#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mls s VAL 2 N 0.00 3.65 0.08 6.31 1.01 -1.25 -4.10 120.40 126.10 3mls s VAL 2 Ca 0.00 0.92 -0.27 0.00 0.00 0.00 0.00 61.98 62.64 3mls s VAL 2 Cb 0.00 -3.59 0.08 0.00 0.00 0.00 0.00 36.38 32.87 3mls s VAL 2 CO 0.00 -0.04 0.90 0.00 0.00 0.00 0.00 175.10 175.95 3mls s GLN 3 N 3.23 1.03 -0.20 2.72 -2.07 -0.21 -4.99 119.66 119.17 3mls s GLN 3 Ca 0.68 -0.48 0.01 0.00 -1.82 0.00 0.00 55.36 53.75 3mls s GLN 3 Cb -0.32 0.41 0.05 0.00 -1.09 0.00 0.00 33.01 32.05 3mls s GLN 3 CO 0.27 -0.46 -0.09 -0.51 -1.32 0.00 0.00 175.29 173.18 3mls s LEU 4 N -2.70 2.21 -0.23 2.60 1.43 -1.26 -1.26 118.68 119.47 3mls s LEU 4 Ca 0.08 -0.90 -0.06 0.00 -1.03 0.00 0.00 54.13 52.22 3mls s LEU 4 Cb -0.01 -1.17 -0.02 0.00 0.03 0.00 0.00 46.19 45.02 3mls s LEU 4 CO -0.04 -0.17 0.03 -0.69 0.23 0.00 0.00 176.35 175.71 3mls s VAL 5 N 1.44 4.02 0.30 -1.59 1.01 -0.03 -3.90 120.40 121.64 3mls s VAL 5 Ca -0.02 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.70 3mls s VAL 5 Cb -0.16 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 3mls s VAL 5 CO -0.08 0.38 0.48 -1.61 0.00 0.00 0.00 175.10 174.27 3mls s GLU 6 N 1.47 3.48 0.87 2.72 2.02 -1.26 -0.87 118.70 127.14 3mls s GLU 6 Ca 0.05 -0.43 -0.11 0.00 0.02 0.00 0.00 54.97 54.51 3mls s GLU 6 Cb -0.15 -2.74 0.12 0.00 0.10 0.00 0.00 34.13 31.46 3mls s GLU 6 CO 0.01 0.26 1.10 -1.54 0.02 0.00 0.00 175.26 175.11 3mls s SER 7 N -3.86 3.53 0.93 -0.19 1.04 -0.41 -4.98 113.70 109.76 3mls s SER 7 Ca 0.38 1.80 -0.11 0.00 0.48 0.00 0.00 55.95 58.50 3mls s SER 7 Cb -0.10 -2.42 0.15 0.00 0.10 0.00 0.00 66.02 63.75 3mls s SER 7 CO 0.33 -2.65 1.09 -0.83 0.98 0.00 0.00 173.24 172.16 3mls s GLY 8 N -3.15 1.62 0.60 7.32 0.00 -1.26 -4.59 107.32 107.86 3mls s GLY 8 Ca 0.64 0.03 -0.11 0.00 0.00 0.00 0.00 44.72 45.28 3mls s GLY 8 CO 0.57 0.54 1.01 -0.32 0.00 0.00 0.00 173.10 174.90 3mls s GLY 9 N -3.19 1.71 0.04 0.20 0.00 -1.26 -4.76 107.32 100.06 3mls s GLY 9 Ca 0.64 -0.08 -0.08 0.00 0.00 0.00 0.00 44.72 45.21 3mls s GLY 9 CO 0.58 0.18 0.15 -0.54 0.00 0.00 0.00 173.10 173.48 3mls s GLU 10 N -4.99 0.66 -0.18 2.90 2.02 -0.81 -4.96 118.70 113.34 3mls s GLU 10 Ca 0.55 -0.71 -0.03 0.00 0.02 0.00 0.00 54.97 54.80 3mls s GLU 10 Cb -0.11 0.27 -0.02 0.00 0.10 0.00 0.00 34.13 34.37 3mls s GLU 10 CO 0.50 -0.18 -0.05 0.08 0.02 0.00 0.00 175.26 175.63 3mls s VAL 11 N -2.69 3.54 0.23 2.63 1.01 -1.26 -2.37 120.40 121.50 3mls s VAL 11 Ca -0.04 -0.46 0.09 0.00 0.00 0.00 0.00 61.98 61.56 3mls s VAL 11 Cb -0.01 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 3mls s VAL 11 CO -0.05 0.46 -0.15 -0.54 0.00 0.00 0.00 175.10 174.83 3mls s LYS 12 N 0.91 1.45 0.18 2.72 1.02 -0.86 -4.94 119.74 120.22 3mls s LYS 12 Ca -0.01 -1.66 -0.10 0.00 0.02 0.00 0.00 55.97 54.22 3mls s LYS 12 Cb -0.15 -1.29 -0.07 0.00 -0.52 0.00 0.00 37.83 35.81 3mls s LYS 12 CO 0.01 0.20 0.50 -0.65 -0.92 0.00 0.00 175.35 174.49 3mls s GLN 13 N -3.62 3.80 0.30 1.68 -0.21 -1.24 0.50 119.66 120.87 3mls s GLN 13 Ca 0.25 0.24 -0.30 0.00 0.02 0.00 0.00 55.36 55.57 3mls s GLN 13 Cb -0.01 -2.77 -0.12 0.00 1.00 0.00 0.00 33.01 31.10 3mls s GLN 13 CO 0.10 0.40 1.44 -2.30 -2.12 0.00 0.00 175.29 172.81 3mls n PRO 14 N 0.19 2.35 -0.01 2.91 -0.02 -1.26 -2.08 135.00 137.08 3mls n PRO 14 Ca -0.02 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3mls n PRO 14 Cb 0.52 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 3mls n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mls n GLY 15 N 1.54 0.38 3.90 -1.23 0.00 0.30 -4.93 105.19 105.15 3mls n GLY 15 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 3mls n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3mls s GLN 16 N -0.88 3.63 0.38 1.61 -0.21 -0.88 -4.46 119.66 118.85 3mls s GLN 16 Ca 0.00 0.26 -0.04 0.00 0.02 0.00 0.00 55.36 55.60 3mls s GLN 16 Cb 0.00 -2.41 -0.04 0.00 1.00 0.00 0.00 33.01 31.55 3mls s GLN 16 CO 0.00 -0.10 0.65 -1.54 -2.12 0.00 0.00 175.29 172.18 3mls s SER 17 N -3.69 6.35 -0.01 5.90 1.04 -1.26 -0.45 113.70 121.57 3mls s SER 17 Ca 0.48 0.74 -0.11 0.00 0.48 0.00 0.00 55.95 57.54 3mls s SER 17 Cb -0.10 -2.16 0.01 0.00 0.10 0.00 0.00 66.02 63.87 3mls s SER 17 CO 0.39 -0.37 0.24 -0.22 0.98 0.00 0.00 173.24 174.26 3mls s LEU 18 N -4.19 1.14 -0.06 2.42 2.96 -0.81 -4.95 118.68 115.18 3mls s LEU 18 Ca 0.45 0.00 -0.02 0.00 -0.22 0.00 0.00 54.13 54.34 3mls s LEU 18 Cb -0.10 1.01 0.03 0.00 0.50 0.00 0.00 46.19 47.63 3mls s LEU 18 CO 0.37 -0.39 0.05 -0.75 -1.32 0.00 0.00 176.35 174.30 3mls s LYS 19 N -1.25 0.12 0.11 1.98 2.20 -1.26 -1.46 119.74 120.18 3mls s LYS 19 Ca -0.13 0.27 0.09 0.00 -0.36 0.00 0.00 55.97 55.84 3mls s LYS 19 Cb -0.06 -0.73 -0.04 0.00 -1.51 0.00 0.00 37.83 35.49 3mls s LYS 19 CO 0.03 -0.35 -0.20 0.96 -0.36 0.00 0.00 175.35 175.43 3mls s ILE 20 N 2.11 2.68 0.27 5.43 -4.36 -0.60 -4.98 121.20 121.75 3mls s ILE 20 Ca 0.05 -1.55 0.08 0.00 -0.26 0.00 0.00 60.65 58.97 3mls s ILE 20 Cb -0.12 -2.21 -0.05 0.00 1.25 0.00 0.00 42.46 41.32 3mls s ILE 20 CO -0.04 0.11 -0.11 -0.94 0.24 0.00 0.00 174.94 174.21 3mls s SER 21 N -2.07 2.94 -0.14 4.36 1.04 -1.26 -1.97 113.70 116.60 3mls s SER 21 Ca 0.17 -1.12 -0.04 0.00 0.48 0.00 0.00 55.95 55.44 3mls s SER 21 Cb -0.10 -0.20 0.06 0.00 0.10 0.00 0.00 66.02 65.88 3mls s SER 21 CO 0.09 -0.22 0.15 0.00 0.98 0.00 0.00 173.24 174.23 3mls s LYS 23 N 2.25 3.76 0.36 0.00 2.20 -0.05 -0.15 119.74 128.10 3mls s LYS 23 Ca 0.04 -0.46 -0.06 0.00 -0.36 0.00 0.00 55.97 55.13 3mls s LYS 23 Cb -0.14 -3.08 -0.05 0.00 -1.51 0.00 0.00 37.83 33.04 3mls s LYS 23 CO -0.08 0.17 0.66 -1.54 -0.36 0.00 0.00 175.35 174.20 3mls s SER 24 N 0.60 6.43 -0.14 1.43 1.04 -0.67 -0.85 113.70 121.54 3mls s SER 24 Ca 0.00 0.87 -0.18 0.00 0.48 0.00 0.00 55.95 57.12 3mls s SER 24 Cb -0.14 -2.21 0.05 0.00 0.10 0.00 0.00 66.02 63.82 3mls s SER 24 CO 0.02 -0.33 0.48 -0.44 0.98 0.00 0.00 173.24 173.95 3mls s SER 25 N -3.37 -0.47 0.00 7.02 0.01 -0.39 -4.93 113.70 111.58 3mls s SER 25 Ca 0.47 0.81 0.00 0.00 1.31 0.00 0.00 55.95 58.54 3mls s SER 25 Cb -0.10 0.84 0.00 0.00 0.21 0.00 0.00 66.02 66.96 3mls s SER 25 CO 0.33 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.33 3mls n GLY 26 N 2.38 0.75 3.88 3.44 0.00 -1.26 -1.04 105.19 113.34 3mls n GLY 26 Ca -0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 3mls n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mls s TYR 27 N -2.29 0.10 -0.85 1.61 -0.85 -1.26 -4.68 117.35 109.13 3mls s TYR 27 Ca 0.00 -0.57 -0.25 0.00 -0.52 0.00 0.00 57.07 55.73 3mls s TYR 27 Cb 0.00 0.74 0.04 0.00 0.38 0.00 0.00 41.96 43.12 3mls s TYR 27 CO 0.00 -1.07 1.34 1.21 -1.52 0.00 0.00 175.55 175.52 3mls s ASN 28 N -3.39 6.30 0.43 -0.18 3.84 -1.26 -4.86 114.94 115.82 3mls s ASN 28 Ca 0.22 -0.87 0.21 0.00 0.21 0.00 0.00 52.86 52.62 3mls s ASN 28 Cb -0.03 -2.56 1.17 0.00 -0.55 0.00 0.00 41.25 39.28 3mls s ASN 28 CO 0.07 -1.69 1.81 0.15 -2.79 0.00 0.00 177.10 174.64 3mls h PHE 29 N 9.92 0.51 -0.29 0.43 3.57 -1.97 -2.59 116.94 126.52 3mls h PHE 29 Ca -0.08 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.31 3mls h PHE 29 Cb 1.03 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 3mls h PHE 29 CO 1.19 0.08 -0.32 -0.07 -2.23 0.00 0.00 178.31 176.95 3mls h LEU 30 N 0.33 0.65 -0.07 0.59 4.07 -1.91 -3.30 115.31 115.67 3mls h LEU 30 Ca 0.54 -0.26 0.00 0.00 0.08 0.00 0.00 57.88 58.24 3mls h LEU 30 Cb 1.50 