.08 -2.24 -1.26 -3.93 114.28 99.02 2wss n THR 318 Ca 0.07 -0.14 -0.48 0.00 -2.27 0.00 0.00 64.05 61.23 2wss n THR 318 Cb 0.06 0.99 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 2wss n THR 318 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2wss n ASP 319 N -1.38 2.34 -0.25 3.42 -0.08 -0.09 -4.56 116.55 115.95 2wss n ASP 319 Ca 0.03 1.11 -0.00 0.00 -1.51 0.00 0.00 54.79 54.41 2wss n ASP 319 Cb 0.25 -1.32 0.03 0.00 2.34 0.00 0.00 41.12 42.42 2wss n ASP 319 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2wss n PRO 320 N 2.75 -0.15 0.00 -0.67 -0.02 -1.26 -0.41 135.00 135.25 2wss n PRO 320 Ca 0.17 1.00 0.00 0.00 -2.02 0.00 0.00 63.50 62.64 2wss n PRO 320 Cb 0.25 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 2wss n PRO 320 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wss n ALA 321 N -3.66 -0.17 -0.18 3.55 0.00 -1.26 0.55 120.51 119.34 2wss n ALA 321 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.45 2wss n ALA 321 Cb 0.26 0.31 0.03 0.00 0.00 0.00 0.00 19.45 20.05 2wss n ALA 321 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2wss h PRO 322 N 0.00 0.66 -0.61 0.00 0.11 -1.70 -2.94 132.00 127.51 2wss h PRO 322 Ca 0.00 -0.04 0.12 0.00 0.11 0.00 0.00 66.00 66.19 2wss h PRO 322 Cb 0.00 -0.15 -0.12 0.00 0.11 0.00 0.00 31.00 30.84 2wss h PRO 322 CO 0.00 0.43 -0.18 0.00 -0.21 0.00 0.00 178.00 178.04 2wss h ALA 323 N 1.21 0.34 -0.15 -0.75 0.00 -0.09 -2.45 119.26 117.37 2wss h ALA 323 Ca 0.20 0.23 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 2wss h ALA 323 Cb -0.04 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2wss h ALA 323 CO -0.06 -0.46 -0.04 1.15 0.00 0.00 0.00 179.25 179.83 2wss h THR 324 N -0.03 1.29 -0.95 0.00 2.02 0.18 -3.28 112.91 112.15 2wss h THR 324 Ca 0.29 -1.01 0.27 0.00 0.77 0.00 0.00 66.41 66.74 2wss h THR 324 Cb 0.47 1.65 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 2wss h THR 324 CO -0.65 0.30 0.77 0.74 0.37 0.00 0.00 175.52 177.05 2wss h THR 325 N -0.01 0.37 -0.93 3.16 2.02 -1.26 -2.45 112.91 113.80 2wss h THR 325 Ca 0.04 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.25 2wss h THR 325 Cb 0.47 0.44 -0.05 0.00 -1.74 0.00 0.00 68.15 67.27 2wss h THR 325 CO 0.02 0.00 0.61 -0.26 0.37 0.00 0.00 175.52 176.26 2wss h PHE 326 N 0.00 1.14 -1.26 3.16 -1.00 -1.60 -1.02 116.94 116.35 2wss h PHE 326 Ca 0.45 0.03 0.39 0.00 2.81 0.00 0.00 57.97 61.65 2wss h PHE 326 Cb 1.98 -0.38 -0.11 0.00 3.61 0.00 0.00 35.95 41.05 2wss h PHE 326 CO 0.00 0.66 0.82 0.00 -1.61 0.00 0.00 178.31 178.19 2wss h ALA 327 N 1.45 2.67 -0.48 2.45 0.00 -1.68 -2.80 119.26 120.88 2wss h ALA 327 Ca 0.37 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2wss h ALA 327 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2wss h ALA 327 CO -0.11 -1.22 0.00 0.72 0.00 0.00 0.00 179.25 178.64 2wss n HIS 328 N -4.62 0.69 -4.50 0.00 8.25 -0.39 -4.94 115.22 109.72 2wss n HIS 328 Ca 0.34 -0.33 -0.25 0.00 -0.26 0.00 0.00 57.72 57.22 2wss n HIS 328 Cb 1.30 -0.02 -0.10 0.00 1.12 0.00 0.00 29.99 32.28 2wss n HIS 328 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2wss s LEU 329 N -1.05 2.65 -0.06 2.41 1.43 -1.06 -4.85 118.68 118.15 2wss s LEU 329 Ca 0.32 -1.10 0.07 0.00 -1.03 0.00 0.00 54.13 52.40 2wss s LEU 329 Cb 0.17 -1.06 -0.10 0.00 0.03 0.00 0.00 46.19 45.23 2wss s LEU 329 CO 0.21 -0.06 0.06 0.47 0.23 0.00 0.00 176.35 177.26 2wss n ASP 330 N -0.69 3.07 -3.84 2.29 8.00 -0.46 -4.94 116.55 119.98 2wss n ASP 330 Ca -0.05 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.31 2wss n ASP 330 Cb 0.61 0.86 -0.15 0.00 -0.02 0.00 0.00 41.12 42.42 2wss n ASP 330 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wss s ALA 331 N -2.28 0.10 0.01 2.24 0.00 -1.05 0.48 121.76 121.26 2wss s ALA 331 Ca -0.04 0.09 0.07 0.00 0.00 0.00 0.00 51.96 52.08 2wss s ALA 331 Cb 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 2wss s ALA 331 CO 0.33 -0.03 -0.20 0.95 0.00 0.00 0.00 175.76 176.81 2wss s THR 332 N 0.42 1.61 -0.17 0.00 -4.23 0.14 -1.94 115.64 111.47 2wss s THR 332 Ca -0.04 -0.98 0.01 0.00 -1.18 0.00 0.00 61.69 59.50 2wss s THR 332 Cb -0.06 -1.36 0.02 0.00 1.34 0.00 0.00 72.50 72.44 2wss s THR 332 CO -0.01 0.36 -0.17 -0.89 -0.54 0.00 0.00 174.62 173.36 2wss s THR 333 N -0.59 1.85 -0.16 3.99 2.01 0.75 -2.26 115.64 121.23 2wss s THR 333 Ca 0.08 -0.81 -0.03 0.00 0.31 0.00 0.00 61.69 61.23 2wss s THR 333 Cb -0.08 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.71 2wss s THR 333 CO 0.00 0.50 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.69 2wss s VAL 334 N 1.37 3.76 -0.16 3.82 1.01 -1.26 0.08 120.40 129.02 2wss s VAL 334 Ca 0.05 -0.40 -0.05 0.00 0.00 0.00 0.00 61.98 61.58 2wss s VAL 334 Cb -0.13 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 2wss s VAL 334 CO -0.12 0.49 -0.01 -0.76 0.00 0.00 0.00 175.10 174.70 2wss s LEU 335 N 0.50 3.42 -0.11 3.92 1.43 0.60 -0.30 118.68 128.15 2wss s LEU 335 Ca -0.04 -0.07 -0.01 0.00 -1.03 0.00 0.00 54.13 52.99 2wss s LEU 335 Cb -0.14 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 2wss s LEU 335 CO 0.03 0.17 -0.07 -0.94 0.23 0.00 0.00 176.35 175.77 2wss s SER 336 N 0.38 4.60 0.24 2.29 1.04 -0.82 -4.35 113.70 117.07 2wss s SER 336 Ca -0.02 -0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.25 2wss s SER 336 Cb -0.14 -1.43 0.33 0.00 0.10 0.00 0.00 66.02 64.88 2wss s SER 336 CO 0.02 0.27 1.84 -0.09 0.98 0.00 0.00 173.24 176.26 2wss h ARG 337 N 5.93 0.88 -0.78 4.02 2.43 -1.95 -2.12 114.38 122.79 2wss h ARG 337 Ca -0.40 -0.05 0.18 0.00 -0.81 0.00 0.00 59.98 58.90 2wss h ARG 337 Cb 1.18 -0.20 -0.13 0.00 -0.42 0.00 0.00 29.97 30.40 2wss h ARG 337 CO 0.56 0.58 0.03 0.00 -1.51 0.00 0.00 179.97 179.64 2wss h ALA 338 N 1.40 0.85 0.21 2.80 0.00 -1.97 0.25 119.26 122.80 2wss h ALA 338 Ca 0.36 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.51 2wss h ALA 338 Cb 0.19 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2wss h ALA 338 CO -0.18 -0.43 -0.10 0.82 0.00 0.00 0.00 179.25 179.36 2wss h ILE 339 N 0.12 0.68 -1.02 0.00 2.04 -1.79 -3.23 117.51 114.31 2wss h ILE 339 Ca 0.43 -1.01 0.24 0.00 1.00 0.00 0.00 64.86 65.52 2wss h ILE 339 Cb 0.78 1.14 -0.11 0.00 -0.74 0.00 0.00 36.82 37.89 2wss h ILE 339 CO -0.67 0.17 0.62 0.00 0.00 0.00 0.00 178.15 178.28 2wss h ALA 340 N -0.45 1.94 0.00 1.87 0.00 -0.71 0.67 119.26 122.58 2wss h ALA 340 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2wss h ALA 340 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2wss h ALA 340 CO 0.05 -0.37 0.00 0.39 0.00 0.00 0.00 179.25 179.32 2wss n GLU 341 N -4.77 0.12 -0.95 0.00 1.02 0.81 -0.30 120.64 116.57 2wss n GLU 341 Ca 0.26 0.46 -0.02 0.00 -0.02 0.00 0.00 57.16 57.84 2wss n GLU 341 Cb 0.77 -1.77 0.33 0.00 -0.02 0.00 0.00 31.44 30.74 2wss n GLU 341 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2wss n LEU 342 N -2.00 5.81 -0.74 -4.62 4.77 0.23 -4.91 117.00 115.54 2wss n LEU 342 Ca 0.01 -3.16 -0.09 0.00 -0.03 0.00 0.00 56.01 52.74 2wss n LEU 342 Cb 0.13 -0.72 -0.04 0.00 -2.33 0.00 0.00 43.42 40.47 2wss n LEU 342 CO 0.13 0.77 -0.08 0.61 -1.33 0.00 0.00 177.39 177.49 2wss n GLY 343 N -0.03 0.85 3.53 -0.72 0.00 0.59 -4.89 105.19 104.52 2wss n GLY 343 Ca 0.36 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 2wss n GLY 343 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wss s ILE 344 N -1.70 4.22 -0.01 -0.61 -1.09 -1.19 -5.00 121.20 115.83 2wss s ILE 344 Ca 0.00 -1.33 -0.02 0.00 -2.23 0.00 0.00 60.65 57.07 2wss s ILE 344 Cb 0.00 -5.02 -0.04 0.00 -1.58 0.00 0.00 42.46 35.82 2wss s ILE 344 CO 0.00 -1.84 0.14 -0.31 -1.23 0.00 0.00 174.94 171.69 2wss s TYR 345 N 4.06 3.44 0.34 3.97 1.51 -1.26 -3.15 117.35 126.26 2wss s TYR 345 Ca 0.45 0.30 -0.27 0.00 -1.01 0.00 0.00 57.07 56.53 2wss s TYR 345 Cb -0.00 -1.79 -0.09 0.00 -0.11 0.00 0.00 41.96 39.96 2wss s TYR 345 CO -0.05 0.61 1.13 -1.25 -1.11 0.00 0.00 175.55 174.88 2wss s PRO 346 N -1.82 4.34 -0.10 -1.71 0.04 -1.26 -1.94 135.00 132.55 2wss s PRO 346 Ca 0.25 1.80 -0.03 0.00 0.04 0.00 0.00 61.00 63.06 2wss s PRO 346 Cb -0.12 -2.90 -0.11 0.00 0.04 0.00 0.00 34.50 31.41 2wss s PRO 346 CO 0.16 -0.06 1.89 0.00 0.04 0.00 0.00 177.00 179.03 2wss n ALA 347 N 0.57 3.46 -2.70 8.56 0.00 -1.19 -4.89 120.51 124.31 2wss n ALA 347 Ca 0.02 -0.91 -0.40 0.00 0.00 0.00 0.00 53.44 52.15 2wss n ALA 347 Cb 0.46 -2.36 -0.05 0.00 0.00 0.00 0.00 19.45 17.50 2wss n ALA 347 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wss s VAL 348 N 2.33 5.03 -0.45 0.00 1.01 -1.26 -1.95 120.40 125.11 2wss s VAL 348 Ca 0.30 1.42 -0.29 0.00 0.00 0.00 0.00 61.98 63.41 2wss s VAL 348 Cb 0.13 -4.03 0.02 0.00 0.00 0.00 0.00 36.38 32.50 2wss s VAL 348 CO -0.00 0.21 1.34 -0.62 0.00 0.00 0.00 175.10 176.02 2wss s ASP 349 N 0.89 6.39 0.51 3.32 -1.08 0.58 -4.88 116.67 122.39 2wss s ASP 349 Ca 0.36 0.66 0.32 0.00 -0.52 0.00 0.00 52.55 53.37 2wss s ASP 349 Cb -0.17 -2.54 1.29 0.00 -1.46 0.00 0.00 42.92 40.03 2wss s ASP 349 CO 0.16 -1.42 1.94 -0.65 0.52 0.00 0.00 175.17 175.71 2wss h PRO 350 N 10.37 0.00 -0.42 4.34 0.11 -1.92 -1.87 132.00 142.62 2wss h PRO 350 Ca -0.26 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.78 2wss h PRO 350 Cb 1.09 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 2wss h PRO 350 CO 1.11 0.00 0.04 1.28 -0.21 0.00 0.00 178.00 180.22 2wss n LEU 351 N -2.96 4.66 0.00 2.35 4.77 -1.26 -4.40 117.00 120.16 2wss n LEU 351 Ca 0.01 -3.13 0.00 0.00 -0.03 0.00 0.00 56.01 52.86 2wss n LEU 351 Cb 0.30 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 2wss n LEU 351 CO 0.26 0.76 0.00 -0.67 -1.33 0.00 0.00 177.39 176.41 2wss n ASP 352 N -0.33 0.00 -4.78 -1.43 -0.08 -0.94 -5.04 116.55 103.95 2wss n ASP 352 Ca 0.28 0.00 -0.38 0.00 -1.51 0.00 0.00 54.79 53.18 2wss n ASP 352 Cb 1.06 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.46 2wss n ASP 352 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2wss s SER 353 N 0.00 6.80 0.05 1.67 0.01 -0.75 -4.67 113.70 116.81 2wss s SER 353 Ca 0.00 0.95 0.00 0.00 1.31 0.00 0.00 55.95 58.22 2wss s SER 353 Cb 0.00 -2.28 -0.03 0.00 0.21 0.00 0.00 66.02 63.91 2wss s SER 353 CO 0.00 0.19 -0.05 0.42 0.41 0.00 0.00 173.24 174.21 2wss s THR 354 N -0.39 0.33 -0.01 1.44 -4.23 -0.96 -4.81 115.64 107.01 2wss s THR 354 Ca 0.25 -1.42 0.02 0.00 -1.18 0.00 0.00 61.69 59.36 2wss s THR 354 Cb -0.17 -1.00 -0.00 0.00 1.34 0.00 0.00 72.50 72.67 2wss s THR 354 CO 0.13 -0.71 -0.07 -0.55 -0.54 0.00 0.00 174.62 172.88 2wss s SER 355 N -2.25 0.91 0.00 3.99 0.15 -1.26 0.25 113.70 115.49 2wss s SER 355 Ca -0.02 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.49 2wss s SER 355 Cb -0.01 -0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.17 2wss s SER 355 CO -0.04 0.08 0.49 0.54 1.20 0.00 0.00 173.24 175.51 2wss n ARG 356 N 2.97 0.63 0.00 5.44 1.74 0.18 -2.23 116.66 125.39 2wss n ARG 356 Ca -0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2wss n ARG 356 Cb 0.57 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 2wss n ARG 356 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 2wss n ILE 357 N 0.46 