#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 4.56 0.21 6.31 -7.23 -1.26 -4.54 120.40 118.45 3mls s VAL 2 Ca 0.00 2.05 -0.23 0.00 -1.81 0.00 0.00 61.98 61.99 3mls s VAL 2 Cb 0.00 -4.32 0.05 0.00 0.56 0.00 0.00 36.38 32.67 3mls s VAL 2 CO 0.00 0.30 0.82 0.00 -0.31 0.00 0.00 175.10 175.91 3mls s GLN 3 N 0.14 1.47 -0.12 4.82 -2.07 -0.73 -5.01 119.66 118.16 3mls s GLN 3 Ca 0.47 -0.79 0.01 0.00 -1.82 0.00 0.00 55.36 53.23 3mls s GLN 3 Cb -0.23 0.51 0.02 0.00 -1.09 0.00 0.00 33.01 32.23 3mls s GLN 3 CO 0.29 -0.67 -0.12 -0.51 -1.32 0.00 0.00 175.29 172.96 3mls s LEU 4 N -2.90 1.55 -0.23 2.60 1.43 -1.26 -1.98 118.68 117.89 3mls s LEU 4 Ca 0.11 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 52.76 3mls s LEU 4 Cb -0.04 -1.03 0.00 0.00 0.03 0.00 0.00 46.19 45.15 3mls s LEU 4 CO 0.03 -0.05 -0.03 -0.69 0.23 0.00 0.00 176.35 175.84 3mls s VAL 5 N 1.35 3.33 0.42 -1.59 1.01 0.03 -4.09 120.40 120.86 3mls s VAL 5 Ca 0.00 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.33 3mls s VAL 5 Cb -0.14 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3mls s VAL 5 CO -0.06 0.34 0.68 -1.61 0.00 0.00 0.00 175.10 174.45 3mls s GLU 6 N 1.45 3.54 1.01 2.72 2.02 -1.26 -1.17 118.70 127.01 3mls s GLU 6 Ca 0.04 0.01 -0.12 0.00 0.02 0.00 0.00 54.97 54.92 3mls s GLU 6 Cb -0.15 -2.50 0.19 0.00 0.10 0.00 0.00 34.13 31.78 3mls s GLU 6 CO -0.03 -0.04 1.08 -1.54 0.02 0.00 0.00 175.26 174.75 3mls s SER 7 N -3.96 2.46 0.55 -0.19 1.04 -0.38 -4.96 113.70 108.26 3mls s SER 7 Ca 0.45 1.35 -0.18 0.00 0.48 0.00 0.00 55.95 58.05 3mls s SER 7 Cb -0.10 -2.04 -0.06 0.00 0.10 0.00 0.00 66.02 63.93 3mls s SER 7 CO 0.40 -3.25 1.06 -0.83 0.98 0.00 0.00 173.24 171.59 3mls s GLY 8 N -3.23 2.32 0.84 7.32 0.00 -1.26 -4.61 107.32 108.71 3mls s GLY 8 Ca 0.66 0.52 -0.10 0.00 0.00 0.00 0.00 44.72 45.79 3mls s GLY 8 CO 0.59 0.84 1.12 -0.32 0.00 0.00 0.00 173.10 175.33 3mls s GLY 9 N -2.37 1.70 0.22 0.20 0.00 -1.26 -4.86 107.32 100.94 3mls s GLY 9 Ca 0.66 0.45 -0.08 0.00 0.00 0.00 0.00 44.72 45.74 3mls s GLY 9 CO 0.29 0.83 0.34 -0.54 0.00 0.00 0.00 173.10 174.02 3mls s GLU 10 N -4.75 1.38 -0.12 2.90 2.02 -0.51 -4.96 118.70 114.67 3mls s GLU 10 Ca 0.64 -1.37 -0.00 0.00 0.02 0.00 0.00 54.97 54.26 3mls s GLU 10 Cb -0.20 0.39 0.02 0.00 0.10 0.00 0.00 34.13 34.44 3mls s GLU 10 CO 0.57 -0.53 -0.09 0.08 0.02 0.00 0.00 175.26 175.31 3mls s VAL 11 N -4.06 1.11 0.39 2.63 1.01 -1.26 -1.29 120.40 118.94 3mls s VAL 11 Ca 0.27 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 61.95 3mls s VAL 11 Cb 0.02 -1.11 -0.06 0.00 0.00 0.00 0.00 36.38 35.23 3mls s VAL 11 CO 0.09 0.38 0.03 -0.54 0.00 0.00 0.00 175.10 175.06 3mls s LYS 12 N 1.61 1.88 0.21 2.72 -0.14 0.08 -4.98 119.74 121.13 3mls s LYS 12 Ca 0.04 -2.08 0.09 0.00 -1.36 0.00 0.00 55.97 52.65 3mls s LYS 12 Cb -0.13 -1.31 -0.04 0.00 -1.68 0.00 0.00 37.83 34.67 3mls s LYS 12 CO -0.08 -0.16 -0.03 1.14 -0.76 0.00 0.00 175.35 175.46 3mls s GLN 13 N -3.79 2.25 0.31 1.68 -2.07 -1.25 -0.44 119.66 