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 43.06 3mls h LEU 30 CO -0.21 0.92 -0.07 0.47 -1.08 0.00 0.00 178.44 178.47 3mls n ASP 31 N -4.07 0.18 -4.25 -0.43 10.43 -0.97 -2.27 116.55 115.17 3mls n ASP 31 Ca -0.01 -0.14 -0.31 0.00 2.57 0.00 0.00 54.79 56.90 3mls n ASP 31 Cb 0.47 -0.22 -0.17 0.00 1.84 0.00 0.00 41.12 43.04 3mls n ASP 31 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3mls s SER 32 N -2.67 3.03 0.56 -2.24 0.01 -1.24 -5.05 113.70 106.10 3mls s SER 32 Ca 0.24 -0.52 -0.21 0.00 1.31 0.00 0.00 55.95 56.77 3mls s SER 32 Cb 0.20 -1.02 -0.04 0.00 0.21 0.00 0.00 66.02 65.37 3mls s SER 32 CO 0.50 0.21 1.35 0.79 0.41 0.00 0.00 173.24 176.51 3mls n TRP 33 N 3.14 2.27 -4.42 2.43 7.02 -1.26 -4.37 117.44 122.25 3mls n TRP 33 Ca -0.18 0.43 -0.32 0.00 -1.02 0.00 0.00 57.50 56.41 3mls n TRP 33 Cb 0.52 -2.35 -0.16 0.00 -2.42 0.00 0.00 31.31 26.90 3mls n TRP 33 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3mls s ILE 34 N -1.30 1.90 0.23 -0.99 1.01 -0.11 -0.58 121.20 121.35 3mls s ILE 34 Ca 0.73 -0.87 0.07 0.00 0.00 0.00 0.00 60.65 60.59 3mls s ILE 34 Cb -0.41 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.31 3mls s ILE 34 CO 0.48 0.52 0.11 -0.83 0.00 0.00 0.00 174.94 175.22 3mls s GLY 35 N 1.04 1.57 -0.04 6.18 0.00 0.68 -0.93 107.32 115.82 3mls s GLY 35 Ca -0.03 -1.42 0.07 0.00 0.00 0.00 0.00 44.72 43.34 3mls s GLY 35 CO -0.06 -1.46 -0.25 -0.98 0.00 0.00 0.00 173.10 170.36 3mls s TRP 36 N -2.04 2.32 -0.02 1.90 0.52 -0.40 -0.77 118.94 120.45 3mls s TRP 36 Ca 0.31 -0.58 0.00 0.00 0.02 0.00 0.00 56.10 55.85 3mls s TRP 36 Cb -0.08 -1.51 0.02 0.00 -1.15 0.00 0.00 33.47 30.75 3mls s TRP 36 CO 0.23 -0.14 -0.00 0.08 0.02 0.00 0.00 176.95 177.13 3mls s VAL 37 N -0.33 0.15 0.05 4.03 1.01 -0.27 -1.15 120.40 123.88 3mls s VAL 37 Ca 0.02 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.08 3mls s VAL 37 Cb -0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 36.01 3mls s VAL 37 CO 0.02 0.11 -0.02 -0.60 0.00 0.00 0.00 175.10 174.61 3mls s ARG 38 N 0.70 2.60 -0.22 2.72 3.52 0.15 -1.11 118.95 127.30 3mls s ARG 38 Ca -0.07 -0.75 -0.03 0.00 -0.13 0.00 0.00 55.73 54.75 3mls s ARG 38 Cb -0.10 -2.56 0.07 0.00 -1.56 0.00 0.00 34.95 30.80 3mls s ARG 38 CO -0.01 0.58 0.07 -1.14 -0.81 0.00 0.00 175.30 173.98 3mls s GLN 39 N -1.89 0.51 0.02 5.12 0.74 -0.51 -0.64 119.66 123.02 3mls s GLN 39 Ca 0.22 -0.50 -0.30 0.00 0.05 0.00 0.00 55.36 54.83 3mls s GLN 39 Cb -0.11 -1.92 -0.04 0.00 1.10 0.00 0.00 33.01 32.04 3mls s GLN 39 CO 0.13 -0.76 1.02 -1.50 -0.55 0.00 0.00 175.29 173.64 3mls s ILE 40 N 1.89 4.67 -0.07 -2.34 1.10 -1.26 -0.67 121.20 124.52 3mls s ILE 40 Ca 0.03 1.95 -0.06 0.00 -0.51 0.00 0.00 60.65 62.05 3mls s ILE 40 Cb -0.17 -4.25 -0.03 0.00 0.15 0.00 0.00 42.46 38.17 3mls s ILE 40 CO -0.15 0.17 0.31 -2.65 -2.11 0.00 0.00 174.94 170.51 3mls n PRO 41 N 3.78 0.00 -1.02 3.50 -0.02 -1.26 0.07 135.00 140.06 3mls n PRO 41 Ca 0.06 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.54 3mls n PRO 41 Cb 0.50 -0.22 -0.00 0.00 -0.02 0.00 0.00 33.50 33.76 3mls n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mls n GLY 42 N 1.07 0.48 1.57 -1.23 0.00 -1.26 -5.04 105.19 100.77 3mls n GLY 42 Ca 0.08 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 3mls n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mls n LYS 43 N -2.79 1.39 -2.64 1.61 4.76 0.11 -5.15 118.16 115.45 3mls n LYS 43 Ca -0.01 -1.55 -0.23 0.00 -2.87 0.00 0.00 58.31 53.65 3mls n LYS 43 Cb 0.04 0.35 0.12 0.00 -1.84 0.00 0.00 35.03 33.70 3mls n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3mls n GLY 44 N 2.36 0.75 3.76 0.72 0.00 -1.26 -4.73 105.19 106.79 3mls n GLY 44 Ca -0.07 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.49 3mls n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mls s LEU 45 N 0.00 4.38 -0.06 0.99 1.43 -1.26 -4.45 118.68 119.71 3mls s LEU 45 Ca 0.67 2.78 -0.00 0.00 -1.03 0.00 0.00 54.13 56.55 3mls s LEU 45 Cb -0.04 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.56 3mls s LEU 45 CO 0.44 -0.69 -0.02 -0.70 0.23 0.00 0.00 176.35 175.61 3mls s GLU 46 N -1.28 0.69 0.04 1.70 2.12 0.19 -4.99 118.70 117.16 3mls s GLU 46 Ca 0.54 0.00 -0.29 0.00 0.36 0.00 0.00 54.97 55.59 3mls s GLU 46 Cb -0.42 -0.86 -0.04 0.00 0.26 0.00 0.00 34.13 33.06 3mls s GLU 46 CO 0.51 -0.18 0.93 -0.46 -0.54 0.00 0.00 175.26 175.52 3mls s TRP 47 N 1.38 3.71 -0.21 5.30 -0.00 -1.26 0.29 118.94 128.16 3mls s TRP 47 Ca -0.04 1.67 0.03 0.00 -0.00 0.00 0.00 56.10 57.76 3mls s TRP 47 Cb -0.13 -3.04 -0.15 0.00 -0.00 0.00 0.00 33.47 30.15 3mls s TRP 47 CO -0.03 0.10 -0.17 -0.89 -0.00 0.00 0.00 176.95 175.97 3mls n ILE 48 N 3.39 1.23 -3.77 5.86 5.41 -0.30 -4.63 119.36 126.55 3mls n ILE 48 Ca 0.03 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.28 3mls n ILE 48 Cb 0.50 -1.20 0.00 0.00 -0.71 0.00 0.00 39.64 38.24 3mls n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3mls n GLY 49 N 2.42 -1.37 3.24 7.39 0.00 -1.20 -1.08 105.19 114.58 3mls n GLY 49 Ca -0.37 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.28 3mls n GLY 49 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mls s ILE 50 N -2.94 0.09 -0.14 -0.61 -4.36 0.23 -1.28 121.20 112.19 3mls s ILE 50 Ca 0.00 -0.73 -0.11 0.00 -0.26 0.00 0.00 60.65 59.55 3mls s ILE 50 Cb 0.00 -0.95 0.04 0.00 1.25 0.00 0.00 42.46 42.80 3mls s ILE 50 CO 0.00 -0.40 0.36 -0.51 0.24 0.00 0.00 174.94 174.63 3mls s ILE 51 N -2.62 -0.01 -0.46 8.37 2.07 -0.10 -1.71 121.20 126.74 3mls s ILE 51 Ca -0.05 0.03 -0.19 0.00 -1.41 0.00 0.00 60.65 59.03 3mls s ILE 51 Cb -0.01 -0.52 0.04 0.00 0.13 0.00 0.00 42.46 42.10 3mls s ILE 51 CO -0.04 0.01 0.59 -0.47 -1.91 0.00 0.00 174.94 173.12 3mls s TYR 52 N 0.47 3.08 0.38 3.50 5.04 -0.48 -0.93 117.35 128.40 3mls s TYR 52 Ca -0.02 -0.31 0.19 0.00 -2.44 0.00 0.00 57.07 54.49 3mls s TYR 52 Cb -0.04 -3.32 1.16 0.00 0.35 0.00 0.00 41.96 40.12 3mls s TYR 52 CO -0.02 -0.90 1.69 -1.35 -1.34 0.00 0.00 175.55 173.64 3mls h PRO 52 N 8.89 0.30 -0.72 4.97 0.11 -1.76 0.41 132.00 144.19 3mls h PRO 52 Ca -0.26 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.88 3mls h PRO 52 Cb 1.10 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 3mls h PRO 52 CO 0.90 0.20 0.47 0.22 -0.21 0.00 0.00 178.00 179.58 3mls h ASP 53 N 0.31 0.70 0.00 -2.05 3.58 -1.74 -3.32 116.42 113.90 3mls h ASP 53 Ca 0.70 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.15 3mls h ASP 53 Cb 1.81 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.71 3mls h ASP 53 CO -0.44 0.46 0.00 -0.90 -2.88 0.00 0.00 179.24 175.48 3mls n ASP 54 N -4.47 0.19 -0.67 2.28 3.85 -0.93 -5.02 116.55 111.78 3mls n ASP 54 Ca 0.10 -0.98 -0.09 0.00 -0.71 0.00 0.00 54.79 53.11 3mls n ASP 54 Cb 0.18 0.00 -0.04 0.00 -1.35 0.00 0.00 41.12 39.92 3mls n ASP 54 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3mls n SER 55 N -0.00 -4.36 -4.72 -1.12 7.64 0.14 -4.98 113.62 106.22 3mls n SER 55 Ca 0.00 0.22 -0.39 0.00 1.01 0.00 0.00 58.87 59.70 3mls n SER 55 Cb 0.20 -2.63 0.03 0.00 -1.01 0.00 0.00 64.21 60.81 3mls n SER 55 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3mls n ASP 56 N 0.10 2.50 -3.75 6.43 -0.08 -1.24 -4.69 116.55 115.82 3mls n ASP 56 Ca -0.09 1.01 -0.10 0.00 -1.51 0.00 0.00 54.79 54.10 3mls n ASP 56 Cb 0.34 -1.54 -0.06 0.00 2.34 0.00 0.00 41.12 42.20 3mls n ASP 56 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3mls s