0.00 -2.20 0.55 -5.35 -1.26 -4.96 119.36 106.60 2wss n ILE 357 Ca 0.00 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.13 2wss n ILE 357 Cb 0.25 1.03 -0.04 0.00 -1.74 0.00 0.00 39.64 39.13 2wss n ILE 357 CO 0.00 0.00 0.00 -0.32 -1.76 0.00 0.00 176.55 174.47 2wss s MET 358 N 0.00 2.84 -0.30 6.28 1.75 -0.95 -4.48 119.30 124.45 2wss s MET 358 Ca 0.00 -0.12 -0.14 0.00 -1.25 0.00 0.00 55.69 54.18 2wss s MET 358 Cb 0.00 -4.76 0.14 0.00 2.84 0.00 0.00 34.83 33.05 2wss s MET 358 CO 0.00 -2.80 0.83 0.34 -0.65 0.00 0.00 175.02 172.74 2wss s ASP 359 N 6.94 -0.81 0.28 1.11 2.15 -1.26 -5.04 116.67 120.04 2wss s ASP 359 Ca 0.60 1.16 -0.02 0.00 0.43 0.00 0.00 52.55 54.72 2wss s ASP 359 Cb -0.08 1.76 0.41 0.00 -0.30 0.00 0.00 42.92 44.71 2wss s ASP 359 CO 0.07 -0.17 1.92 -0.65 -0.17 0.00 0.00 175.17 176.17 2wss h PRO 360 N 7.34 1.14 -0.00 4.34 0.11 -1.91 0.47 132.00 143.50 2wss h PRO 360 Ca -0.21 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2wss h PRO 360 Cb 1.14 -0.26 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 2wss h PRO 360 CO 0.12 0.76 0.01 -0.91 -0.21 0.00 0.00 178.00 177.77 2wss h ASN 361 N 1.18 0.00 0.00 -2.05 2.35 -1.95 1.01 115.58 116.12 2wss h ASN 361 Ca 0.38 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.89 2wss h ASN 361 Cb 0.03 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.36 2wss h ASN 361 CO -0.12 0.00 -1.90 -0.38 -1.65 0.00 0.00 177.43 173.38 2wss n ILE 362 N -3.21 0.90 0.17 2.81 5.41 0.13 -4.72 119.36 120.85 2wss n ILE 362 Ca -0.03 -0.53 0.02 0.00 1.00 0.00 0.00 62.75 63.21 2wss n ILE 362 Cb 0.09 -0.70 -0.01 0.00 -0.71 0.00 0.00 39.64 38.31 2wss n ILE 362 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2wss n VAL 363 N -2.53 0.00 -0.83 1.39 0.24 0.71 -4.89 118.33 112.42 2wss n VAL 363 Ca -0.22 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.63 2wss n VAL 363 Cb 0.91 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 34.32 2wss n VAL 363 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wss n GLY 364 N 0.74 -2.51 1.01 7.63 0.00 0.35 -4.33 105.19 108.08 2wss n GLY 364 Ca 0.01 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.38 2wss n GLY 364 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wss n SER 365 N 0.00 0.00 -0.13 1.61 3.41 -1.21 0.04 113.62 117.34 2wss n SER 365 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.37 2wss n SER 365 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 2wss n SER 365 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2wss n GLU 366 N 0.98 0.62 0.31 4.33 2.13 -1.26 -4.01 120.64 123.74 2wss n GLU 366 Ca 0.00 0.22 -0.17 0.00 0.66 0.00 0.00 57.16 57.87 2wss n GLU 366 Cb 0.00 -1.52 -0.09 0.00 0.27 0.00 0.00 31.44 30.10 2wss n GLU 366 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2wss h HIS 367 N -0.48 -1.03 -0.19 4.31 2.76 -0.58 -1.10 115.15 118.84 2wss h HIS 367 Ca -0.62 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 57.60 2wss h HIS 367 Cb 1.76 0.38 -0.01 0.00 1.55 0.00 0.00 27.41 31.09 2wss h HIS 367 CO -0.02 -0.57 0.18 -0.92 -1.30 0.00 0.00 177.93 175.31 2wss h TYR 368 N -0.90 0.00 0.14 5.26 3.20 -1.78 -0.87 116.97 122.03 2wss h TYR 368 Ca -0.06 0.00 -0.33 0.00 3.14 0.00 0.00 58.73 61.48 2wss h TYR 368 Cb 0.75 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 2wss h TYR 368 CO -0.14 0.00 -1.68 -0.44 -1.64 0.00 0.00 178.16 174.26 2wss h ASP 369 N 0.00 0.46 -0.24 -2.11 3.45 -1.59 -2.82 116.42 113.57 2wss h ASP 369 Ca 0.09 -0.71 -0.18 0.00 0.43 0.00 0.00 57.03 56.66 2wss h ASP 369 Cb 0.45 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.07 2wss h ASP 369 CO -0.00 1.60 -0.54 0.58 -1.57 0.00 0.00 179.24 179.31 2wss h VAL 370 N 0.08 1.29 0.00 -1.35 2.07 -0.85 -2.38 116.25 115.11 2wss h VAL 370 Ca -0.30 -1.74 0.00 0.00 0.82 0.00 0.00 66.70 65.47 2wss h VAL 370 Cb 2.05 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 33.59 2wss h VAL 370 CO 0.16 0.56 0.00 0.00 0.02 0.00 0.00 177.57 178.30 2wss n ALA 371 N -2.56 -0.04 0.17 1.67 0.00 -0.36 -1.12 120.51 118.27 2wss n ALA 371 Ca -0.05 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.47 2wss n ALA 371 Cb 0.62 0.15 0.46 0.00 0.00 0.00 0.00 19.45 20.69 2wss n ALA 371 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wss h ARG 372 N 0.00 0.00 0.01 0.00 2.47 -1.59 0.32 114.38 115.59 2wss h ARG 372 Ca 0.00 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.63 2wss h ARG 372 Cb 0.00 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.33 2wss h ARG 372 CO 0.00 0.00 -0.37 0.78 0.56 0.00 0.00 179.97 180.94 2wss h GLY 373 N 0.00 0.26 0.86 0.04 0.00 -1.10 -1.92 103.07 101.22 2wss h GLY 373 Ca 0.00 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 46.82 2wss h GLY 373 CO 0.00 0.42 -0.47 -2.08 0.00 0.00 0.00 176.54 174.40 2wss h VAL 374 N -0.42 0.04 -0.05 4.60 2.07 0.11 -2.28 116.25 120.32 2wss h VAL 374 Ca -0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.49 2wss h VAL 374 Cb 1.14 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2wss h VAL 374 CO 0.07 0.00 0.54 1.56 0.02 0.00 0.00 177.57 179.76 2wss h GLN 375 N -1.20 0.00 0.00 1.57 4.20 -0.92 -0.84 115.11 117.92 2wss h GLN 375 Ca -0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.60 2wss h GLN 375 Cb 0.95 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.73 2wss h GLN 375 CO 0.13 0.00 -0.31 -0.22 -0.67 0.00 0.00 178.83 177.76 2wss h LYS 376 N 0.00 0.00 -0.76 1.46 3.64 -1.03 -3.09 116.57 116.79 2wss h LYS 376 Ca 0.03 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.57 