116.34 3mls s GLN 13 Ca 0.31 -1.28 -0.27 0.00 -1.82 0.00 0.00 55.36 52.30 3mls s GLN 13 Cb 0.08 -2.21 -0.14 0.00 -1.09 0.00 0.00 33.01 29.65 3mls s GLN 13 CO 0.15 0.41 0.97 -2.30 -1.32 0.00 0.00 175.29 173.20 3mls n PRO 14 N -0.37 1.27 0.00 9.60 -0.02 -1.26 -2.07 135.00 142.15 3mls n PRO 14 Ca -0.09 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3mls n PRO 14 Cb 0.57 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 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 1.27 3.12 3.78 -1.23 0.00 0.14 -4.94 105.19 107.32 3mls n GLY 15 Ca 0.10 0.00 -0.31 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 -0.37 2.21 0.35 1.61 -0.21 -0.88 -4.24 119.66 118.12 3mls s GLN 16 Ca 0.00 0.99 0.01 0.00 0.02 0.00 0.00 55.36 56.38 3mls s GLN 16 Cb 0.00 -1.90 -0.03 0.00 1.00 0.00 0.00 33.01 32.08 3mls s GLN 16 CO 0.00 -1.63 0.54 -1.54 -2.12 0.00 0.00 175.29 170.54 3mls s SER 17 N -3.56 6.20 -0.13 5.90 1.04 -1.26 0.34 113.70 122.23 3mls s SER 17 Ca 0.61 0.33 -0.22 0.00 0.48 0.00 0.00 55.95 57.14 3mls s SER 17 Cb -0.16 -1.87 0.05 0.00 0.10 0.00 0.00 66.02 64.14 3mls s SER 17 CO 0.56 -0.34 0.56 -0.22 0.98 0.00 0.00 173.24 174.77 3mls s LEU 18 N -4.30 -0.15 -0.18 2.42 2.96 -0.40 -4.93 118.68 114.10 3mls s LEU 18 Ca 0.41 0.84 -0.05 0.00 -0.22 0.00 0.00 54.13 55.11 3mls s LEU 18 Cb -0.10 2.01 0.07 0.00 0.50 0.00 0.00 46.19 48.68 3mls s LEU 18 CO 0.35 -0.36 0.13 -0.75 -1.32 0.00 0.00 176.35 174.40 3mls s LYS 19 N -0.42 0.10 0.16 1.98 2.20 -1.26 -0.31 119.74 122.20 3mls s LYS 19 Ca -0.06 -0.02 0.04 0.00 -0.36 0.00 0.00 55.97 55.58 3mls s LYS 19 Cb -0.03 -1.63 -0.04 0.00 -1.51 0.00 0.00 37.83 34.62 3mls s LYS 19 CO 0.04 -0.68 0.20 0.96 -0.36 0.00 0.00 175.35 175.51 3mls s ILE 20 N 2.19 4.82 0.33 5.43 -4.36 -0.62 -4.95 121.20 124.05 3mls s ILE 20 Ca 0.04 -0.94 0.04 0.00 -0.26 0.00 0.00 60.65 59.52 3mls s ILE 20 Cb -0.16 -3.48 -0.06 0.00 1.25 0.00 0.00 42.46 40.01 3mls s ILE 20 CO -0.11 -0.12 0.06 -0.94 0.24 0.00 0.00 174.94 174.07 3mls s SER 21 N -3.21 2.49 -0.22 4.36 1.04 -1.26 -1.88 113.70 115.02 3mls s SER 21 Ca 0.32 -1.39 -0.04 0.00 0.48 0.00 0.00 55.95 55.33 3mls s SER 21 Cb -0.10 -0.07 0.11 0.00 0.10 0.00 0.00 66.02 66.06 3mls s SER 21 CO 0.26 -0.61 0.34 0.00 0.98 0.00 0.00 173.24 174.20 3mls s LYS 23 N 2.49 3.90 0.41 0.00 2.20 -0.31 -0.29 119.74 128.14 3mls s LYS 23 Ca 0.09 -0.36 0.03 0.00 -0.36 0.00 0.00 55.97 55.37 3mls s LYS 23 Cb -0.15 -3.40 -0.00 0.00 -1.51 0.00 0.00 37.83 32.77 3mls s LYS 23 CO -0.14 0.01 0.60 -1.54 -0.36 0.00 0.00 175.35 173.92 3mls s SER 24 N 1.13 5.83 -0.28 1.43 1.04 -0.63 -0.79 113.70 121.43 3mls s SER 24 Ca 0.06 0.05 -0.24 0.00 0.48 0.00 0.00 55.95 56.29 3mls s SER 24 Cb -0.14 -1.32 0.12 0.00 0.10 0.00 0.00 66.02 64.78 3mls s SER 24 CO 0.04 -0.64 1.01 -0.94 0.98 0.00 0.00 173.24 173.69 3mls s SER 25 N -4.22 -0.47 0.00 7.02 1.04 -0.84 -4.89 113.70 111.33 3mls s SER 25 Ca 0.48 0.90 0.00 0.00 0.48 0.00 0.00 55.95 57.81 3mls s SER 25 Cb -0.10 0.94 0.00 0.00 0.10 0.00 0.00 