ALA 57 N -1.28 -0.60 -0.03 -1.67 0.00 -1.26 -1.38 121.76 115.53 3mls s ALA 57 Ca 0.68 -0.25 -0.01 0.00 0.00 0.00 0.00 51.96 52.38 3mls s ALA 57 Cb -0.45 0.53 0.03 0.00 0.00 0.00 0.00 23.12 23.23 3mls s ALA 57 CO 0.52 -0.54 0.03 -1.01 0.00 0.00 0.00 175.76 174.77 3mls s HIS 58 N -3.54 0.14 0.19 0.00 3.76 -0.69 -5.01 115.29 110.14 3mls s HIS 58 Ca 0.02 0.12 0.09 0.00 -0.15 0.00 0.00 55.06 55.14 3mls s HIS 58 Cb 0.02 -0.38 -0.04 0.00 1.11 0.00 0.00 32.58 33.29 3mls s HIS 58 CO -0.10 -0.14 -0.06 0.71 -0.85 0.00 0.00 174.74 174.30 3mls s TYR 59 N 1.44 2.68 0.34 1.40 1.51 -1.26 -0.60 117.35 122.86 3mls s TYR 59 Ca -0.04 -0.20 -0.18 0.00 -1.01 0.00 0.00 57.07 55.63 3mls s TYR 59 Cb -0.13 -1.29 -0.09 0.00 -0.11 0.00 0.00 41.96 40.34 3mls s TYR 59 CO -0.03 0.54 0.81 0.45 -1.11 0.00 0.00 175.55 176.21 3mls s SER 60 N -3.00 6.92 0.46 2.29 0.15 -0.24 -4.89 113.70 115.39 3mls s SER 60 Ca 0.27 1.47 0.19 0.00 0.70 0.00 0.00 55.95 58.58 3mls s SER 60 Cb -0.08 -2.45 1.17 0.00 -1.71 0.00 0.00 66.02 62.95 3mls s SER 60 CO 0.17 -0.20 1.93 -0.65 1.20 0.00 0.00 173.24 175.69 3mls h PRO 61 N 2.44 0.27 0.00 5.44 0.11 -1.92 -1.24 132.00 137.10 3mls h PRO 61 Ca -0.48 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3mls h PRO 61 Cb 1.18 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3mls h PRO 61 CO 0.64 0.18 -0.08 0.77 -0.21 0.00 0.00 178.00 179.30 3mls h SER 62 N 0.28 0.00 0.00 -2.05 0.02 -1.92 -3.32 113.55 106.56 3mls h SER 62 Ca 0.35 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.22 3mls h SER 62 Cb 0.97 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.49 3mls h SER 62 CO -0.08 0.08 -1.43 0.49 -1.14 0.00 0.00 176.83 174.75 3mls n PHE 63 N -3.23 0.00 -1.60 3.45 3.72 -0.72 -4.92 117.46 114.16 3mls n PHE 63 Ca 0.00 0.00 -0.49 0.00 -0.05 0.00 0.00 57.45 56.91 3mls n PHE 63 Cb 0.33 -0.28 -0.05 0.00 -0.94 0.00 0.00 39.48 38.54 3mls n PHE 63 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3mls n GLU 64 N -2.08 1.75 0.00 -1.08 2.13 -0.55 -0.78 120.64 120.03 3mls n GLU 64 Ca -0.08 0.58 0.00 0.00 0.66 0.00 0.00 57.16 58.33 3mls n GLU 64 Cb 0.54 -2.64 0.00 0.00 0.27 0.00 0.00 31.44 29.61 3mls n GLU 64 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3mls n GLY 65 N 5.22 1.04 0.00 8.31 0.00 -1.26 -4.88 105.19 113.62 3mls n GLY 65 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 3mls n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mls n GLN 66 N -0.58 0.05 -3.79 1.61 10.64 0.04 -5.08 117.38 120.26 3mls n GLN 66 Ca 0.00 -0.03 -0.13 0.00 -1.83 0.00 0.00 57.00 55.02 3mls n GLN 66 Cb 0.00 -0.43 -0.11 0.00 -0.86 0.00 0.00 30.24 28.83 3mls n GLN 66 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 3mls s VAL 67 N -0.01 0.01 -0.02 -0.39 0.11 -1.04 -4.49 120.40 114.56 3mls s VAL 67 Ca 0.00 -0.06 0.07 0.00 -2.93 0.00 0.00 61.98 59.06 3mls s VAL 67 Cb 0.00 -0.36 -0.02 0.00 -1.53 0.00 0.00 36.38 34.47 3mls s VAL 67 CO 0.00 -0.03 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.61 3mls s THR 68 N -0.02 1.85 0.08 5.04 2.01 -0.15 -4.73 115.64 119.72 3mls s THR 68 Ca -0.01 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 61.01 3mls s THR 68 Cb -0.02 -1.54 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 3mls s THR 68 CO 0.01 0.52 0.14 -0.04 -0.69 0.00 0.00 174.62 174.56 3mls s MET 69 N -0.51 3.10 0.18 4.92 -1.94 -1.26 -1.02 119.30 122.76 3mls s MET 69 Ca 0.08 -0.62 -0.24 0.00 -1.71 0.00 0.00 55.69 53.20 3mls s MET 69 Cb -0.09 -2.84 0.06 0.00 2.01 0.00 0.00 34.83 33.97 3mls s MET 69 CO -0.01 0.57 0.93 -1.54 -0.01 0.00 0.00 175.02 174.97 3mls s SER 70 N -2.54 -0.17 0.09 3.03 1.04 -0.64 -5.00 113.70 109.52 3mls s SER 70 Ca 0.32 -0.47 -0.08 0.00 0.48 0.00 0.00 55.95 56.20 3mls s SER 70 Cb -0.12 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.52 3mls s SER 70 CO 0.24 -0.99 0.17 0.68 0.98 0.00 0.00 173.24 174.33 3mls s VAL 71 N -3.27 0.14 -0.38 5.02 -7.23 -1.26 0.61 120.40 114.03 3mls s VAL 71 Ca 0.13 -1.26 0.02 0.00 -1.81 0.00 0.00 61.98 59.06 3mls s VAL 71 Cb -0.02 -1.40 0.11 0.00 0.56 0.00 0.00 36.38 35.63 3mls s VAL 71 CO 0.03 -0.66 0.14 -0.62 -0.31 0.00 0.00 175.10 173.69 3mls s ASP 72 N -2.88 4.21 0.33 4.85 3.68 -0.17 -4.97 116.67 121.73 3mls s ASP 72 Ca 0.06 -2.24 0.05 0.00 2.13 0.00 0.00 52.55 52.55 3mls s ASP 72 Cb 0.05 -1.25 0.69 0.00 -1.45 0.00 0.00 42.92 40.96 3mls s ASP 72 CO -0.10 -0.34 1.89 0.11 0.13 0.00 0.00 175.17 176.86 3mls h LYS 73 N 7.38 0.81 0.00 4.34 1.57 -1.90 -2.10 116.57 126.67 3mls h LYS 73 Ca -0.07 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3mls h LYS 73 Cb 0.98 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 33.10 3mls h LYS 73 CO 0.52 0.54 -0.01 0.66 -0.57 0.00 0.00 179.45 180.58 3mls h SER 74 N 0.83 0.00 0.00 0.86 4.64 -1.96 -2.66 113.55 115.27 3mls h SER 74 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3mls h SER 74 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3mls h SER 74 CO -0.18 0.01 -0.07 2.30 -0.87 0.00 0.00 176.83 178.03 3mls n ILE 75 N -3.42 1.18 -3.96 0.95 -5.35 -0.85 -5.01 119.36 102.90 3mls n ILE 75 Ca -0.03 -1.35 -0.30 0.00 -0.27 0.00 0.00 62.75 60.80 3mls n ILE 75 Cb 0.11 0.21 0.01 0.00 -1.74 0.00 0.00 39.64 38.23 3mls n ILE 75 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3mls n SER 76 N -0.82 -4.00 -4.34 7.28 7.64 -0.85 -4.80 113.62 113.73 3mls n SER 76 Ca 0.07 -0.84 -0.31 0.00 1.01 0.00 0.00 58.87 58.80 3mls n SER 76 Cb 0.52 -3.64 -0.15 0.00 -1.01 0.00 0.00 64.21 59.92 3mls n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3mls s THR 77 N -3.36 2.28 -0.11 0.44 2.01 -1.03 -1.67 115.64 114.21 3mls s THR 77 Ca 0.59 -1.01 -0.04 0.00 0.31 0.00 0.00 61.69 61.54 3mls s THR 77 Cb -0.30 -1.82 -0.03 0.00 0.01 0.00 0.00 72.50 70.35 3mls s THR 77 CO 0.85 0.58 0.03 0.00 -0.69 0.00 0.00 174.62 175.39 3mls s ALA 78 N -0.56 3.38 0.10 7.40 0.00 0.79 -1.00 121.76 131.87 3mls s ALA 78 Ca 0.08 -0.77 0.10 0.00 0.00 0.00 0.00 51.96 51.37 3mls s ALA 78 Cb -0.11 -1.62 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 3mls s ALA 78 CO 0.00 0.51 -0.25 0.71 0.00 0.00 0.00 175.76 176.74 3mls s TYR 79 N -0.66 2.15 -0.07 0.00 1.51 0.20 -0.96 117.35 119.52 3mls s TYR 79 Ca 0.11 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.79 3mls s TYR 79 Cb -0.12 -1.20 0.02 0.00 -0.11 0.00 0.00 41.96 40.55 3mls s TYR 79 CO 0.02 0.24 -0.11 -1.17 -1.11 0.00 0.00 175.55 173.43 3mls s LEU 80 N -1.78 1.55 0.04 -1.29 2.96 -0.83 -1.62 118.68 117.71 3mls s LEU 80 Ca 0.11 -0.29 0.03 0.00 -0.22 0.00 0.00 54.13 53.76 3mls s LEU 80 Cb -0.10 -0.81 -0.02 0.00 0.50 0.00 0.00 46.19 45.76 3mls s LEU 80 CO 0.04 0.00 -0.09 -1.10 -1.32 0.00 0.00 176.35 173.89 3mls s GLN 81 N 0.85 0.60 0.00 1.98 -0.21 -0.19 -1.56 119.66 121.14 3mls s GLN 81 Ca -0.11 -0.68 0.00 0.00 0.02 0.00 0.00 55.36 54.59 3mls s GLN 81 Cb -0.15 -0.46 0.00 0.00 1.00 0.00 0.00 33.01 33.40 3mls s GLN 81 CO 0.01 0.10 0.00 0.91 -2.12 0.00 0.00 175.29 174.19 3mls n TRP 82 N 1.76 0.00 -1.46 0.91 8.01 -0.53 -0.97 117.44 125.16 3mls n TRP 82 Ca -0.20 0.00 -0.45 0.00 -1.31 0.00 0.00 57.50 55.54 3mls n TRP 82 Cb 0.55 0.00 -0.10 0.00 -2.01 0.00 0.00 31.31 29.75 3mls n TRP 82 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.69 179.09 3mls n THR 82 N 0.00 0.02 -2.49 -0.99 -1.04 -1.26 -1.93 114.28 106.59 3mls n THR 82 Ca 0.00 -0.23 -0.40 0.00 -2.04 0.00 0.00 64.05 61.37 3mls n THR 82 Cb 0.00 -1.26 -0.04 0.00 -1.82 0.00 0.00 70.33 67.20 3mls n THR 82 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3mls s LEU 82 N 8.90 4.55 0.24 -4.42 1.43 0.40 -4.77 118.68 125.02 3mls s LEU 82 Ca 1.19 2.24 0.10 0.00 -1.03 0.00 0.00 54.13 56.63 3mls s LEU 82 Cb -0.97 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 41.58 3mls s LEU 82 CO 0.46 -0.13 -0.18 0.00 0.23 0.00 0.00 176.35 176.73 3mls s GLN 83 N -1.33 1.52 0.41 1.70 -2.07 -1.26 0.11 119.66 118.74 3mls s GLN 83 Ca 0.45 -1.68 0.19 0.00 -1.82 0.00 0.00 55.36 52.49 3mls s GLN 83 Cb -0.31 -1.49 1.11 0.00 -1.09 0.00 0.00 33.01 31.22 3mls s GLN 83 CO 0.40 0.27 1.80 0.00 -1.32 0.00 0.00 175.29 176.44 3mls h ALA 84 N 2.43 2.25 0.00 2.60 0.00 -1.97 0.13 119.26 124.71 3mls h ALA 84 Ca -0.39 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3mls h ALA 84 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3mls h ALA 84 CO 0.60 -0.62 0.00 0.66 0.00 0.00 0.00 179.25 179.90 3mls h SER 85 N 0.39 0.00 0.00 0.00 4.64 -1.96 -2.48 113.55 114.15 3mls h SER 85 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 3mls h SER 85 Cb 1.