2wss h LYS 376 Cb 1.10 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.82 2wss h LYS 376 CO -0.00 0.00 0.25 0.97 -2.27 0.00 0.00 179.45 178.40 2wss h ILE 377 N -0.97 0.56 0.21 2.00 2.10 -0.92 0.10 117.51 120.60 2wss h ILE 377 Ca 0.00 -0.12 0.01 0.00 1.08 0.00 0.00 64.86 65.83 2wss h ILE 377 Cb 0.31 0.18 -0.04 0.00 -1.09 0.00 0.00 36.82 36.18 2wss h ILE 377 CO 0.00 0.06 -0.49 -0.07 -1.08 0.00 0.00 178.15 176.57 2wss h LEU 378 N 0.35 -1.43 0.00 2.19 3.38 -1.34 0.13 115.31 118.59 2wss h LEU 378 Ca 0.43 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.55 2wss h LEU 378 Cb 0.72 0.52 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2wss h LEU 378 CO -0.47 -0.56 0.00 1.67 0.09 0.00 0.00 178.44 179.16 2wss n GLN 379 N -5.50 0.26 -0.06 1.13 -0.06 -0.48 -0.88 117.38 111.79 2wss n GLN 379 Ca -0.09 0.09 -0.22 0.00 -2.00 0.00 0.00 57.00 54.79 2wss n GLN 379 Cb 0.42 -1.50 -0.13 0.00 -4.06 0.00 0.00 30.24 24.97 2wss n GLN 379 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 2wss n ASP 380 N -1.15 2.02 -0.02 1.69 8.00 0.23 -3.69 116.55 123.63 2wss n ASP 380 Ca 0.07 0.21 -0.09 0.00 0.71 0.00 0.00 54.79 55.69 2wss n ASP 380 Cb 0.07 -0.80 -0.02 0.00 -0.02 0.00 0.00 41.12 40.34 2wss n ASP 380 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2wss h TYR 381 N -0.30 -0.59 -0.28 1.24 3.20 0.34 -2.43 116.97 118.14 2wss h TYR 381 Ca -0.47 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.52 2wss h TYR 381 Cb 1.80 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 40.35 2wss h TYR 381 CO 0.06 -0.30 0.27 -0.22 -1.64 0.00 0.00 178.16 176.32 2wss h LYS 382 N -0.26 0.00 0.03 1.82 3.64 -1.16 -0.64 116.57 120.00 2wss h LYS 382 Ca 0.12 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.24 2wss h LYS 382 Cb 0.44 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.28 2wss h LYS 382 CO -0.33 0.00 -1.01 0.77 -2.27 0.00 0.00 179.45 176.61 2wss h SER 383 N 0.00 0.84 0.39 4.20 0.02 -1.51 -2.99 113.55 114.49 2wss h SER 383 Ca 0.13 -0.76 0.00 0.00 -0.84 0.00 0.00 61.79 60.32 2wss h SER 383 Cb 0.67 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2wss h SER 383 CO -0.00 1.50 0.00 -0.07 -1.14 0.00 0.00 176.83 177.12 2wss h LEU 384 N 0.27 0.00 -1.66 5.07 3.38 -1.01 -3.31 115.31 118.05 2wss h LEU 384 Ca -0.13 0.00 0.32 0.00 0.09 0.00 0.00 57.88 58.15 2wss h LEU 384 Cb 1.68 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.38 2wss h LEU 384 CO 0.20 0.00 0.99 -0.61 0.09 0.00 0.00 178.44 179.11 2wss h GLN 385 N 0.00 0.00 0.13 1.13 5.75 -1.26 -1.15 115.11 119.72 2wss h GLN 385 Ca 0.00 0.00 -0.29 0.00 -0.15 0.00 0.00 58.65 58.21 2wss h GLN 385 Cb 0.19 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.75 2wss h GLN 385 CO 0.00 0.00 -1.44 0.22 -2.65 0.00 0.00 178.83 174.96 2wss h ASP 386 N 0.00 0.44 0.54 -0.69 1.82 -1.80 -3.26 116.42 113.47 2wss h ASP 386 Ca 0.52 -0.88 -0.11 0.00 -0.39 0.00 0.00 57.03 56.17 2wss h ASP 386 Cb 2.50 -0.14 -0.02 0.00 0.68 0.00 0.00 39.33 42.35 2wss h ASP 386 CO -0.01 1.64 -0.55 0.40 -1.61 0.00 0.00 179.24 179.12 2wss h ILE 387 N -0.22 1.39 0.00 2.25 5.03 -1.50 -2.65 117.51 121.82 2wss h ILE 387 Ca -0.30 -1.87 -0.03 0.00 -0.12 0.00 0.00 64.86 62.54 2wss h ILE 387 Cb 1.82 2.01 -0.00 0.00 -3.03 0.00 0.00 36.82 37.62 2wss h ILE 387 CO 0.09 0.53 -0.14 0.40 -0.68 0.00 0.00 178.15 178.36 2wss h ILE 388 N 0.00 0.35 0.00 -0.67 2.04 -1.55 -1.71 117.51 115.98 2wss h ILE 388 Ca -0.01 -0.87 -0.18 0.00 1.00 0.00 0.00 64.86 64.80 2wss h ILE 388 Cb 0.97 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.68 2wss h ILE 388 CO 0.07 0.13 -1.39 0.00 0.00 0.00 0.00 178.15 176.97 2wss h ALA 389 N 1.86 0.67 0.00 1.87 0.00 -1.52 -3.19 119.26 118.96 2wss h ALA 389 Ca -0.00 -0.92 -0.38 0.00 0.00 0.00 0.00 54.91 53.62 2wss h ALA 389 Cb 0.65 0.28 -0.07 0.00 0.00 0.00 0.00 17.79 18.65 2wss h ALA 389 CO 0.02 1.01 -2.43 -0.89 0.00 0.00 0.00 179.25 176.96 2wss n ILE 390 N -2.94 1.43 -0.06 0.00 2.08 -1.10 -4.77 119.36 114.01 2wss n ILE 390 Ca -0.10 -0.56 -0.04 0.00 0.56 0.00 0.00 62.75 62.61 2wss n ILE 390 Cb 0.87 -1.35 -0.11 0.00 -0.75 0.00 0.00 39.64 38.30 2wss n ILE 390 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2wss n LEU 391 N -3.21 0.00 0.00 1.39 4.77 -0.65 -5.12 117.00 114.18 2wss n LEU 391 Ca -0.44 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.54 2wss n LEU 391 Cb 0.98 0.27 0.00 0.00 -2.33 0.00 0.00 43.42 42.34 2wss n LEU 391 CO 0.26 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 2wss n GLY 392 N 2.09 2.11 0.35 -0.72 0.00 -1.17 -4.66 105.19 103.19 2wss n GLY 392 Ca -0.18 -2.01 0.02 0.00 0.00 0.00 0.00 46.02 43.85 2wss n GLY 392 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2wss h MET 393 N 0.00 0.89 -0.85 1.61 2.86 -1.89 -2.97 114.93 114.59 2wss h MET 393 Ca 0.00 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2wss h MET 393 Cb 0.00 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.42 2wss h MET 393 CO 0.00 0.59 0.56 -0.44 1.06 0.00 0.00 176.91 178.68 2wss h ASP 394 N 0.92 0.95 0.16 1.22 3.45 -1.97 -0.50 116.42 120.65 2wss h ASP 394 Ca 0.28 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.72 2wss h ASP 394 Cb -0.02 -0.23 0.00 0.00 -0.56 0.00 0.00 39.33 38.52 2wss h ASP 394 CO -0.07 0.68 0.00 -0.62 -1.57 0.00 0.00 179.24 177.66 2wss n GLU 395 N -4.42 0.29 -2.38 3.56 -0.58 -1.12 -4.69 120.64 111.29 2wss n GLU 395 Ca 0.10 0.10 -0.42 0.00 -0.42 0.00 0.00 57.16 56.51 2wss n GLU 395 Cb 0.05 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.39 2wss n GLU 395 