66.02 66.96 3mls s SER 25 CO 0.35 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.03 3mls n GLY 26 N 2.38 0.50 3.49 7.32 0.00 -1.26 -1.77 105.19 115.85 3mls n GLY 26 Ca -0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.00 0.26 -0.48 1.61 -0.85 -1.26 -4.72 117.35 109.91 3mls s TYR 27 Ca 0.00 -0.62 -0.28 0.00 -0.52 0.00 0.00 57.07 55.65 3mls s TYR 27 Cb 0.00 0.15 0.01 0.00 0.38 0.00 0.00 41.96 42.50 3mls s TYR 27 CO 0.00 -0.88 1.49 1.21 -1.52 0.00 0.00 175.55 175.85 3mls s ASN 28 N -2.97 6.12 0.23 -0.18 3.84 -1.26 -4.86 114.94 115.86 3mls s ASN 28 Ca 0.18 0.62 -0.06 0.00 0.21 0.00 0.00 52.86 53.81 3mls s ASN 28 Cb 0.01 -2.54 0.40 0.00 -0.55 0.00 0.00 41.25 38.56 3mls s ASN 28 CO 0.03 -1.65 1.75 0.15 -2.79 0.00 0.00 177.10 174.59 3mls h PHE 29 N 11.43 0.55 0.00 0.43 3.57 -1.96 -2.29 116.94 128.66 3mls h PHE 29 Ca -0.28 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.26 3mls h PHE 29 Cb 1.11 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.72 3mls h PHE 29 CO 1.00 0.13 0.00 1.28 -2.23 0.00 0.00 178.31 178.49 3mls n LEU 30 N -4.95 0.64 -0.64 0.59 4.77 -1.26 -3.61 117.00 112.53 3mls n LEU 30 Ca 0.13 0.68 0.13 0.00 -0.03 0.00 0.00 56.01 56.91 3mls n LEU 30 Cb 0.35 -0.62 0.33 0.00 -2.33 0.00 0.00 43.42 41.15 3mls n LEU 30 CO 0.21 -0.62 0.73 0.47 -1.33 0.00 0.00 177.39 176.85 3mls n ASP 31 N -2.22 2.06 -3.91 -1.43 10.43 -0.86 -3.21 116.55 117.40 3mls n ASP 31 Ca 0.02 -1.64 -0.17 0.00 2.57 0.00 0.00 54.79 55.56 3mls n ASP 31 Cb 0.19 0.04 -0.15 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 -2.06 0.68 0.64 -2.24 0.01 -1.24 -5.03 113.70 104.47 3mls s SER 32 Ca 0.32 -0.09 -0.18 0.00 1.31 0.00 0.00 55.95 57.30 3mls s SER 32 Cb 0.20 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 66.20 3mls s SER 32 CO 0.35 -0.00 1.27 0.79 0.41 0.00 0.00 173.24 176.06 3mls n TRP 33 N 3.52 1.87 -4.51 2.43 7.02 -1.26 -4.53 117.44 121.98 3mls n TRP 33 Ca -0.20 0.42 -0.33 0.00 -1.02 0.00 0.00 57.50 56.37 3mls n TRP 33 Cb 0.54 -2.26 -0.15 0.00 -2.42 0.00 0.00 31.31 27.01 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 -1.39 2.57 0.31 -0.99 -1.09 0.24 -0.99 121.20 119.87 3mls s ILE 34 Ca 0.82 -0.80 0.08 0.00 -2.23 0.00 0.00 60.65 58.51 3mls s ILE 34 Cb -0.39 -2.08 -0.03 0.00 -1.58 0.00 0.00 42.46 38.38 3mls s ILE 34 CO 0.41 0.52 0.19 -0.83 -1.23 0.00 0.00 174.94 174.00 3mls s GLY 35 N 0.86 1.74 -0.06 6.18 0.00 0.12 -0.51 107.32 115.65 3mls s GLY 35 Ca -0.05 -1.66 0.02 0.00 0.00 0.00 0.00 44.72 43.03 3mls s GLY 35 CO -0.01 -1.62 -0.09 -0.98 0.00 0.00 0.00 173.10 170.39 3mls s TRP 36 N -2.31 1.21 -0.03 1.90 0.52 -0.19 -1.71 118.94 118.33 3mls s TRP 36 Ca 0.37 -0.43 0.05 0.00 0.02 0.00 0.00 56.10 56.11 3mls s TRP 36 Cb -0.05 -0.94 -0.01 0.00 -1.15 0.00 0.00 33.47 31.32 3mls s TRP 36 CO 0.24 -0.26 -0.18 0.08 0.02 0.00 0.00 176.95 176.86 3mls s VAL 37 N 0.79 1.46 0.11 4.03 1.01 -0.72 -0.28 120.40 126.80 3mls s VAL 37 Ca -0.13 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.14 3mls