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 3mls h SER 85 CO -0.25 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.18 3mls n ASP 86 N -2.40 0.00 -4.72 4.97 8.00 0.47 -4.85 116.55 118.02 3mls n ASP 86 Ca -0.00 -1.44 -0.42 0.00 0.71 0.00 0.00 54.79 53.64 3mls n ASP 86 Cb 0.13 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 3mls n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3mls s THR 87 N -2.00 3.56 0.00 -3.53 2.01 -0.93 -4.83 115.64 109.92 3mls s THR 87 Ca 0.23 1.17 0.00 0.00 0.31 0.00 0.00 61.69 63.40 3mls s THR 87 Cb 0.11 -3.75 0.00 0.00 0.01 0.00 0.00 72.50 68.87 3mls s THR 87 CO 0.18 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.84 3mls n GLY 88 N 3.05 0.71 3.70 4.40 0.00 -0.58 -4.53 105.19 111.93 3mls n GLY 88 Ca 0.09 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.44 3mls n GLY 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mls s LYS 89 N -1.94 4.25 -0.14 1.61 2.20 0.15 -1.58 119.74 124.29 3mls s LYS 89 Ca 0.00 0.30 -0.05 0.00 -0.36 0.00 0.00 55.97 55.86 3mls s LYS 89 Cb 0.00 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.80 3mls s LYS 89 CO 0.00 0.06 0.03 0.71 -0.36 0.00 0.00 175.35 175.79 3mls s TYR 90 N 0.97 3.21 0.09 4.03 1.51 0.50 -1.42 117.35 126.24 3mls s TYR 90 Ca 0.22 0.07 0.10 0.00 -1.01 0.00 0.00 57.07 56.45 3mls s TYR 90 Cb -0.15 -1.96 -0.03 0.00 -0.11 0.00 0.00 41.96 39.71 3mls s TYR 90 CO 0.08 0.26 -0.26 -0.06 -1.11 0.00 0.00 175.55 174.45 3mls s PHE 91 N -0.11 2.28 -0.01 2.71 0.40 -0.27 -1.14 117.98 121.85 3mls s PHE 91 Ca 0.05 -0.40 0.07 0.00 -0.60 0.00 0.00 56.93 56.05 3mls s PHE 91 Cb -0.12 -1.30 -0.03 0.00 0.51 0.00 0.00 43.02 42.08 3mls s PHE 91 CO 0.02 0.23 -0.21 0.00 0.70 0.00 0.00 175.22 175.96 3mls s THR 93 N -0.75 0.10 -0.20 0.00 -1.32 0.05 -2.35 115.64 111.18 3mls s THR 93 Ca 0.12 -0.82 -0.11 0.00 -1.21 0.00 0.00 61.69 59.66 3mls s THR 93 Cb -0.10 -0.36 -0.05 0.00 -1.51 0.00 0.00 72.50 70.48 3mls s THR 93 CO 0.01 -0.45 0.19 -0.60 -2.21 0.00 0.00 174.62 171.56 3mls s ARG 94 N -1.47 4.19 -0.12 7.08 3.00 0.16 -0.23 118.95 131.55 3mls s ARG 94 Ca -0.15 -0.13 -0.27 0.00 -1.00 0.00 0.00 55.73 54.18 3mls s ARG 94 Cb -0.09 -3.45 -0.02 0.00 0.00 0.00 0.00 34.95 31.40 3mls s ARG 94 CO 0.00 0.23 0.91 -1.17 0.00 0.00 0.00 175.30 175.27 3mls s LEU 95 N 0.56 4.24 -0.12 -0.88 2.96 0.25 -2.96 118.68 122.72 3mls s LEU 95 Ca 0.11 1.38 -0.05 0.00 -0.22 0.00 0.00 54.13 55.34 3mls s LEU 95 Cb -0.12 -3.39 -0.04 0.00 0.50 0.00 0.00 46.19 43.14 3mls s LEU 95 CO 0.01 -0.38 0.07 -0.47 -1.32 0.00 0.00 176.35 174.26 3mls s TYR 96 N 1.87 3.35 -0.48 5.38 5.04 0.76 -4.13 117.35 129.14 3mls s TYR 96 Ca 0.44 0.29 -0.17 0.00 -2.44 0.00 0.00 57.07 55.19 3mls s TYR 96 Cb -0.18 -1.92 0.06 0.00 0.35 0.00 0.00 41.96 40.27 3mls s TYR 96 CO 0.17 0.49 0.48 -1.17 -1.34 0.00 0.00 175.55 174.18 3mls s LEU 97 N -0.62 5.26 -0.30 6.97 1.98 -1.26 -2.15 118.68 128.56 3mls s LEU 97 Ca 0.11 -1.07 -0.22 0.00 -2.89 0.00 0.00 54.13 50.06 3mls s LEU 97 Cb -0.12 -2.31 -0.01 0.00 0.66 0.00 0.00 46.19 44.42 3mls s LEU 97 CO 0.02 -0.72 0.70 -0.36 -1.89 0.00 0.00 176.35 174.10 3mls s PHE 98 N 2.08 3.22 0.27 5.38 0.40 0.15 -4.96 117.98 124.51 3mls s PHE 98 Ca 0.09 0.72 0.05 0.00 -0.60 0.00 0.00 56.93 57.19 3mls s PHE 98 Cb -0.21 -3.08 -0.02 0.00 0.51 0.00 0.00 43.02 40.21 3mls s PHE 98 CO 0.10 -0.50 0.39 -1.21 0.70 0.00 0.00 175.22 174.70 3mls s GLU 99 N 2.76 3.36 0.00 0.44 2.02 -1.26 -1.09 118.70 124.93 3mls s GLU 99 Ca 0.29 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.47 3mls s GLU 99 Cb -0.15 -2.86 0.00 0.00 0.10 0.00 0.00 34.13 31.22 3mls s GLU 99 CO 0.12 0.33 0.00 0.41 0.02 0.00 0.00 175.26 176.13 3mls n GLY 100 N -1.48 0.07 0.38 -1.39 0.00 -1.26 -4.93 105.19 96.58 3mls n GLY 100 Ca -0.07 -1.26 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 3mls n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mls h ALA 100 N 0.00 -0.54 -3.55 4.61 0.00 -2.08 -3.50 119.26 114.19 3mls h ALA 100 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3mls h ALA 100 Cb 0.00 1.27 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3mls h ALA 100 CO 0.00 -0.88 0.00 1.04 0.00 0.00 0.00 179.25 179.41 3mls n GLN 100 N -5.00 2.80 0.00 0.00 3.00 -1.26 -5.31 117.38 111.62 3mls n GLN 100 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 3mls n GLN 100 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.49 3mls n GLN 100 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 3mls n SER 100 N -0.59 0.00 -4.18 1.08 3.41 -0.25 -4.79 113.62 108.30 3mls n SER 100 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 3mls n SER 100 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 3mls n SER 100 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3mls s ASN 100 N 0.00 0.87 -0.21 4.04 -0.87 -1.26 0.30 114.94 117.82 3mls s ASN 100 Ca 0.00 -1.12 -0.34 0.00 -1.57 0.00 0.00 52.86 49.83 3mls s ASN 100 Cb 0.00 0.17 0.15 0.00 -0.02 0.00 0.00 41.25 41.55 3mls s ASN 100 CO 0.00 -0.59 1.22 0.00 -2.57 0.00 0.00 177.10 175.16 3mls s ALA 100 N -3.78 -2.07 -0.73 0.60 0.00 -0.91 -4.97 121.76 109.89 3mls s ALA 100 Ca 0.19 1.65 -0.23 0.00 0.00 0.00 0.00 51.96 53.57 3mls s ALA 100 Cb 0.07 -0.41 0.06 0.00 0.00 0.00 0.00 23.12 22.84 3mls s ALA 100 CO -0.01 -0.51 1.09 -0.06 0.00 0.00 0.00 175.76 176.28 3mls s PHE 100 N -2.06 2.60 -0.03 0.00 0.08 -1.26 -0.17 117.98 117.14 3mls s PHE 100 Ca 0.08 -0.52 0.12 0.00 0.12 0.00 0.00 56.93 56.74 3mls s PHE 100 Cb -0.01 -4.41 -0.22 0.00 -0.57 0.00 0.00 43.02 37.82 3mls s PHE 100 CO -0.05 -1.77 0.78 0.38 -0.10 0.00 0.00 175.22 174.47 3mls h ASP 101 N 9.64 0.00 -3.32 1.36 2.03 -1.90 -3.46 116.42 120.76 3mls h ASP 101 Ca -0.21 0.00 -0.66 0.00 -0.73 0.00 0.00 57.03 55.43 3mls h ASP 101 Cb 1.06 0.00 -0.28 0.00 -0.83 0.00 0.00 39.33 39.28 3mls h ASP 101 CO 1.22 0.96 -0.78 -0.22 -1.03 0.00 0.00 179.24 179.39 3mls s LEU 102 N -6.17 2.64 0.02 0.15 0.20 -1.24 -5.02 118.68 109.27 3mls s LEU 102 Ca -0.03 -0.35 0.04 0.00 0.69 0.00 0.00 54.13 54.47 3mls s LEU 102 Cb 0.08 -1.59 -0.02 0.00 -0.43 0.00 0.00 46.19 44.24 3mls s LEU 102 CO 0.82 0.17 -0.12 0.26 -0.29 0.00 0.00 176.35 177.19 3mls s TRP 103 N 0.34 1.07 0.59 5.38 0.52 -1.26 -0.67 118.94 124.91 3mls s TRP 103 Ca -0.12 -0.29 -0.01 0.00 0.02 0.00 0.00 56.10 55.70 