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2wss s LEU 396 N -2.35 4.31 0.97 -4.62 1.43 -0.20 -5.01 118.68 113.21 2wss s LEU 396 Ca 0.16 1.95 -0.14 0.00 -1.03 0.00 0.00 54.13 55.07 2wss s LEU 396 Cb 0.09 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.75 2wss s LEU 396 CO 0.19 -0.59 0.14 -1.54 0.23 0.00 0.00 176.35 174.78 2wss n SER 397 N 4.86 -2.82 -0.05 2.29 3.41 -1.26 -4.52 113.62 115.53 2wss n SER 397 Ca 0.11 0.27 -0.11 0.00 -0.26 0.00 0.00 58.87 58.87 2wss n SER 397 Cb 0.45 -1.10 -0.05 0.00 -0.26 0.00 0.00 64.21 63.25 2wss n SER 397 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2wss h GLU 398 N -1.49 0.26 -0.51 4.33 4.57 -1.95 0.14 114.58 119.93 2wss h GLU 398 Ca -0.44 -0.06 0.09 0.00 -1.18 0.00 0.00 59.36 57.77 2wss h GLU 398 Cb 1.29 -0.03 -0.08 0.00 -0.16 0.00 0.00 28.75 29.77 2wss h GLU 398 CO 0.32 0.41 0.05 1.49 -1.18 0.00 0.00 179.01 180.11 2wss h GLU 399 N 0.07 0.17 -0.50 1.92 4.81 -2.00 -2.37 114.58 116.69 2wss h GLU 399 Ca 0.05 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.16 2wss h GLU 399 Cb 0.27 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2wss h GLU 399 CO 0.00 0.11 -0.14 -0.44 -0.73 0.00 0.00 179.01 177.81 2wss h ASP 400 N 0.17 0.98 -0.45 1.04 3.32 -1.72 -1.11 116.42 118.66 2wss h ASP 400 Ca 0.26 -0.37 0.09 0.00 0.02 0.00 0.00 57.03 57.03 2wss h ASP 400 Cb 0.38 -0.27 -0.10 0.00 0.22 0.00 0.00 39.33 39.56 2wss h ASP 400 CO -0.38 1.13 -0.33 0.11 -1.72 0.00 0.00 179.24 178.05 2wss h LYS 401 N 0.83 -0.22 -0.72 3.56 1.57 -0.46 -1.57 116.57 119.57 2wss h LYS 401 Ca 0.12 0.01 0.12 0.00 -1.87 0.00 0.00 60.65 59.04 2wss h LYS 401 Cb 0.71 0.05 -0.09 0.00 0.08 0.00 0.00 32.23 32.98 2wss h LYS 401 CO 0.05 -0.15 0.30 1.25 -0.57 0.00 0.00 179.45 180.33 2wss h LEU 402 N -0.23 0.30 -0.60 2.94 5.85 -0.71 -1.18 115.31 121.69 2wss h LEU 402 Ca 0.19 0.09 -0.13 0.00 0.84 0.00 0.00 57.88 58.87 2wss h LEU 402 Cb 0.54 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 2wss h LEU 402 CO -0.57 0.14 -0.32 0.71 -0.34 0.00 0.00 178.44 178.06 2wss h THR 403 N 0.47 1.28 0.72 1.05 1.35 -0.62 -2.97 112.91 114.19 2wss h THR 403 Ca 0.38 -1.47 -0.03 0.00 -0.55 0.00 0.00 66.41 64.74 2wss h THR 403 Cb 0.52 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 2wss h THR 403 CO -0.36 0.48 -0.40 0.58 -0.25 0.00 0.00 175.52 175.58 2wss h VAL 404 N 0.65 0.19 -0.01 6.82 2.07 -0.53 -0.63 116.25 124.82 2wss h VAL 404 Ca 0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.59 2wss h VAL 404 Cb 0.85 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2wss h VAL 404 CO 0.07 0.00 0.10 0.77 0.02 0.00 0.00 177.57 178.53 2wss h SER 405 N -1.04 0.00 0.04 0.57 4.64 -1.21 0.40 113.55 116.95 2wss h SER 405 Ca -0.09 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.84 2wss h SER 405 Cb 0.82 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.86 2wss h SER 405 CO 0.13 0.00 -2.31 -1.14 -0.87 0.00 0.00 176.83 172.63 2wss n ARG 406 N -3.07 0.68 -0.31 4.77 0.63 -1.13 -3.50 116.66 114.72 2wss n ARG 406 Ca -0.03 0.20 0.10 0.00 -0.92 0.00 0.00 57.85 57.21 2wss n ARG 406 Cb 0.16 -1.58 0.27 0.00 0.45 0.00 0.00 32.46 31.77 2wss n ARG 406 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wss h ALA 407 N -0.05 1.41 -0.04 5.13 0.00 0.27 -1.07 119.26 124.90 2wss h ALA 407 Ca -0.54 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2wss h ALA 407 Cb 1.91 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.71 2wss h ALA 407 CO -0.06 -0.16 0.02 0.00 0.00 0.00 0.00 179.25 179.05 2wss h ARG 408 N 0.59 0.06 -0.83 0.00 3.08 -1.13 0.46 114.38 116.62 2wss h ARG 408 Ca 0.52 -0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.74 2wss h ARG 408 Cb 0.83 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.81 2wss h ARG 408 CO -0.41 0.18 0.55 0.87 -1.07 0.00 0.00 179.97 180.09 2wss h LYS 409 N -0.07 0.35 -0.02 0.04 1.57 -1.35 -0.41 116.57 116.69 2wss h LYS 409 Ca 0.01 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2wss h LYS 409 Cb 0.14 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.38 2wss h LYS 409 CO -0.00 0.23 -0.36 0.82 -0.57 0.00 0.00 179.45 179.57 2wss h ILE 410 N 0.36 1.48 -0.54 1.86 2.04 -0.00 -2.52 117.51 120.19 2wss h ILE 410 Ca 0.42 -1.92 0.16 0.00 1.00 0.00 0.00 64.86 64.51 2wss h ILE 410 Cb 1.07 2.60 -0.02 0.00 -0.74 0.00 0.00 36.82 39.74 2wss h ILE 410 CO -0.13 0.54 0.48 -0.61 0.00 0.00 0.00 178.15 178.43 2wss h GLN 411 N -0.30 0.00 0.00 2.37 4.15 0.15 -0.55 115.11 120.93 2wss h GLN 411 Ca -0.04 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.23 2wss h GLN 411 Cb 1.08 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.74 2wss h GLN 411 CO 0.07 0.00 -1.92 0.54 -1.93 0.00 0.00 178.83 175.59 2wss n ARG 412 N -3.95 0.66 0.09 1.69 1.74 -0.79 -3.93 116.66 112.15 2wss n ARG 412 Ca 0.10 -0.03 -0.04 0.00 -0.77 0.00 0.00 57.85 57.11 2wss n ARG 412 Cb 0.70 -1.60 0.16 0.00 -1.02 0.00 0.00 32.46 30.70 2wss n ARG 412 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2wss h PHE 413 N 0.00 0.30 0.00 -1.55 3.57 -0.65 -2.89 116.94 115.72 2wss h PHE 413 Ca -0.20 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.20 2wss h PHE 413 Cb 1.50 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 40.18 2wss h PHE 413 CO 0.00 0.71 0.00 1.28 -2.23 0.00 0.00 178.31 178.07 2wss n LEU 414 N -3.94 0.48 -4.87 0.59 4.77 -0.95 -4.64 117.00 108.44 2wss n LEU 414 Ca -0.02 0.72 -0.30 0.00 -0.03 0.00 0.00 56.01 56.38 2wss n LEU 414 Cb 0.55 -0.78 -0.01 0.00 -2.33 0.00 0.00 43.42 40.85 2wss n LEU 414 CO 0.43 -0.88 0.60 -0.94 -1.33 0.00 0.00 177.39 175.28 2wss s SER 415 N -3.89 6.38 -0.29 -1.43 1.04 -1.09 -4.13 113.70 110.29 2wss s SER 415 Ca -0.02 1.30 -0.14 0.00 0.48 0.00 0.00 55.95 57.57 2wss s SER 415 Cb 0.05 -2.41 0.11 0.00 0.10 0.00 0.00 66.02 63.88 2wss s SER 415 CO 0.17 -0.66 0.74 -1.58 0.98 0.00 0.00 173.24 172.89 2wss s GLN 416 N -4.59 0.61 -0.27 4.02 0.74 -0.82 -4.28 119.66 115.06 2wss s GLN 416 Ca 0.54 1.18 -0.28 0.00 0.05 0.00 0.00 55.36 56.84 2wss s GLN 416 Cb -0.10 0.34 -0.03 0.00 1.10 0.00 0.00 33.01 34.32 2wss s GLN 416 CO 0.43 -0.15 1.87 -2.14 -0.55 0.00 0.00 175.29 174.75 2wss s PRO 417 N 1.97 3.40 0.29 1.67 0.02 -1.25 -4.52 135.00 136.57 2wss s PRO 417 Ca -0.08 1.66 -0.28 0.00 0.02 0.00 0.00 61.00 62.31 2wss s PRO 417 Cb -0.07 -4.21 -0.09 0.00 0.02 0.00 0.00 34.50 30.15 2wss s PRO 417 CO -0.19 -1.78 0.95 -0.06 -0.33 0.00 0.00 177.00 175.59 2wss s PHE 418 N 6.83 3.81 0.37 6.54 2.99 -1.26 -1.22 117.98 136.04 2wss s PHE 418 Ca 0.84 1.84 0.20 0.00 0.00 0.00 0.00 56.93 59.80 2wss s PHE 418 Cb -0.26 -2.97 1.04 0.00 0.00 0.00 0.00 43.02 40.83 2wss s PHE 418 CO 0.34 0.27 1.93 0.37 -0.00 0.00 0.00 175.22 178.13 2wss h GLN 419 N 3.62 0.00 0.00 0.44 4.15 -1.87 -2.73 115.11 118.73 2wss h GLN 419 Ca -0.46 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.96 2wss h GLN 419 Cb 1.20 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.89 2wss h GLN 419 CO 0.66 0.24 0.00 1.55 -1.93 0.00 0.00 178.83 179.35 2wss n VAL 420 N -3.86 0.13 -3.05 2.39 3.14 -1.26 -3.49 118.33 112.33 2wss n VAL 420 Ca -0.02 0.03 -0.19 0.00 -2.96 0.00 0.00 64.34 61.20 2wss n VAL 420 Cb 0.33 -0.57 -0.02 0.00 -1.06 0.00 0.00 33.84 32.52 2wss n VAL 420 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2wss n ALA 421 N -1.46 2.84 -0.01 1.55 0.00 -1.03 -4.88 120.51 117.52 2wss n ALA 421 Ca 0.08 -3.67 -0.16 0.00 0.00 0.00 0.00 53.44 49.68 2wss n ALA 421 Cb 0.30 -0.87 -0.10 0.00 0.00 0.00 0.00 19.45 18.77 2wss n ALA 421 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2wss h GLU 422 N 2.98 0.38 -0.77 0.00 5.08 -1.59 -3.16 114.58 117.50 2wss h GLU 422 Ca 0.09 -0.36 0.28 0.00 -1.00 0.00 0.00 59.36 58.37 2wss h GLU 422 Cb 0.90 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 30.10 2wss h GLU 422 CO 0.58 1.03 0.27 0.28 -1.00 0.00 0.00 179.01 180.16 2wss n VAL 423 N -4.31 -0.32 -0.05 3.13 0.31 -1.26 -0.24 118.33 115.60 2wss n VAL 423 Ca -0.09 1.61 -0.09 0.00 -0.01 0.00 0.00 64.34 65.75 2wss n VAL 423 Cb 0.60 -2.51 -0.15 0.00 -0.91 0.00 0.00 33.84 30.88 2wss n VAL 423 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2wss n PHE 424 N -4.86 0.69 0.07 3.52 3.01 -1.23 -4.15 117.46 114.51 2wss n PHE 424 Ca 0.25 0.25 -0.21 0.00 1.01 0.00 0.00 57.45 58.75 2wss n PHE 424 Cb 0.84 -1.13 -0.15 0.00 -0.01 0.00 0.00 39.48 39.04 2wss n PHE 424 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 2wss h THR 425 N 0.00 0.97 0.00 4.37 1.35 -1.21 -3.47 112.91 114.92 2wss h THR 425 Ca -0.37 -2.58 0.00 0.00 -0.55 0.00 0.00 66.41 62.92 2wss h THR 425 Cb 2.08 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 71.24 2wss h THR 425 CO 0.06 0.84 0.00 0.61 -0.25 0.00 0.00 175.52 176.79 2wss n GLY 426 N 1.81 2.36 3.78 5.82 0.00 0.67 -5.01 105.19 114.62 2wss n GLY 426 Ca -0.23 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 44.91 2wss n GLY 426 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wss s HIS 427 N -0.71 2.95 0.45 1.61 3.76 -1.26 -4.95 115.29 117.14 2wss s HIS 427 Ca 0.00 1.57 -0.19 0.00 -0.15 0.00 0.00 55.06 56.29 2wss s HIS 427 Cb 0.00 -3.24 -0.10 0.00 1.11 0.00 0.00 32.58 30.35 2wss s HIS 427 CO 0.00 -1.18 0.95 -0.51 -0.85 0.00 0.00 174.74 173.16 2wss s LEU 428 N -3.20 3.85 0.49 0.89 1.43 -1.26 -4.59 118.68 116.28 2wss s LEU 428 Ca 0.65 1.63 -0.22 0.00 -1.03 0.00 0.00 54.13 55.16 2wss s LEU 428 Cb -0.23 -4.51 -0.08 0.00 0.03 0.00 0.00 46.19 41.39 2wss s LEU 428 CO 0.28 -0.43 1.04 0.61 0.23 0.00 0.00 176.35 178.09 2wss n GLY 429 N -0.93 -0.10 3.36 -3.19 0.00 -1.26 -4.78 105.19 98.29 2wss n GLY 429 Ca 0.07 0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2wss n GLY 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wss s LYS 430 N -2.32 1.34 -0.23 1.61 -0.14 -0.36 -4.80 119.74 114.85 2wss s LYS 430 Ca 0.67 -1.39 -0.03 0.00 -1.36 0.00 0.00 55.97 53.86 2wss s LYS 430 Cb -0.49 -1.58 0.07 0.00 -1.68 0.00 0.00 37.83 34.15 2wss s LYS 430 CO 0.54 0.34 0.07 -1.17 -0.76 0.00 0.00 175.35 174.37 2wss s LEU 431 N -2.45 1.14 -0.19 3.17 0.20 -1.26 -4.75 118.68 114.53 2wss s LEU 431 Ca 0.15 -1.01 -0.12 0.00 0.69 0.00 0.00 54.13 53.84 2wss s LEU 431 Cb -0.08 -0.55 -0.05 0.00 -0.43 0.00 0.00 46.19 45.09 2wss s LEU 431 CO 0.07 -0.35 0.21 -0.69 -0.29 0.00 0.00 176.35 175.29 2wss s VAL 432 N 1.90 5.36 0.49 1.68 1.01 -1.04 -4.94 120.40 124.86 2wss s VAL 432 Ca 0.03 0.34 -0.18 0.00 0.00 0.00 0.00 61.98 62.17 2wss s VAL 432 Cb -0.17 -3.55 -0.09 0.00 0.00 0.00 0.00 36.38 32.58 2wss s VAL 432 CO -0.16 0.40 0.99 -2.84 0.00 0.00 0.00 175.10 173.48 2wss s PRO 433 N 0.55 3.97 0.34 2.72 0.02 -1.26 -4.10 135.00 137.24 2wss s PRO 433 Ca 0.11 1.08 0.10 0.00 0.02 0.00 0.00 61.00 62.31 2wss s PRO 433 Cb -0.12 -2.14 0.86 0.00 0.02 0.00 0.00 34.50 33.12 2wss s PRO 433 CO 0.01 -0.26 1.80 1.25 -0.33 0.00 0.00 177.00 179.48 2wss h LEU 434 N 1.28 0.66 -0.55 -5.54 6.46 -1.98 -0.21 115.31 115.42 2wss h LEU 434 Ca -0.48 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.36 2wss h LEU 434 Cb 1.19 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 41.08 2wss h LEU 434 CO 0.61 0.24 0.00 