s VAL 37 Cb -0.15 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 3mls s VAL 37 CO 0.02 0.42 0.05 -0.60 0.00 0.00 0.00 175.10 174.99 3mls s ARG 38 N -0.22 2.70 -0.33 2.72 3.52 0.10 -0.31 118.95 127.14 3mls s ARG 38 Ca 0.02 -0.83 0.02 0.00 -0.13 0.00 0.00 55.73 54.80 3mls s ARG 38 Cb -0.09 -2.60 0.15 0.00 -1.56 0.00 0.00 34.95 30.85 3mls s ARG 38 CO 0.01 0.53 0.35 -1.14 -0.81 0.00 0.00 175.30 174.23 3mls s GLN 39 N -2.57 0.49 0.44 5.12 0.74 -0.32 -0.03 119.66 123.53 3mls s GLN 39 Ca 0.28 -0.47 -0.24 0.00 0.05 0.00 0.00 55.36 54.98 3mls s GLN 39 Cb -0.11 -0.65 -0.08 0.00 1.10 0.00 0.00 33.01 33.27 3mls s GLN 39 CO 0.20 -1.11 1.21 0.42 -0.55 0.00 0.00 175.29 175.46 3mls s ILE 40 N 1.92 2.93 -0.10 -2.34 1.01 -1.26 -1.87 121.20 121.50 3mls s ILE 40 Ca 0.13 0.75 -0.40 0.00 0.00 0.00 0.00 60.65 61.13 3mls s ILE 40 Cb -0.14 -3.40 -0.18 0.00 0.01 0.00 0.00 42.46 38.74 3mls s ILE 40 CO -0.18 0.04 1.36 -2.65 0.00 0.00 0.00 174.94 173.51 3mls n PRO 41 N -0.27 0.58 0.00 2.79 -0.02 -1.26 -1.01 135.00 135.82 3mls n PRO 41 Ca 0.06 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3mls n PRO 41 Cb 0.46 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 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 2.72 1.92 3.69 -1.23 0.00 -1.26 -4.99 105.19 106.04 3mls n GLY 42 Ca 0.22 -0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 3mls n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mls s LYS 43 N 0.00 -0.66 0.48 1.61 -0.14 -0.18 -5.09 119.74 115.75 3mls s LYS 43 Ca 0.00 -0.17 -0.02 0.00 -1.36 0.00 0.00 55.97 54.42 3mls s LYS 43 Cb 0.00 -1.67 0.10 0.00 -1.68 0.00 0.00 37.83 34.58 3mls s LYS 43 CO 0.00 -3.32 0.65 0.41 -0.76 0.00 0.00 175.35 172.33 3mls n GLY 44 N -1.79 0.28 3.68 -3.33 0.00 -1.26 -4.70 105.19 98.07 3mls n GLY 44 Ca 0.14 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 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 4.25 -0.07 0.99 1.43 -1.26 -4.43 118.68 119.59 3mls s LEU 45 Ca 0.42 1.70 0.01 0.00 -1.03 0.00 0.00 54.13 55.23 3mls s LEU 45 Cb -0.02 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.62 3mls s LEU 45 CO 0.28 -0.56 -0.08 -1.61 0.23 0.00 0.00 176.35 174.61 3mls s GLU 46 N 2.28 2.74 -0.06 1.70 2.02 0.95 -4.95 118.70 123.38 3mls s GLU 46 Ca 0.53 -0.58 -0.21 0.00 0.02 0.00 0.00 54.97 54.73 3mls s GLU 46 Cb -0.22 -2.56 -0.04 0.00 0.10 0.00 0.00 34.13 31.41 3mls s GLU 46 CO 0.19 0.63 0.60 -0.46 0.02 0.00 0.00 175.26 176.25 3mls s TRP 47 N -0.73 3.59 -0.24 1.61 -0.00 -1.26 0.02 118.94 121.92 3mls s TRP 47 Ca 0.11 1.13 0.03 0.00 -0.00 0.00 0.00 56.10 57.37 3mls s TRP 47 Cb -0.11 -2.67 -0.17 0.00 -0.00 0.00 0.00 33.47 30.52 3mls s TRP 47 CO 0.01 0.18 -0.19 -0.89 -0.00 0.00 0.00 176.95 176.06 3mls n ILE 48 N 3.46 1.40 0.00 5.86 5.41 0.61 -4.61 119.36 131.49 3mls n ILE 48 Ca -0.05 -0.56 0.00 0.00 1.00 0.00 0.00 62.75 63.14 3mls n ILE 48 Cb 0.51 -1.30 0.00 0.00 -0.71 0.00 0.00 39.64 38.14 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 2.29 -0.71 2.97 