3mls s TRP 103 Cb -0.16 -0.65 0.04 0.00 -1.15 0.00 0.00 33.47 31.54 3mls s TRP 103 CO 0.06 0.00 0.83 0.20 0.02 0.00 0.00 176.95 178.07 3mls s GLY 104 N -0.80 1.79 0.92 0.98 0.00 -0.99 -4.64 107.32 104.58 3mls s GLY 104 Ca 0.02 -1.22 -0.12 0.00 0.00 0.00 0.00 44.72 43.40 3mls s GLY 104 CO 0.00 -0.91 1.09 -0.86 0.00 0.00 0.00 173.10 172.43 3mls s GLN 105 N -4.88 1.04 0.64 2.90 0.00 -1.25 -4.79 119.66 113.31 3mls s GLN 105 Ca 0.58 0.86 -0.07 0.00 -0.00 0.00 0.00 55.36 56.73 3mls s GLN 105 Cb -0.10 -1.78 0.14 0.00 0.00 0.00 0.00 33.01 31.27 3mls s GLN 105 CO 0.40 -2.40 0.87 0.41 0.00 0.00 0.00 175.29 174.56 3mls n GLY 106 N -0.88 -0.58 2.80 2.60 0.00 -1.26 -4.51 105.19 103.36 3mls n GLY 106 Ca 0.07 -1.82 -0.28 0.00 0.00 0.00 0.00 46.02 43.98 3mls n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mls s THR 107 N -2.73 0.82 -0.06 2.61 2.01 -0.29 -4.85 115.64 113.15 3mls s THR 107 Ca 0.52 -0.73 -0.23 0.00 0.31 0.00 0.00 61.69 61.55 3mls s THR 107 Cb -0.02 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 3mls s THR 107 CO 0.36 -0.16 0.69 -0.32 -0.69 0.00 0.00 174.62 174.50 3mls s MET 108 N 1.72 4.43 -0.23 4.92 1.75 -1.26 -0.37 119.30 130.26 3mls s MET 108 Ca -0.02 0.87 -0.01 0.00 -1.25 0.00 0.00 55.69 55.28 3mls s MET 108 Cb -0.17 -3.44 0.07 0.00 2.84 0.00 0.00 34.83 34.12 3mls s MET 108 CO -0.07 0.09 0.01 0.42 -0.65 0.00 0.00 175.02 174.81 3mls s ILE 109 N 0.72 1.05 -0.55 10.11 1.01 -0.61 -1.92 121.20 131.01 3mls s ILE 109 Ca 0.37 -1.02 -0.12 0.00 0.00 0.00 0.00 60.65 59.88 3mls s ILE 109 Cb -0.18 -1.50 0.14 0.00 0.01 0.00 0.00 42.46 40.93 3mls s ILE 109 CO 0.18 -0.25 0.46 -0.22 0.00 0.00 0.00 174.94 175.11 3mls s LEU 110 N 1.60 6.01 -0.48 2.97 2.96 -1.00 -1.53 118.68 129.21 3mls s LEU 110 Ca -0.01 -2.00 -0.28 0.00 -0.22 0.00 0.00 54.13 51.62 3mls s LEU 110 Cb -0.18 -2.11 0.03 0.00 0.50 0.00 0.00 46.19 44.43 3mls s LEU 110 CO -0.10 -0.73 1.09 0.54 -1.32 0.00 0.00 176.35 175.83 3mls s VAL 111 N 1.25 4.25 0.22 1.68 0.11 -1.26 -2.03 120.40 124.63 3mls s VAL 111 Ca 0.07 1.09 -0.08 0.00 -2.93 0.00 0.00 61.98 60.13 3mls s VAL 111 Cb -0.26 -4.58 -0.02 0.00 -1.53 0.00 0.00 36.38 30.00 3mls s VAL 111 CO -0.00 -0.99 0.33 -0.55 -3.33 0.00 0.00 175.10 170.56 3mls s SER 112 N 2.45 0.01 0.00 3.54 0.15 0.18 -4.74 113.70 115.28 3mls s SER 112 Ca 0.45 -1.10 0.09 0.00 0.70 0.00 0.00 55.95 56.10 3mls s SER 112 Cb -0.08 0.50 0.03 0.00 -1.71 0.00 0.00 66.02 64.76 3mls s SER 112 CO 0.30 -1.01 0.68 -1.20 1.20 0.00 0.00 173.24 173.21 3mls n SER 113 N -0.33 1.41 -4.62 5.45 7.64 -1.26 -3.72 113.62 118.20 3mls n SER 113 Ca -0.01 -1.21 -0.45 0.00 1.01 0.00 0.00 58.87 58.22 3mls n SER 113 Cb 0.63 0.27 -0.02 0.00 -1.01 0.00 0.00 64.21 64.09 3mls n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mls n GLY 114 N 0.71 0.12 3.67 0.23 0.00 -1.26 -4.97 105.19 103.69 3mls n GLY 114 Ca 0.04 0.40 -0.35 0.00 0.00 0.00 0.00 46.02 46.12 3mls n GLY 114 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3mls s THR 115 N -0.69 4.44 -0.20 2.61 -1.32 -1.26 -5.06 115.64 114.17 3mls s THR 115 Ca 0.63 -0.19 -0.29 0.00 -1.21 0.00 0.00 61.69 60.64 3mls s THR 115 Cb -0.70 -2.91 -0.04 0.00 -1.51 0.00 0.00 72.50 67.34 3mls s THR 115 CO 0.57 0.57 1.89 -0.89 -2.21 0.00 0.00 174.62 174.54 3mls s THR 116 N -0.53 3.34 -0.02 5.08 2.01 -1.26 -4.63 115.64 119.62 3mls s THR 116 Ca 0.09 0.37 -0.16 0.00 0.31 0.00 0.00 61.69 62.30 3mls s THR 116 Cb -0.12 -3.37 0.03 0.00 0.01 0.00 0.00 72.50 69.05 3mls s THR 116 CO 0.02 -0.18 0.35 -1.59 -0.69 0.00 0.00 174.62 172.53 3mls s LYS 117 N 5.31 0.70 0.84 4.92 -2.85 -0.07 -4.97 119.74 123.61 3mls s LYS 117 Ca 0.84 -0.12 -0.11 0.00 -1.00 0.00 0.00 55.97 55.59 3mls s LYS 117 Cb -0.30 0.31 0.10 0.00 -2.06 0.00 0.00 37.83 35.88 3mls s LYS 117 CO 0.34 -0.19 1.09 0.20 0.10 0.00 0.00 175.35 176.89 3mls s GLY 118 N -1.25 1.65 0.87 0.59 0.00 -1.26 -1.74 107.32 106.19 3mls s GLY 118 Ca -0.13 0.16 -0.11 0.00 0.00 0.00 0.00 44.72 44.65 3mls s GLY 118 CO 0.05 0.58 1.20 2.56 0.00 0.00 0.00 173.10 177.49 3mls s PRO 119 N -4.88 1.05 -0.07 2.90 0.04 -1.26 -4.62 135.00 128.16 3mls s PRO 119 Ca 0.63 -0.62 0.03 0.00 0.04 0.00 0.00 61.00 61.08 3mls s PRO 119 Cb -0.18 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 3mls s PRO 119 CO 0.57 -2.05 -0.16 0.45 0.04 0.00 0.00 177.00 175.85 3mls s SER 120 N -4.82 3.87 -0.18 6.66 0.15 -0.36 -4.94 113.70 114.08 3mls s SER 120 Ca 0.71 -0.28 -0.01 0.00 0.70 0.00 0.00 55.95 57.07 3mls s SER 120 Cb -0.05 -1.04 0.00 0.00 -1.71 0.00 0.00 66.02 63.23 3mls s SER 120 CO 0.50 0.28 -0.13 -0.69 1.20 0.00 0.00 173.24 174.40 3mls s VAL 121 N -0.36 2.73 0.03 4.45 1.01 -1.26 -1.19 120.40 125.81 3mls s VAL 121 Ca 0.03 -0.73 0.09 0.00 0.00 0.00 0.00 61.98 61.37 3mls s VAL 121 Cb -0.12 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 3mls s VAL 121 CO 0.02 0.49 -0.25 -0.36 0.00 0.00 0.00 175.10 175.01 3mls s PHE 122 N 1.12 2.22 0.32 5.22 0.08 -0.79 -4.97 117.98 121.19 3mls s PHE 122 Ca 0.01 -0.41 -0.20 0.00 0.12 0.00 0.00 56.93 56.45 3mls s PHE 122 Cb -0.14 -1.36 -0.09 0.00 -0.57 0.00 0.00 43.02 40.86 3mls s PHE 122 CO -0.04 0.08 0.82 -1.25 -0.10 0.00 0.00 175.22 174.73 3mls s PRO 123 N -1.07 4.23 -0.85 0.24 0.04 -1.26 -0.03 135.00 136.29 3mls s PRO 123 Ca 0.11 0.95 -0.03 0.00 0.04 0.00 0.00 61.00 62.06 3mls s PRO 123 Cb -0.10 -2.55 0.21 0.00 0.04 0.00 0.00 34.50 32.10 3mls s PRO 123 CO 0.01 0.20 0.73 -0.51 0.04 0.00 0.00 177.00 177.47 3mls s LEU 124 N -2.60 5.61 0.31 -3.56 1.43 0.17 -4.84 118.68 115.21 3mls s LEU 124 Ca 0.52 -3.46 -0.28 0.00 -1.03 0.00 0.00 54.13 49.88 3mls s LEU 124 Cb -0.13 -1.94 -0.13 0.00 0.03 0.00 0.00 46.19 44.02 3mls s LEU 124 CO 0.18 -0.25 1.07 0.00 0.23 0.00 0.00 176.35 177.58 3mls n ALA 125 N 2.71 0.16 -1.81 4.21 0.00 -1.26 -1.52 120.51 123.00 3mls n ALA 125 Ca 0.18 0.37 -0.31 0.00 0.00 0.00 0.00 53.44 53.68 3mls n ALA 125 Cb 0.38 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.75 3mls n ALA 125 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3mls s PRO 126 N -1.67 3.60 0.15 0.00 0.04 -1.26 -4.85 135.00 131.01 3mls s PRO 126 Ca 0.58 0.87 0.03 0.00 0.04 0.00 0.00 61.00 62.53 3mls s PRO 126 Cb -0.66 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.79 3mls s PRO 126 CO 0.60 -0.57 0.12 -1.13 0.04 0.00 0.00 177.00 176.07 3mls n SER 127 N -2.39 -0.13 -1.61 6.66 3.41 -1.26 -4.72 113.62 113.58 3mls n SER 127 Ca 0.07 -1.99 -0.02 0.00 -0.26 0.00 0.00 58.87 56.66 3mls n SER 127 Cb 0.54 0.72 0.24 0.00 -0.26 0.00 0.00 64.21 65.44 3mls n SER 127 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3mls n SER 128 N -2.32 4.09 0.00 4.04 7.64 -1.26 -3.30 113.62 122.50 3mls n SER 128 Ca 0.03 -2.81 0.00 0.00 1.01 0.00 0.00 58.87 57.10 3mls n SER 128 Cb 0.27 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 3mls n SER 128 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3mls n LYS 129 N 0.09 2.72 -0.03 1.43 0.00 -1.26 -4.75 118.16 116.36 3mls n LYS 129 Ca 0.27 0.00 0.08 0.00 0.00 0.00 0.00 58.31 58.66 3mls n LYS 129 Cb 1.05 -0.23 0.41 0.00 0.00 0.00 0.00 35.03 36.26 3mls n LYS 129 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3mls n SER 130 N 0.00 0.60 -4.43 3.14 2.88 -1.21 -4.80 113.62 109.81 3mls n SER 130 Ca 0.00 -1.61 -0.21 0.00 -1.33 0.00 0.00 58.87 55.72 3mls n SER 130 Cb 0.00 -0.05 -0.10 0.00 -0.75 0.00 0.00 64.21 63.31 3mls n SER 130 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3mls