0.11 -0.62 0.00 0.00 178.44 178.77 2wss h LYS 435 N 0.64 0.00 0.00 1.25 1.79 -2.00 -2.02 116.57 116.22 2wss h LYS 435 Ca 0.55 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.81 2wss h LYS 435 Cb 1.01 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.62 2wss h LYS 435 CO -0.31 0.00 -2.12 0.39 -1.08 0.00 0.00 179.45 176.33 2wss n GLU 436 N -2.46 0.67 -0.20 3.15 1.02 -0.16 -3.39 120.64 119.27 2wss n GLU 436 Ca 0.03 -0.05 -0.09 0.00 -0.02 0.00 0.00 57.16 57.03 2wss n GLU 436 Cb 0.33 -1.56 0.02 0.00 -0.02 0.00 0.00 31.44 30.21 2wss n GLU 436 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2wss h THR 437 N 0.00 1.26 -0.09 2.62 2.02 -1.02 -1.40 112.91 116.30 2wss h THR 437 Ca -0.29 -1.01 -0.01 0.00 0.77 0.00 0.00 66.41 65.87 2wss h THR 437 Cb 1.69 0.79 -0.00 0.00 -1.74 0.00 0.00 68.15 68.89 2wss h THR 437 CO 0.02 0.37 0.02 0.40 0.37 0.00 0.00 175.52 176.70 2wss h ILE 438 N 0.86 1.20 0.01 3.11 1.08 -1.54 -3.14 117.51 119.09 2wss h ILE 438 Ca 0.17 -0.61 0.03 0.00 -0.39 0.00 0.00 64.86 64.06 2wss h ILE 438 Cb 0.44 1.43 -0.05 0.00 -3.07 0.00 0.00 36.82 35.56 2wss h ILE 438 CO 0.01 0.17 -0.47 0.50 -0.69 0.00 0.00 178.15 177.68 2wss h LYS 439 N -0.07 -0.61 -0.57 2.37 3.64 -1.54 -0.19 116.57 119.61 2wss h LYS 439 Ca 0.03 0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.52 2wss h LYS 439 Cb 0.25 0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 32.11 2wss h LYS 439 CO 0.00 -0.40 -0.51 0.78 -2.27 0.00 0.00 179.45 177.04 2wss h GLY 440 N -0.63 -0.76 0.84 5.01 0.00 -1.23 -1.93 103.07 104.37 2wss h GLY 440 Ca 0.03 0.67 -0.06 0.00 0.00 0.00 0.00 47.33 47.97 2wss h GLY 440 CO -0.33 -0.11 -0.08 0.74 0.00 0.00 0.00 176.54 176.76 2wss h PHE 441 N -0.27 0.54 -0.97 5.60 -1.00 -1.43 -1.16 116.94 118.24 2wss h PHE 441 Ca 0.13 -0.12 0.31 0.00 2.81 0.00 0.00 57.97 61.10 2wss h PHE 441 Cb 0.56 -0.13 -0.17 0.00 3.61 0.00 0.00 35.95 39.82 2wss h PHE 441 CO -0.77 0.72 0.27 0.37 -1.61 0.00 0.00 178.31 177.29 2wss h GLN 442 N 0.21 0.07 0.02 1.51 5.75 -0.31 0.12 115.11 122.47 2wss h GLN 442 Ca 0.06 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 2wss h GLN 442 Cb 0.56 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.10 2wss h GLN 442 CO 0.03 0.05 -0.01 1.96 -2.65 0.00 0.00 178.83 178.21 2wss h GLN 443 N 0.07 -0.02 -0.93 1.69 4.20 -0.82 -2.40 115.11 116.91 2wss h GLN 443 Ca 0.67 0.00 0.15 0.00 0.06 0.00 0.00 58.65 59.54 2wss h GLN 443 Cb 1.55 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 29.23 2wss h GLN 443 CO -0.80 0.61 0.53 0.82 -0.67 0.00 0.00 178.83 179.32 2wss h ILE 444 N -0.67 0.76 0.00 2.54 2.04 0.25 0.71 117.51 123.15 2wss h ILE 444 Ca -0.00 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 2wss h ILE 444 Cb 0.64 -0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2wss h ILE 444 CO 0.00 0.14 -0.10 -0.07 0.00 0.00 0.00 178.15 178.12 2wss h LEU 445 N 0.74 0.00 -0.36 1.44 3.38 -0.88 -2.61 115.31 117.02 2wss h LEU 445 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.47 2wss h LEU 445 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2wss h LEU 445 CO -0.35 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.28 2wss h ALA 446 N 1.90 1.00 0.00 1.53 0.00 0.95 -3.46 119.26 121.18 2wss h ALA 446 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wss h ALA 446 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2wss h ALA 446 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2wss n GLY 447 N 0.83 0.70 0.08 0.00 0.00 -0.86 -4.89 105.19 101.06 2wss n GLY 447 Ca 0.04 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.11 2wss n GLY 447 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wss n GLU 448 N -2.52 0.06 0.00 1.61 1.02 -1.12 -1.84 120.64 117.85 2wss n GLU 448 Ca 0.00 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.67 2wss n GLU 448 Cb 0.00 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 29.65 2wss n GLU 448 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2wss n TYR 449 N -1.83 0.00 -0.42 -0.32 0.53 -1.26 -4.78 117.16 109.08 2wss n TYR 449 Ca -0.01 -0.16 0.36 0.00 -1.02 0.00 0.00 57.90 57.07 2wss n TYR 449 Cb 0.08 -0.02 0.68 0.00 -1.03 0.00 0.00 39.34 39.05 2wss n TYR 449 CO 0.00 0.00 0.00 -0.44 -1.02 0.00 0.00 176.86 175.40 2wss h ASP 450 N 0.00 0.17 0.88 7.72 3.32 -1.67 0.15 116.42 126.99 2wss h ASP 450 Ca 0.00 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 2wss h ASP 450 Cb 0.53 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 2wss h ASP 450 CO 0.00 -0.03 -0.30 1.12 -1.72 0.00 0.00 179.24 178.31 2wss h HIS 451 N 0.11 0.00 -3.36 4.55 2.07 -1.86 -3.46 115.15 113.20 2wss h HIS 451 Ca 0.71 0.00 -0.42 0.00 -2.85 0.00 0.00 60.37 57.81 2wss h HIS 451 Cb 2.44 0.00 0.20 0.00 2.57 0.00 0.00 27.41 32.61 2wss h HIS 451 CO -0.00 0.30 0.04 -0.51 -3.07 0.00 0.00 177.93 174.68 2wss s LEU 452 N -6.94 0.32 -0.13 6.12 1.43 0.53 -5.06 118.68 114.95 2wss s LEU 452 Ca 0.00 0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 54.08 2wss s LEU 452 Cb 0.11 -2.74 -0.02 0.00 0.03 0.00 0.00 46.19 43.57 2wss s LEU 452 CO 0.66 -4.36 -0.10 -2.16 0.23 0.00 0.00 176.35 170.62 2wss s PRO 453 N -5.01 3.43 0.09 1.29 0.05 -1.26 -5.03 135.00 128.55 2wss s PRO 453 Ca 0.69 -0.63 -0.17 0.00 0.05 0.00 0.00 61.00 60.94 2wss s PRO 453 Cb -0.16 -2.71 -0.04 0.00 0.05 0.00 0.00 34.50 31.65 2wss s PRO 453 CO 0.59 0.25 0.83 0.39 0.05 0.00 0.00 177.00 179.11 2wss n GLU 454 N 3.45 -0.24 0.07 4.56 1.02 -1.26 0.55 120.64 128.80 2wss n GLU 454 Ca -0.18 0.81 0.05 0.00 -0.02 0.00 0.00 57.16 57.82 2wss