7.39 0.00 -1.19 -0.98 105.19 114.96 3mls n GLY 49 Ca -0.43 -1.32 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 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 -1.99 0.20 -0.00 -0.61 -4.36 0.88 -1.02 121.20 114.29 3mls s ILE 50 Ca 0.00 -0.64 0.00 0.00 -0.26 0.00 0.00 60.65 59.76 3mls s ILE 50 Cb 0.00 -0.27 -0.00 0.00 1.25 0.00 0.00 42.46 43.44 3mls s ILE 50 CO 0.00 -0.29 -0.02 -0.51 0.24 0.00 0.00 174.94 174.37 3mls s ILE 51 N -0.93 0.13 -0.38 8.37 2.07 0.34 -0.53 121.20 130.27 3mls s ILE 51 Ca -0.09 -0.09 -0.14 0.00 -1.41 0.00 0.00 60.65 58.91 3mls s ILE 51 Cb -0.07 -0.12 0.00 0.00 0.13 0.00 0.00 42.46 42.41 3mls s ILE 51 CO -0.00 0.02 0.29 -0.47 -1.91 0.00 0.00 174.94 172.86 3mls s TYR 52 N -0.08 3.23 0.56 3.50 5.04 0.08 -0.59 117.35 129.09 3mls s TYR 52 Ca 0.00 -0.40 0.27 0.00 -2.44 0.00 0.00 57.07 54.51 3mls s TYR 52 Cb -0.01 -2.56 1.47 0.00 0.35 0.00 0.00 41.96 41.21 3mls s TYR 52 CO -0.00 -0.49 1.98 -1.35 -1.34 0.00 0.00 175.55 174.35 3mls h PRO 52 N 8.57 0.00 -0.43 4.97 0.11 -1.80 0.83 132.00 144.26 3mls h PRO 52 Ca -0.29 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 3mls h PRO 52 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3mls h PRO 52 CO 0.69 0.00 -0.08 0.22 -0.21 0.00 0.00 178.00 178.62 3mls h ASP 53 N 0.00 0.81 0.00 -2.05 3.58 -1.86 -3.35 116.42 113.55 3mls h ASP 53 Ca 0.22 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.32 3mls h ASP 53 Cb 1.00 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.83 3mls h ASP 53 CO -0.00 0.97 0.00 -0.90 -2.88 0.00 0.00 179.24 176.43 3mls n ASP 54 N -4.32 1.14 -2.22 2.28 5.68 -1.14 -5.02 116.55 112.95 3mls n ASP 54 Ca -0.01 -1.52 -0.18 0.00 -0.50 0.00 0.00 54.79 52.58 3mls n ASP 54 Cb 0.36 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.31 3mls n ASP 54 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3mls n SER 55 N -0.26 -5.26 -4.77 -1.12 7.64 0.29 -4.95 113.62 105.19 3mls n SER 55 Ca 0.00 0.13 -0.41 0.00 1.01 0.00 0.00 58.87 59.61 3mls n SER 55 Cb 0.30 -4.46 -0.02 0.00 -1.01 0.00 0.00 64.21 59.02 3mls n SER 55 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3mls s ASP 56 N -2.16 6.75 0.05 6.43 1.11 -1.19 -4.72 116.67 122.94 3mls s ASP 56 Ca 0.00 2.71 0.00 0.00 0.18 0.00 0.00 52.55 55.44 3mls s ASP 56 Cb 0.00 -2.65 -0.03 0.00 1.07 0.00 0.00 42.92 41.31 3mls s ASP 56 CO 0.00 -0.56 -0.05 0.00 1.18 0.00 0.00 175.17 175.75 3mls s ALA 57 N -1.12 0.46 -0.09 5.23 0.00 -1.26 -0.74 121.76 124.25 3mls s ALA 57 Ca 0.49 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.51 3mls s ALA 57 Cb -0.40 0.17 0.03 0.00 0.00 0.00 0.00 23.12 22.91 3mls s ALA 57 CO 0.53 -0.21 -0.03 -1.01 0.00 0.00 0.00 175.76 175.05 3mls s HIS 58 N -2.52 0.96 0.11 0.00 3.76 0.31 -4.98 115.29 112.92 3mls s HIS 58 Ca -0.04 -0.37 0.06 0.00 -0.15 0.00 0.00 55.06 54.56 3mls s HIS 58 Cb -0.02 -0.95 -0.04 0.00 1.11 0.00 0.00 32.58 32.68 3mls s HIS 58 CO -0.04 -0.39 -0.02 0.71 -0.85 0.00 0.00 174.74 174.15 3mls s TYR 59 N 1.87 2.92 