s THR 131 N -1.91 1.38 0.00 2.46 -1.32 -1.26 -1.06 115.64 113.92 3mls s THR 131 Ca 0.26 -2.05 0.00 0.00 -1.21 0.00 0.00 61.69 58.68 3mls s THR 131 Cb 0.13 -2.60 0.00 0.00 -1.51 0.00 0.00 72.50 68.52 3mls s THR 131 CO 0.20 -0.17 0.00 -1.20 -2.21 0.00 0.00 174.62 171.24 3mls n SER 132 N -0.62 0.00 0.00 8.08 7.64 -1.26 -4.98 113.62 122.48 3mls n SER 132 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 3mls n SER 132 Cb 0.65 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 3mls n SER 132 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mls n GLY 133 N 0.48 0.00 0.00 0.23 0.00 -1.26 -5.01 105.19 99.62 3mls n GLY 133 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3mls n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mls n GLY 134 N 0.68 0.00 3.28 -0.02 0.00 -1.26 -5.06 105.19 102.81 3mls n GLY 134 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3mls n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mls s THR 135 N 0.00 3.50 0.19 2.61 -4.23 -1.26 0.18 115.64 116.63 3mls s THR 135 Ca 0.00 -0.83 -0.04 0.00 -1.18 0.00 0.00 61.69 59.65 3mls s THR 135 Cb 0.00 -2.79 -0.05 0.00 1.34 0.00 0.00 72.50 71.00 3mls s THR 135 CO 0.00 0.13 0.42 0.00 -0.54 0.00 0.00 174.62 174.64 3mls s ALA 136 N 1.43 3.76 -0.03 3.99 0.00 0.41 -4.15 121.76 127.17 3mls s ALA 136 Ca 0.02 -0.63 -0.02 0.00 0.00 0.00 0.00 51.96 51.32 3mls s ALA 136 Cb -0.17 -2.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 3mls s ALA 136 CO -0.00 0.51 0.12 0.00 0.00 0.00 0.00 175.76 176.39 3mls s ALA 137 N -1.81 3.74 -0.25 0.00 0.00 -0.23 -1.92 121.76 121.29 3mls s ALA 137 Ca 0.41 -0.79 -0.26 0.00 0.00 0.00 0.00 51.96 51.32 3mls s ALA 137 Cb -0.11 -1.74 0.10 0.00 0.00 0.00 0.00 23.12 21.36 3mls s ALA 137 CO 0.27 0.69 0.88 -0.48 0.00 0.00 0.00 175.76 177.12 3mls s LEU 138 N -1.64 -0.58 0.00 0.00 0.05 -0.82 -4.04 118.68 111.64 3mls s LEU 138 Ca 0.23 1.06 0.00 0.00 0.05 0.00 0.00 54.13 55.46 3mls s LEU 138 Cb -0.12 2.16 0.00 0.00 -2.05 0.00 0.00 46.19 46.18 3mls s LEU 138 CO 0.13 -0.24 0.00 0.61 -0.55 0.00 0.00 176.35 176.31 3mls n GLY 139 N 2.20 3.96 3.11 -3.48 0.00 -0.57 -0.49 105.19 109.92 3mls n GLY 139 Ca -0.13 -0.75 -0.15 0.00 0.00 0.00 0.00 46.02 44.98 3mls n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mls s LEU 141 N -1.67 3.22 -0.75 0.00 2.96 0.95 -2.15 118.68 121.24 3mls s LEU 141 Ca -0.06 -0.92 -0.15 0.00 -0.22 0.00 0.00 54.13 52.79 3mls s LEU 141 Cb -0.10 -1.66 0.19 0.00 0.50 0.00 0.00 46.19 45.13 3mls s LEU 141 CO 0.01 -0.14 0.70 -0.69 -1.32 0.00 0.00 176.35 174.92 3mls s VAL 142 N 1.31 5.48 -0.02 1.68 1.01 -0.25 -1.88 120.40 127.73 3mls s VAL 142 Ca -0.00 -2.17 -0.14 0.00 0.00 0.00 0.00 61.98 59.66 3mls s VAL 142 Cb -0.17 -4.44 -0.05 0.00 0.00 0.00 0.00 36.38 31.72 3mls s VAL 142 CO -0.04 -0.99 0.38 -0.75 0.00 0.00 0.00 175.10 173.69 3mls s LYS 143 N 0.63 3.89 -0.47 2.72 2.47 -0.34 -1.88 119.74 126.76 3mls s LYS 143 Ca 0.14 0.35 -0.35 0.00 -1.56 0.00 0.00 55.97 54.56 3mls s LYS 143 Cb -0.16 -3.23 0.05 0.00 -1.46 0.00 0.00 37.83 33.04 3mls s LYS 143 CO -0.05 0.68 0.66 -0.25 0.16 0.00 0.00 175.35 176.54 3mls n ASP 144 N 1.92 -5.81 -4.38 1.43 10.43 -0.74 -1.23 116.55 118.17 3mls n ASP 144 Ca -0.14 -0.10 -0.19 0.00 2.57 0.00 0.00 54.79 56.92 3mls n ASP 144 Cb 0.53 -2.17 -0.10 0.00 1.84 0.00 0.00 41.12 41.21 3mls n ASP 144 CO 0.00 0.00 0.00 -0.72 -1.07 0.00 0.00 177.20 175.41 3mls s TYR 145 N -1.70 1.76 -0.29 1.24 -0.85 -0.48 -4.39 117.35 112.64 3mls s TYR 145 Ca 0.35 -0.89 -0.22 0.00 -0.52 0.00 0.00 57.07 55.79 3mls s TYR 145 Cb -0.04 -1.05 0.16 0.00 0.38 0.00 0.00 41.96 41.40 3mls s TYR 145 CO 0.86 0.03 1.16 0.12 -1.52 0.00 0.00 175.55 176.21 3mls s PHE 146 N -3.31 -0.33 0.00 -3.49 5.36 -0.71 -0.54 117.98 114.96 3mls s PHE 146 Ca 0.31 0.76 0.00 0.00 -0.96 0.00 0.00 56.93 57.04 3mls s PHE 146 Cb 0.06 0.35 0.00 0.00 -0.34 0.00 0.00 43.02 43.10 3mls s PHE 146 CO 0.11 -0.16 0.00 -0.35 -1.46 0.00 0.00 175.22 173.36 3mls n PRO 147 N 2.48 2.41 -1.51 10.12 -0.04 -1.26 -0.90 135.00 146.30 3mls n PRO 147 Ca -0.14 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.99 3mls n PRO 147 Cb 0.57 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.10 3mls n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3mls s GLU 148 N 1.05 2.39 0.47 0.54 0.41 -1.26 -4.76 118.70 117.54 3mls s GLU 148 Ca 0.00 1.49 0.05 0.00 -0.41 0.00 0.00 54.97 56.10 3mls s GLU 148 Cb 0.00 -1.89 -0.03 0.00 -1.78 0.00 0.00 34.13 30.43 3mls s GLU 148 CO 0.00 -1.59 0.11 -1.25 -0.49 0.00 0.00 175.26 172.04 3mls s PRO 149 N -4.18 2.16 0.03 0.39 0.04 -1.26 -4.95 135.00 127.23 3mls s PRO 149 Ca 0.68 -2.15 0.05 0.00 0.04 0.00 0.00 61.00 59.62 3mls s PRO 149 Cb -0.23 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.55 3mls s PRO 149 CO 0.46 -0.27 -0.14 0.14 0.04 0.00 0.00 177.00 177.23 3mls s VAL 150 N -2.76 1.07 0.09 -0.36 -7.23 -1.26 -4.47 120.40 105.48 3mls s VAL 150 Ca 0.25 -0.90 0.04 0.00 -1.81 0.00 0.00 61.98 59.56 3mls s VAL 150 Cb 0.03 -0.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.98 3mls s VAL 150 CO 0.14 0.06 0.06 -0.89 -0.31 0.00 0.00 175.10 174.15 3mls s THR 151 N -0.74 4.37 -0.07 5.32 2.01 0.10 -4.92 115.64 121.71 3mls s THR 151 Ca 0.02 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.11 3mls s THR 151 Cb -0.07 -3.11 0.04 0.00 0.01 0.00 0.00 72.50 69.36 3mls s THR 151 CO 0.01 0.09 0.16 -0.69 -0.69 0.00 0.00 174.62 173.50 3mls s VAL 152 N -1.41 -0.04 0.20 3.82 1.01 -1.26 -0.61 120.40 122.11 3mls s VAL 152 Ca 0.28 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 3mls s VAL 152 Cb -0.12 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 3mls s VAL 152 CO 0.21 0.07 0.12 -0.94 0.00 0.00 0.00 175.10 174.56 3mls s SER 153 N 1.09 0.28 -0.08 3.32 1.04 -0.83 -4.98 113.70 113.55 3mls s SER 153 Ca -0.08 -1.38 0.04 0.00 0.48 0.00 0.00 55.95 55.00 3mls s SER 153 Cb -0.10 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.37 3mls s SER 153 CO -0.06 -0.82 -0.20 0.26 0.98 0.00 0.00 173.24 173.40 3mls s TRP 154 N -4.11 2.12 -1.40 5.02 0.52 -1.26 -1.16 118.94 118.67 3mls s TRP 154 Ca 0.38 -0.80 -0.05 0.00 0.02 0.00 0.00 56.10 55.66 3mls s TRP 154 Cb 0.07 -1.44 0.03 0.00 -1.15 0.00 0.00 33.47 30.98 3mls s TRP 154 CO 0.12 -0.32 0.76 0.09 0.02 0.00 0.00 176.95 177.61 3mls n ASN 155 N 3.50 -2.27 -2.83 2.95 3.02 -0.42 -1.15 115.26 118.05 3mls n ASN 155 Ca -0.20 -0.83 -0.20 0.00 -0.03 0.00 0.00 54.58 53.32 3mls n ASN 155 Cb 0.53 -3.86 0.01 0.00 -0.61 0.00 0.00 39.78 35.85 3mls n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3mls n SER 156 N -2.97 -4.90 0.00 6.41 7.64 -1.26 -1.61 113.62 116.93 3mls n SER 156 Ca -0.18 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.57 3mls n SER 156 Cb 0.63 -4.05 0.00 0.00 -1.01 0.00 0.00 64.21 59.78 3mls n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mls n GLY 157 N -1.15 0.85 0.17 0.23 0.00 -0.30 -4.94 105.19 100.05 3mls n GLY 157 Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 3mls n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mls h ALA 158 N 0.00 0.44 -2.42 4.61 0.00 -1.12 -3.41 119.26 117.36 3mls h ALA 158 Ca 0.00 -0.15 -0.58 0.00 0.00 0.00 0.00 54.91 54.18 3mls h ALA 158 Cb 0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.59 3mls h ALA 158 CO 0.00 0.07 0.35 -1.17 0.00 0.00 0.00 179.25 178.50 3mls s LEU 159 N -9.74 4.19 0.00 0.00 2.96 -1.04 -4.89 118.68 110.16 3mls s LEU 159 Ca -0.13 1.17 0.00 0.00 -0.22 0.00 0.00 54.13 54.95 3mls s LEU 159 Cb 0.09 -3.22 0.00 0.00 0.50 0.00 0.00 46.19 43.56 3mls s LEU 159 CO 0.74 -0.37 0.00 0.35 -1.32 0.00 0.00 176.35 175.76 3mls n THR 160 N 4.64 0.00 -2.13 3.68 -2.24 -1.26 -4.33 114.28 112.63 3mls n THR 160 Ca 0.04 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 3mls n THR 160 Cb 0.49 -0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 68.08 3mls n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3mls s SER 161 N -4.11 6.79 0.00 3.42 0.01 -1.26 -2.87 113.70 115.69 3mls s SER 161 Ca 0.00 2.45 0.00 0.00 1.31 0.00 0.00 55.95 59.71 3mls s SER 161 Cb 0.00 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.63 3mls s SER 161 CO 0.00 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 173.62 3mls n GLY 162 N 2.90 0.92 3.84 3.44 0.00 -1.26 -4.69 105.19 110.34 3mls n GLY 162 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 3mls n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mls s VAL 163 N -3.08 4.69 -0.29 1.61 1.01 -1.14 -1.57 120.40 121.63 3mls s VAL 163 Ca 0.00 1.01 0.02 0.00 0.00 0.00 0.00 61.98 63.01 3mls s VAL 163 Cb 0.00 -3.72 0.18 0.00 0.00 0.00 0.00 36.38 32.84 3mls s VAL 163 CO 0.00 0.03 0.51 -2.28 0.00 0.00 0.00 175.10 173.36 3mls s HIS 164 N -1.73 -1.42 -0.35 5.22 2.46 -0.48 -4.99 115.29 113.99 3mls s HIS 164 Ca 0.47 0.93 -0.19 0.00 0.47 0.00 0.00 55.06 56.75 3mls s HIS 164 Cb -0.13 0.18 -0.00 0.00 -0.13 0.00 0.00 32.58 32.49 3mls s HIS 164 CO 0.19 -0.97 0.54 0.99 -2.47 0.00 0.00 174.74 173.02 3mls s THR 165 N 2.71 4.99 0.50 0.89 2.01 -1.26 -2.02 115.64 123.45 3mls s THR 165 Ca 0.12 0.41 -0.18 0.00 0.31 0.00 0.00 61.69 62.35 3mls s THR 165 Cb -0.12 -3.99 -0.08 0.00 0.01 0.00 0.00 72.50 68.31 3mls s THR 165 CO -0.25 -0.24 0.99 -0.36 -0.69 0.00 0.00 174.62 174.08 3mls s PHE 166 N 2.47 3.28 0.61 4.92 0.40 -0.11 -4.99 117.98 124.56 3mls s PHE 166 Ca 0.20 1.53 -0.18 0.00 -0.60 0.00 0.00 56.93 57.88 3mls s PHE 166 Cb -0.15 -2.88 -0.03 0.00 0.51 0.00 0.00 43.02 40.47 3mls s PHE 166 CO 0.14 -0.47 1.23 -2.14 0.70 0.00 0.00 175.22 174.68 3mls s PRO 167 N -3.69 2.86 0.82 0.24 0.02 -1.26 -4.27 135.00 129.72 3mls s PRO 167 Ca 0.62 1.88 -0.11 0.00 0.02 0.00 0.00 61.00 63.41 3mls s PRO 167 Cb -0.11 -1.91 0.09 0.00 0.02 0.00 0.00 34.50 32.59 3mls s PRO 167 CO 0.25 -1.31 1.10 0.00 -0.33 0.00 0.00 177.00 176.71 3mls s ALA 168 N -1.56 1.96 -0.10 -1.55 0.00 -1.26 -4.78 121.76 114.47 3mls s ALA 168 Ca 0.79 0.27 0.02 0.00 0.00 0.00 0.00 51.96 53.03 3mls s ALA 168 Cb -0.32 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.49 3mls s ALA 168 CO 0.35 -2.07 -0.16 0.08 0.00 0.00 0.00 175.76 173.95 3mls s VAL 169 N -2.86 2.78 -0.30 0.00 1.01 0.14 -4.90 120.40 116.28 3mls s VAL 169 Ca 0.63 -0.78 -0.19 0.00 0.00 0.00 0.00 61.98 61.64 3mls s VAL 169 Cb -0.18 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3mls s VAL 169 CO 0.57 0.55 0.55 -0.22 0.00 0.00 0.00 175.10 176.55 3mls s LEU 170 N 0.07 4.16 0.55 3.92 2.96 -1.26 -1.91 118.68 127.15 3mls s LEU 170 Ca -0.07 0.34 -0.07 0.00 -0.22 0.00 0.00 54.13 54.12 3mls s LEU 170 Cb -0.15 -2.69 -0.02 0.00 0.50 0.00 0.00 46.19 43.82 3mls s LEU 170 CO 0.05 -0.40 0.88 -1.10 -1.32 0.00 0.00 176.35 174.46 3mls s GLN 171 N 2.43 3.38 0.53 1.98 -0.21 -0.21 -4.92 119.66 122.65 3mls s GLN 171 Ca 0.22 0.29 0.31 0.00 0.02 0.00 0.00 55.36 56.20 3mls s GLN 171 Cb -0.15 -2.27 1.68 0.00 1.00 0.00 0.00 33.01 33.27 3mls s GLN 171 CO 0.11 -0.44 1.93 0.77 -2.12 0.00 0.00 175.29 175.54 3mls h SER 172 N -0.03 0.00 1.61 5.90 0.02 -1.97 0.33 113.55 119.40 3mls h SER 172 Ca -0.46 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 3mls h SER 172 Cb 1.22 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.75 3mls h SER 172 CO 0.62 0.00 -0.14 0.77 -1.14 0.00 0.00 176.83 176.94 3mls h SER 173 N 0.00 0.00 0.00 3.07 4.64 -2.01 -3.47 113.55 115.78 3mls h SER 173 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mls h SER 173 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3mls h SER 173 CO 0.00 0.14 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 3mls n GLY 174 N 0.85 0.23 3.94 -0.77 0.00 0.12 -4.78 105.19 104.77 3mls n GLY 174 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 3mls n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mls s LEU 175 N 0.00 4.25 0.32 0.99 1.43 -1.26 -4.82 118.68 119.59 3mls s LEU 175 Ca 0.00 0.06 0.07 0.00 -1.03 0.00 0.00 54.13 53.22 3mls s LEU 175 Cb 0.00 -2.80 -0.02 0.00 0.03 0.00 0.00 46.19 43.40 3mls s LEU 175 CO 0.00 -0.03 0.42 -0.31 0.23 0.00 0.00 176.35 176.66 3mls s TYR 176 N -1.92 3.11 -0.14 0.29 1.51 0.30 -1.05 117.35 119.45 3mls s TYR 176 Ca 0.34 -0.21 -0.18 0.00 -1.01 0.00 0.00 57.07 56.01 3mls s TYR 176 Cb -0.09 -1.90 0.04 0.00 -0.11 0.00 0.00 41.96 39.90 3mls s TYR 176 CO 0.28 0.09 0.47 -1.12 -1.11 0.00 0.00 175.55 174.16 3mls s SER 177 N -4.11 -0.46 0.27 2.29 0.01 -0.80 -1.39 113.70 109.51 3mls s SER 177 Ca 0.43 0.80 -0.08 0.00 1.31 0.00 0.00 55.95 58.40 3mls s SER 177 Cb -0.09 0.83 -0.01 0.00 0.21 0.00 0.00 66.02 66.97 3mls s SER 177 CO 0.30 -0.25 0.44 -1.48 0.41 0.00 0.00 173.24 172.66 3mls s LEU 178 N -0.13 0.61 -0.01 2.44 0.05 -0.79 0.28 118.68 121.14 3mls s LEU 178 Ca -0.03 -1.15 -0.07 0.00 0.05 0.00 0.00 54.13 52.93 3mls s LEU 178 Cb -0.03 1.53 0.00 0.00 -2.05 0.00 0.00 46.19 45.64 3mls s LEU 178 CO 0.02 -1.16 0.13 -0.44 -0.55 0.00 0.00 176.35 174.35 3mls s SER 179 N -3.10 0.00 -0.21 1.48 0.01 -1.26 -1.09 113.70 109.53 3mls s SER 179 Ca 0.27 -0.14 -0.01 0.00 1.31 0.00 0.00 55.95 57.38 3mls s SER 179 Cb 0.00 0.22 0.06 0.00 0.21 0.00 0.00 66.02 66.51 3mls s SER 179 CO 0.13 -0.32 -0.02 -0.55 0.41 0.00 0.00 173.24 172.89 3mls s SER 180 N -1.15 3.41 -0.02 2.44 0.15 -0.91 -0.93 113.70 116.68 3mls s SER 180 Ca -0.12 -1.00 0.00 0.00 0.70 0.00 0.00 55.95 55.53 3mls s SER 180 Cb -0.07 -0.94 -0.04 0.00 -1.71 0.00 0.00 66.02 63.27 3mls s SER 180 CO 0.01 -0.26 0.03 0.68 1.20 0.00 0.00 173.24 174.91 3mls s VAL 181 N 1.59 4.42 -0.00 4.45 -7.23 -0.85 -1.63 120.40 121.14 3mls s VAL 181 Ca -0.03 -0.46 0.05 0.00 -1.81 0.00 0.00 61.98 59.72 3mls s VAL 181 Cb -0.18 -2.98 -0.01 0.00 0.56 0.00 0.00 36.38 33.77 3mls s VAL 181 CO -0.07 0.40 -0.16 0.54 -0.31 0.00 0.00 175.10 175.50 3mls s VAL 182 N -1.10 1.29 -0.18 1.32 0.11 0.35 -1.39 120.40 120.81 3mls s VAL 182 Ca 0.20 -0.75 -0.05 0.00 -2.93 0.00 0.00 61.98 58.45 3mls s VAL 182 Cb -0.12 -1.08 -0.03 0.00 -1.53 0.00 0.00 36.38 33.62 3mls s VAL 182 CO 0.10 0.32 -0.01 0.42 -3.33 0.00 0.00 175.10 172.60 3mls s THR 183 N -0.45 4.02 0.05 5.04 -4.23 -0.61 -1.95 115.64 117.52 3mls s THR 183 Ca 0.06 -0.30 -0.00 0.00 -1.18 0.00 0.00 61.69 60.27 3mls s THR 183 Cb -0.07 -2.79 -0.04 0.00 1.34 0.00 0.00 72.50 70.95 3mls s THR 183 CO -0.00 0.46 -0.04 0.68 -0.54 0.00 0.00 174.62 175.18 3mls s VAL 184 N 0.61 0.29 0.31 2.29 -7.23 -0.81 -4.56 120.40 111.30 3mls s VAL 184 Ca -0.01 -1.65 -0.30 0.00 -1.81 0.00 0.00 61.98 58.21 3mls s VAL 184 Cb -0.14 -1.30 -0.12 0.00 0.56 0.00 0.00 36.38 35.38 3mls s VAL 184 CO 0.02 -0.87 1.55 -2.65 -0.31 0.00 0.00 175.10 172.84 3mls n PRO 185 N 0.39 2.64 0.23 4.82 -0.02 -1.26 -0.44 135.00 141.36 3mls n PRO 185 Ca -0.16 0.94 0.16 0.00 -2.02 0.00 0.00 63.50 62.42 3mls n PRO 185 Cb 0.60 -2.69 0.82 0.00 -0.02 0.00 0.00 33.50 32.20 3mls n PRO 185 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3mls