n GLU 454 Cb 0.53 -1.19 0.26 0.00 -0.02 0.00 0.00 31.44 31.01 2wss n GLU 454 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wss n GLN 455 N -4.67 0.06 0.01 3.49 0.00 -1.26 -1.35 117.38 113.66 2wss n GLN 455 Ca 0.01 0.55 -0.02 0.00 0.00 0.00 0.00 57.00 57.54 2wss n GLN 455 Cb 0.14 -1.72 0.23 0.00 0.00 0.00 0.00 30.24 28.89 2wss n GLN 455 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2wss h ALA 456 N 1.94 1.19 0.00 2.61 0.00 -0.22 -2.99 119.26 121.79 2wss h ALA 456 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2wss h ALA 456 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2wss h ALA 456 CO 0.00 0.52 -0.76 1.19 0.00 0.00 0.00 179.25 180.20 2wss n PHE 457 N -4.17 0.37 -2.19 0.00 3.01 -0.46 -4.39 117.46 109.64 2wss n PHE 457 Ca 0.00 0.11 -0.42 0.00 1.01 0.00 0.00 57.45 58.15 2wss n PHE 457 Cb 0.35 -0.52 -0.03 0.00 -0.01 0.00 0.00 39.48 39.28 2wss n PHE 457 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 2wss s TYR 458 N -3.16 2.39 -1.10 1.38 5.04 -1.13 -3.73 117.35 117.04 2wss s TYR 458 Ca 0.06 0.56 -0.05 0.00 -2.44 0.00 0.00 57.07 55.20 2wss s TYR 458 Cb 0.14 -3.74 -0.05 0.00 0.35 0.00 0.00 41.96 38.67 2wss s TYR 458 CO 0.75 -2.90 0.93 -1.33 -1.34 0.00 0.00 175.55 171.65 2wss n MET 459 N 6.77 -3.34 0.00 4.97 2.81 -1.24 -5.04 117.12 122.05 2wss n MET 459 Ca 0.16 0.84 0.00 0.00 -1.81 0.00 0.00 57.70 56.88 2wss n MET 459 Cb 0.44 -5.74 0.00 0.00 -0.71 0.00 0.00 33.22 27.21 2wss n MET 459 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2wss n VAL 460 N -3.53 0.00 0.00 2.03 0.24 -1.25 -4.72 118.33 111.10 2wss n VAL 460 Ca -0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 2wss n VAL 460 Cb 0.63 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 2wss n VAL 460 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wss n GLY 461 N 4.68 1.69 3.66 7.63 0.00 -1.26 -3.91 105.19 117.68 2wss n GLY 461 Ca 0.00 -0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 2wss n GLY 461 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wss n PRO 462 N 0.00 1.85 -0.13 1.61 -0.02 -1.26 -4.83 135.00 132.21 2wss n PRO 462 Ca 0.00 0.65 0.26 0.00 -2.02 0.00 0.00 63.50 62.39 2wss n PRO 462 Cb 0.00 -2.20 0.53 0.00 -0.02 0.00 0.00 33.50 31.80 2wss n PRO 462 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2wss h ILE 463 N 2.60 0.10 -0.05 4.25 6.09 -1.96 -1.96 117.51 126.57 2wss h ILE 463 Ca -0.44 0.00 -0.14 0.00 -1.37 0.00 0.00 64.86 62.91 2wss h ILE 463 Cb 1.30 0.18 0.01 0.00 0.47 0.00 0.00 36.82 38.78 2wss h ILE 463 CO 0.67 0.00 -0.52 -0.33 -3.07 0.00 0.00 178.15 174.90 2wss h GLU 464 N 0.00 0.43 -0.17 2.19 3.07 -1.98 -3.14 114.58 114.98 2wss h GLU 464 Ca 0.42 -0.40 0.05 0.00 -0.50 0.00 0.00 59.36 58.92 2wss h GLU 464 Cb 2.44 0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 30.44 2wss h GLU 464 CO -0.00 1.05 0.49 0.93 -1.40 0.00 0.00 179.01 180.08 2wss h GLU 465 N -0.04 0.00 -0.10 2.33 5.08 -1.71 1.30 114.58 121.44 2wss h GLU 465 Ca -0.05 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.08 2wss h GLU 465 Cb 1.20 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.46 2wss h GLU 465 CO 0.10 0.00 -0.84 0.00 -1.00 0.00 0.00 179.01 177.27 2wss h ALA 466 N 1.19 0.32 -0.17 3.43 0.00 -1.68 -0.88 119.26 121.47 2wss h ALA 466 Ca 0.08 -0.63 -0.20 0.00 0.00 0.00 0.00 54.91 54.16 2wss h ALA 466 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2wss h ALA 466 CO -0.00 0.71 -0.70 0.28 0.00 0.00 0.00 179.25 179.53 2wss h VAL 467 N 0.45 1.30 0.19 0.00 2.07 0.15 -1.54 116.25 118.87 2wss h VAL 467 Ca -0.07 -1.93 0.00 0.00 0.82 0.00 0.00 66.70 65.52 2wss h VAL 467 Cb 1.47 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 33.11 2wss h VAL 467 CO 0.17 0.61 -0.44 0.00 0.02 0.00 0.00 177.57 177.93 2wss h ALA 468 N 0.68 -0.97 -0.29 1.67 0.00 -1.24 -2.75 119.26 116.36 2wss h ALA 468 Ca -0.03 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 54.85 2wss h ALA 468 Cb 1.31 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 19.87 2wss h ALA 468 CO 0.14 -1.06 0.32 -0.22 0.00 0.00 0.00 179.25 178.44 2wss h LYS 469 N -0.69 0.00 0.00 0.00 3.64 -1.09 0.83 116.57 119.26 2wss h LYS 469 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2wss h LYS 469 Cb 0.66 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 2wss h LYS 469 CO -0.19 0.00 -0.11 0.00 -2.27 0.00 0.00 179.45 176.89 2wss h ALA 470 N 1.62 0.94 0.00 5.00 0.00 -1.06 -2.53 119.26 123.23 2wss h ALA 470 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2wss h ALA 470 Cb 0.78 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2wss h ALA 470 CO -0.00 0.00 -0.27 -0.44 0.00 0.00 0.00 179.25 178.54 2wss h ASP 471 N 0.00 0.00 -0.03 0.00 3.45 0.91 -3.35 116.42 117.40 2wss h ASP 471 Ca 0.00 -0.15 0.01 0.00 0.43 0.00 0.00 57.03 57.32 2wss h ASP 471 Cb 0.84 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.61 2wss h ASP 471 CO 0.00 0.72 0.19 0.50 -1.57 0.00 0.00 179.24 179.08 2wss h LYS 472 N -1.00 0.00 -1.71 3.56 3.64 -1.27 2.40 116.57 122.20 2wss h LYS 472 Ca -0.03 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.13 2wss h LYS 472 Cb 0.38 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.11 2wss h LYS 472 CO -0.02 0.00 0.26 1.28 -2.27 0.00 0.00 179.45 178.70 2wss n LEU 473 N -3.10 6.09 0.00 5.20 4.77 -0.95 -5.09 117.00 123.92 2wss n LEU 473 Ca -0.02 -3.06 0.00 0.00 -0.03 0.00 0.00 56.01 52.90 2wss n LEU 473 Cb 0.26 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.25 2wss n LEU 473 CO 0.18 1.20 0.00 0.00 -1.33 0.00 0.00 177.39 177.44