0.17 1.40 1.51 -1.26 -0.08 117.35 123.87 3mls s TYR 59 Ca 0.05 -0.07 -0.30 0.00 -1.01 0.00 0.00 57.07 55.74 3mls s TYR 59 Cb -0.12 -1.49 -0.08 0.00 -0.11 0.00 0.00 41.96 40.15 3mls s TYR 59 CO -0.06 0.47 1.25 0.45 -1.11 0.00 0.00 175.55 176.55 3mls s SER 60 N -2.39 7.00 0.58 2.29 0.15 -0.15 -4.81 113.70 116.36 3mls s SER 60 Ca 0.25 2.28 0.34 0.00 0.70 0.00 0.00 55.95 59.52 3mls s SER 60 Cb -0.11 -2.60 1.37 0.00 -1.71 0.00 0.00 66.02 62.96 3mls s SER 60 CO 0.17 -0.46 1.63 -0.65 1.20 0.00 0.00 173.24 175.13 3mls h PRO 61 N 5.58 0.00 -0.10 5.44 0.11 -1.93 0.26 132.00 141.36 3mls h PRO 61 Ca -0.44 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.55 3mls h PRO 61 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3mls h PRO 61 CO 0.77 0.00 -0.48 0.77 -0.21 0.00 0.00 178.00 178.85 3mls h SER 62 N 0.00 0.27 0.00 -2.05 0.02 -1.94 -3.32 113.55 106.52 3mls h SER 62 Ca 0.52 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 3mls h SER 62 Cb 2.46 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 64.93 3mls h SER 62 CO -0.01 0.71 -1.49 0.49 -1.14 0.00 0.00 176.83 175.40 3mls n PHE 63 N -3.97 0.00 -1.63 3.45 3.72 0.86 -4.85 117.46 115.04 3mls n PHE 63 Ca -0.02 0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 56.90 3mls n PHE 63 Cb 0.53 -0.28 -0.05 0.00 -0.94 0.00 0.00 39.48 38.75 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 -1.89 1.97 0.00 -1.08 0.00 -0.80 0.15 120.64 118.99 3mls n GLU 64 Ca -0.01 0.68 0.00 0.00 0.00 0.00 0.00 57.16 57.83 3mls n GLU 64 Cb 0.39 -2.71 0.00 0.00 0.00 0.00 0.00 31.44 29.12 3mls n GLU 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3mls n GLY 65 N 4.99 2.09 0.10 8.31 0.00 -1.26 -4.85 105.19 114.56 3mls n GLY 65 Ca 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.19 3mls n GLY 65 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3mls n GLN 66 N -2.00 0.68 -4.16 1.61 7.27 0.12 -4.98 117.38 115.93 3mls n GLN 66 Ca 0.00 0.05 -0.11 0.00 0.07 0.00 0.00 57.00 57.01 3mls n GLN 66 Cb 0.00 -1.57 -0.10 0.00 2.41 0.00 0.00 30.24 30.98 3mls n GLN 66 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 3mls s VAL 67 N -2.51 0.69 -0.09 1.69 0.11 -0.88 -4.67 120.40 114.75 3mls s VAL 67 Ca -0.09 -1.80 0.01 0.00 -2.93 0.00 0.00 61.98 57.17 3mls s VAL 67 Cb 0.06 -1.52 0.02 0.00 -1.53 0.00 0.00 36.38 33.41 3mls s VAL 67 CO 0.83 -0.79 -0.11 -0.89 -3.33 0.00 0.00 175.10 170.81 3mls s THR 68 N -3.24 1.17 0.14 5.04 2.01 -0.05 -4.79 115.64 115.93 3mls s THR 68 Ca 0.09 -0.46 -0.07 0.00 0.31 0.00 0.00 61.69 61.55 3mls s THR 68 Cb 0.03 -1.10 -0.06 0.00 0.01 0.00 0.00 72.50 71.37 3mls s THR 68 CO -0.04 0.37 0.42 -0.04 -0.69 0.00 0.00 174.62 174.65 3mls s MET 69 N 1.01 3.70 -0.10 4.92 -1.94 -1.26 -1.37 119.30 124.26 3mls s MET 69 Ca -0.08 0.07 -0.32 0.00 -1.71 0.00 0.00 55.69 53.65 3mls s MET 69 Cb -0.15 -2.85 0.12 0.00 2.01 0.00 0.00 34.83 33.96 3mls s MET 69 CO -0.01 0.46 1.05 -1.54 -0.01 0.00 0.00 175.02 174.98 3mls s SER 70 N -2.21 -0.25 0.09 3.03 1.04 -1.09 -5.00 113.70 109.31 3mls s SER 70 Ca 0.40 0.01 0.02 0.00 0.48 0.00 0.00 55.95 56.85 3mls s SER 70 Cb -0.12 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.21 3mls s SER 70 CO 0.22 -0.42 -0.07 0.68 0.98 0.00 0.00 173.24 174.64 3mls s VAL 71 N -2.72 0.65 -0.40 5.02 -7.23 -1.26 0.14 120.40 114.61 3mls s VAL 71 Ca 0.07 -1.81 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 3mls s VAL 71 Cb -0.01 -1.53 0.11 0.00 0.56 0.00 0.00 36.38 35.51 3mls s VAL 71 CO -0.07 -0.81 0.13 -0.62 -0.31 0.00 0.00 175.10 173.42 3mls s ASP 72 N -2.84 4.79 0.23 4.85 -1.08 0.36 -4.98 116.67 118.00 3mls s ASP 72 Ca 0.09 -2.33 -0.07 0.00 -0.52 0.00 0.00 52.55 49.72 3mls s ASP 72 Cb 0.03 -1.67 0.38 0.00 -1.46 0.00 0.00 42.92 40.20 3mls s ASP 72 CO -0.04 -0.38 1.69 0.11 0.52 0.00 0.00 175.17 177.07 3mls h LYS 73 N 7.45 0.24 0.00 4.34 1.57 -1.88 -1.16 116.57 127.14 3mls h LYS 73 Ca -0.06 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3mls h LYS 73 Cb 1.00 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.25 3mls h LYS 73 CO 0.59 0.16 0.22 0.66 -0.57 0.00 0.00 179.45 180.51 3mls h SER 74 N 0.25 0.00 0.00 0.86 4.64 -1.97 -2.27 113.55 115.06 3mls h SER 74 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3mls h SER 74 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3mls h SER 74 CO -0.47 0.00 -0.31 2.30 -0.87 0.00 0.00 176.83 177.48 3mls n ILE 75 N -2.22 0.32 -3.83 0.95 -5.35 -0.50 -5.04 119.36 103.70 3mls n ILE 75 Ca -0.01 -0.38 -0.32 0.00 -0.27 0.00 0.00 62.75 61.77 3mls n ILE 75 Cb 0.24 0.49 0.02 0.00 -1.74 0.00 0.00 39.64 38.65 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 -0.23 -3.58 -3.87 7.28 7.64 -0.85 -4.78 113.62 115.23 3mls n SER 76 Ca 0.02 -1.06 -0.18 0.00 1.01 0.00 0.00 58.87 58.65 3mls n SER 76 Cb 0.63 -2.99 -0.16 0.00 -1.01 0.00 0.00 64.21 60.68 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 -3.63 0.38 -0.01 0.44 2.01 -1.17 -1.60 115.64 112.06 3mls s THR 77 Ca 0.33 -0.04 -0.04 0.00 0.31 0.00 0.00 61.69 62.25 3mls s THR 77 Cb -0.13 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 3mls s THR 77 CO 0.89 0.19 0.21 0.00 -0.69 0.00 0.00 174.62 175.21 3mls s ALA 78 N 0.90 3.93 0.29 7.40 0.00 0.60 -0.48 121.76 134.40 3mls s ALA 78 Ca -0.11 -0.71 0.05 0.00 0.00 0.00 0.00 51.96 51.19 3mls s ALA 78 Cb -0.14 -1.93 -0.06 0.00 0.00 0.00 0.00 23.12 20.99 3mls s ALA 78 CO -0.00 0.72 0.00 0.71 0.00 0.00 0.00 175.76 177.19 3mls s TYR 79 N -1.31 1.89 -0.12 0.00 1.51 0.38 -0.36 117.35 119.34 3mls s TYR 79 Ca 0.27 -0.85 -0.05 0.00 -1.01 0.00 0.00 57.07 55.44 3mls s TYR 79 Cb -0.13 -1.16 0.06 0.00 -0.11 0.00 0.00 41.96 40.62 3mls s TYR 79 CO 0.18 0.11 0.25 -1.17 -1.11 0.00 0.00 175.55 173.80 3mls s LEU 80 N -3.44 -0.12 0.13 -1.29 2.96 -0.79 -2.69 118.68 113.44 3mls s LEU 80 Ca 0.32 0.55 0.05 0.00 -0.22 0.00 0.00 54.13 54.83 3mls s LEU 80 Cb 0.06 0.66 -0.04 0.00 0.50 0.00 0.00 46.19 47.37 3mls s LEU 80 CO 0.13 -0.22 -0.12 0.00 -1.32 0.00 0.00 176.35 174.82 3mls s GLN 81 N 2.15 1.00 