h SER 186 N 4.30 0.00 -0.59 2.55 0.02 0.15 -1.39 113.55 118.59 3mls h SER 186 Ca -0.48 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.40 3mls h SER 186 Cb 1.23 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.75 3mls h SER 186 CO 0.75 0.00 0.10 0.28 -1.14 0.00 0.00 176.83 176.83 3mls h SER 187 N 0.00 0.96 0.80 3.07 0.02 -1.89 -3.17 113.55 113.34 3mls h SER 187 Ca 0.00 -0.21 -0.14 0.00 -0.84 0.00 0.00 61.79 60.60 3mls h SER 187 Cb 0.08 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 3mls h SER 187 CO 0.00 0.95 -0.65 0.77 -1.14 0.00 0.00 176.83 176.77 3mls h SER 188 N 0.95 0.00 -3.18 3.07 4.64 -1.62 -3.47 113.55 113.94 3mls h SER 188 Ca 0.19 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.95 3mls h SER 188 Cb 0.40 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 62.68 3mls h SER 188 CO 0.01 0.65 -0.44 0.18 -0.87 0.00 0.00 176.83 176.36 3mls n LEU 189 N -3.62 0.60 -1.05 5.97 4.32 -1.20 -0.05 117.00 121.98 3mls n LEU 189 Ca -0.01 0.57 -0.14 0.00 -0.02 0.00 0.00 56.01 56.42 3mls n LEU 189 Cb 0.67 -1.20 -0.06 0.00 -1.62 0.00 0.00 43.42 41.21 3mls n LEU 189 CO 0.42 -3.21 -0.13 0.61 -1.22 0.00 0.00 177.39 173.86 3mls n GLY 190 N 1.68 1.37 2.10 -0.72 0.00 -1.26 -4.57 105.19 103.80 3mls n GLY 190 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3mls n GLY 190 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3mls n THR 191 N -2.44 0.00 -2.40 2.61 -1.04 -0.74 -5.09 114.28 105.17 3mls n THR 191 Ca -0.14 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.46 3mls n THR 191 Cb 0.53 -0.15 -0.03 0.00 -1.82 0.00 0.00 70.33 68.86 3mls n THR 191 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 3mls s GLN 192 N -1.69 4.47 0.24 -2.82 2.00 0.93 -5.01 119.66 117.77 3mls s GLN 192 Ca 0.00 1.83 -0.17 0.00 -2.00 0.00 0.00 55.36 55.01 3mls s GLN 192 Cb 0.00 -3.29 -0.08 0.00 0.80 0.00 0.00 33.01 30.44 3mls s GLN 192 CO 0.00 -0.15 0.70 0.99 -0.50 0.00 0.00 175.29 176.32 3mls s THR 193 N 0.42 4.65 -0.13 -0.34 2.01 -1.26 -4.75 115.64 116.24 3mls s THR 193 Ca 0.55 1.11 -0.02 0.00 0.31 0.00 0.00 61.69 63.64 3mls s THR 193 Cb -0.31 -3.77 0.04 0.00 0.01 0.00 0.00 72.50 68.47 3mls s THR 193 CO 0.33 0.10 0.02 -0.31 -0.69 0.00 0.00 174.62 174.08 3mls s TYR 194 N -1.64 0.76 -0.06 4.92 2.02 -1.26 -4.96 117.35 117.12 3mls s TYR 194 Ca 0.45 -0.44 -0.00 0.00 -0.37 0.00 0.00 57.07 56.71 3mls s TYR 194 Cb -0.15 -0.87 0.03 0.00 -0.40 0.00 0.00 41.96 40.57 3mls s TYR 194 CO 0.20 -0.45 -0.02 0.96 -1.57 0.00 0.00 175.55 174.67 3mls s ILE 195 N 1.95 0.47 -0.07 2.71 -0.00 -1.26 -0.76 121.20 124.23 3mls s ILE 195 Ca 0.02 0.01 -0.17 0.00 -0.00 0.00 0.00 60.65 60.52 3mls s ILE 195 Cb -0.14 -0.57 -0.05 0.00 -0.00 0.00 0.00 42.46 41.69 3mls s ILE 195 CO -0.07 0.25 0.44 0.00 -0.00 0.00 0.00 174.94 175.56 3mls s ASN 197 N -0.05 5.35 -0.14 0.00 -0.87 -0.31 -1.18 114.94 117.74 3mls s ASN 197 Ca 0.24 -0.48 -0.04 0.00 -1.57 0.00 0.00 52.86 51.00 3mls s ASN 197 Cb -0.16 -1.96 -0.03 0.00 -0.02 0.00 0.00 41.25 39.09 3mls s ASN 197 CO 0.11 -0.15 0.01 -0.69 -2.57 0.00 0.00 177.10 173.80 3mls s VAL 198 N 1.59 4.32 -0.09 1.60 1.01 -0.14 -1.96 120.40 126.73 3mls s VAL 198 Ca 0.05 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.82 3mls s VAL 198 Cb -0.17 -2.89 0.02 0.00 0.00 0.00 0.00 36.38 33.34 3mls s VAL 198 CO 0.05 0.51 -0.11 0.21 0.00 0.00 0.00 175.10 175.77 3mls s ASN 199 N 0.01 2.05 -0.57 3.32 3.84 0.21 -1.22 114.94 122.58 3mls s ASN 199 Ca 0.03 -0.32 0.04 0.00 0.21 0.00 0.00 52.86 52.82 3mls s ASN 199 Cb -0.13 -0.87 0.16 0.00 -0.55 0.00 0.00 41.25 39.86 3mls s ASN 199 CO 0.02 -0.04 0.38 -2.28 -2.79 0.00 0.00 177.10 172.39 3mls s HIS 200 N 1.18 2.70 0.36 0.43 5.65 0.10 0.02 115.29 125.72 3mls s HIS 200 Ca -0.05 -2.93 0.07 0.00 0.25 0.00 0.00 55.06 52.41 3mls s HIS 200 Cb -0.14 -2.20 0.77 0.00 -1.18 0.00 0.00 32.58 29.83 3mls s HIS 200 CO -0.03 -0.68 1.91 0.87 -0.65 0.00 0.00 174.74 176.17 3mls h LYS 201 N 5.87 0.72 -0.95 2.88 1.57 -1.81 -1.48 116.57 123.37 3mls h LYS 201 Ca 0.11 -0.04 0.28 0.00 -1.87 0.00 0.00 60.65 59.12 3mls h LYS 201 Cb 0.84 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.95 3mls h LYS 201 CO 0.60 0.47 0.70 -1.35 -0.57 0.00 0.00 179.45 179.30 3mls h PRO 202 N 0.74 0.00 0.00 3.15 0.11 -1.91 -1.08 132.00 133.01 3mls h PRO 202 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 3mls h PRO 202 Cb 0.49 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.60 3mls h PRO 202 CO -0.15 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.51 3mls n SER 203 N -4.19 1.80 -3.60 -2.05 3.41 -0.94 -4.97 113.62 103.08 3mls n SER 203 Ca 0.20 -1.89 -0.21 0.00 -0.26 0.00 0.00 58.87 56.70 3mls n SER 203 Cb 1.03 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 65.05 3mls n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3mls n ASN 204 N -0.45 -3.36 -4.22 4.04 5.03 -0.41 -4.81 115.26 111.09 3mls n ASN 204 Ca 0.00 -0.66 -0.36 0.00 0.87 0.00 0.00 54.58 54.42 3mls n ASN 204 Cb 0.27 -4.71 -0.13 0.00 -1.02 0.00 0.00 39.78 34.19 3mls n ASN 204 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3mls s THR 205 N -3.41 3.38 -0.13 3.41 2.01 -0.63 -5.00 115.64 115.27 3mls s THR 205 Ca 0.24 -1.30 -0.02 0.00 0.31 0.00 0.00 61.69 60.92 3mls s THR 205 Cb -0.11 -2.95 -0.02 0.00 0.01 0.00 0.00 72.50 69.43 3mls s THR 205 CO 0.76 -0.17 -0.07 -0.54 -0.69 0.00 0.00 174.62 173.91 3mls s LYS 206 N 1.32 3.40 -0.11 4.92 1.02 -1.26 -0.72 119.74 128.30 3mls s LYS 206 Ca -0.03 -0.57 -0.04 0.00 0.02 0.00 0.00 55.97 55.35 3mls s LYS 206 Cb -0.20 -2.76 0.06 0.00 -0.52 0.00 0.00 37.83 34.40 3mls s LYS 206 CO 0.01 0.32 0.16 0.08 -0.92 0.00 0.00 175.35 175.00 3mls s VAL 207 N 0.12 -0.25 -0.08 3.17 1.01 -0.36 -5.01 120.40 118.99 3mls s VAL 207 Ca -0.03 0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 3mls s VAL 207 Cb -0.14 -0.38 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 3mls s VAL 207 CO 0.03 0.06 0.18 -1.81 0.00 0.00 0.00 175.10 173.56 3mls s ASP 208 N 2.28 6.42 -0.14 3.32 1.11 -1.26 -0.96 116.67 127.43 3mls s ASP 208 Ca 0.04 0.48 -0.07 0.00 0.18 0.00 0.00 52.55 53.17 3mls s ASP 208 Cb -0.13 -2.07 0.06 0.00 1.07 0.00 0.00 42.92 41.85 3mls s ASP 208 CO -0.07 0.36 0.34 -0.75 1.18 0.00 0.00 175.17 176.23 3mls s LYS 209 N -1.29 0.29 0.18 8.23 2.20 -0.33 -4.98 119.74 124.05 3mls s LYS 209 Ca 0.19 0.71 -0.19 0.00 -0.36 0.00 0.00 55.97 56.33 3mls s LYS 209 Cb -0.12 -0.03 -0.08 0.00 -1.51 0.00 0.00 37.83 36.09 3mls s LYS 209 CO 0.09 -0.18 0.67 0.21 -0.36 0.00 0.00 175.35 175.77 3mls s LYS 210 N 1.56 4.20 -0.22 4.03 2.36 -1.26 -0.44 119.74 129.97 3mls s LYS 210 Ca -0.08 0.78 -0.04 0.00 -2.55 0.00 0.00 55.97 54.09 3mls s LYS 210 Cb -0.10 -2.96 -0.01 0.00 -1.05 0.00 0.00 37.83 33.71 3mls s LYS 210 CO -0.11 0.46 -0.05 0.08 1.55 0.00 0.00 175.35 177.28 3mls s VAL 211 N -1.43 3.37 -0.08 4.02 1.01 0.06 -4.83 120.40 122.51 3mls s VAL 211 Ca 0.40 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.88 3mls s VAL 211 Cb -0.17 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 3mls s VAL 211 CO 0.21 0.43 -0.06 -1.61 0.00 0.00 0.00 175.10 174.07 3mls s GLU 212 N 1.41 2.90 0.00 2.72 0.41 -1.26 -4.62 118.70 120.26 3mls s GLU 212 Ca 0.05 -0.53 0.00 0.00 -0.41 0.00 0.00 54.97 54.08 3mls s GLU 212 Cb -0.14 -2.66 0.00 0.00 -1.78 0.00 0.00 34.13 29.55 3mls s GLU 212 CO -0.03 0.61 0.04 -2.30 -0.49 0.00 0.00 175.26 173.09