0.00 1.98 -2.07 -0.47 -1.59 119.66 120.66 3mls s GLN 81 Ca -0.01 -1.31 0.00 0.00 -1.82 0.00 0.00 55.36 52.22 3mls s GLN 81 Cb -0.12 -0.71 0.00 0.00 -1.09 0.00 0.00 33.01 31.09 3mls s GLN 81 CO -0.08 0.11 0.00 0.91 -1.32 0.00 0.00 175.29 174.91 3mls n TRP 82 N 0.24 0.00 -1.26 9.60 8.01 0.57 -0.87 117.44 133.74 3mls n TRP 82 Ca -0.13 0.00 -0.54 0.00 -1.31 0.00 0.00 57.50 55.51 3mls n TRP 82 Cb 0.59 0.00 -0.12 0.00 -2.01 0.00 0.00 31.31 29.76 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 0.00 -2.47 -0.99 -1.04 -1.25 -1.27 114.28 107.26 3mls n THR 82 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 3mls n THR 82 Cb 0.00 -0.48 -0.03 0.00 -1.82 0.00 0.00 70.33 67.99 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 6.40 3.73 0.19 -4.42 1.43 0.15 -4.82 118.68 121.34 3mls s LEU 82 Ca 1.19 1.73 0.04 0.00 -1.03 0.00 0.00 54.13 56.06 3mls s LEU 82 Cb -1.40 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 40.24 3mls s LEU 82 CO 0.60 -0.68 -0.05 -1.10 0.23 0.00 0.00 176.35 175.35 3mls s GLN 83 N -3.66 1.20 0.43 1.70 -0.21 -1.26 -0.68 119.66 117.17 3mls s GLN 83 Ca 0.62 -1.56 0.11 0.00 0.02 0.00 0.00 55.36 54.55 3mls s GLN 83 Cb -0.12 -0.60 0.93 0.00 1.00 0.00 0.00 33.01 34.21 3mls s GLN 83 CO 0.25 -0.02 2.01 0.00 -2.12 0.00 0.00 175.29 175.41 3mls h ALA 84 N 2.63 1.68 0.00 6.09 0.00 -1.97 -1.26 119.26 126.42 3mls h ALA 84 Ca -0.37 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3mls h ALA 84 Cb 1.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3mls h ALA 84 CO 0.64 0.24 0.00 -1.13 0.00 0.00 0.00 179.25 179.00 3mls n SER 85 N -4.39 0.00 -0.18 0.00 3.41 -1.26 -2.16 113.62 109.04 3mls n SER 85 Ca -0.00 -0.10 0.13 0.00 -0.26 0.00 0.00 58.87 58.63 3mls n SER 85 Cb 0.18 -0.21 0.38 0.00 -0.26 0.00 0.00 64.21 64.29 3mls n SER 85 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3mls n ASP 86 N -1.21 0.85 -4.69 4.04 8.00 -0.48 -4.93 116.55 118.13 3mls n ASP 86 Ca 0.09 -0.71 -0.41 0.00 0.71 0.00 0.00 54.79 54.47 3mls n ASP 86 Cb 0.11 0.13 0.01 0.00 -0.02 0.00 0.00 41.12 41.36 3mls n ASP 86 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3mls n THR 87 N -0.87 2.58 0.00 -3.53 -1.04 -0.92 -4.88 114.28 105.62 3mls n THR 87 Ca 0.11 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 3mls n THR 87 Cb 0.34 -1.53 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 3mls n THR 87 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3mls n GLY 88 N 0.85 1.23 3.64 3.41 0.00 0.19 -4.59 105.19 109.92 3mls n GLY 88 Ca 0.07 -1.63 -0.37 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.62 4.04 -0.23 1.61 2.20 -0.78 -0.39 119.74 124.57 3mls s LYS 89 Ca 0.00 -0.29 -0.09 0.00 -0.36 0.00 0.00 55.97 55.24 3mls s LYS 89 Cb 0.00 -3.52 -0.04 0.00 -1.51 0.00 0.00 37.83 32.76 3mls s LYS 89 CO 0.00 0.04 0.11 0.71 -0.36 0.00 0.00 175.35 175.85 3mls s TYR 90 N 1.10 3.20 0.01 4.03 1.51 -0.65 -1.17 117.35 125.38 3mls s TYR 90 Ca 0.07 -0.06 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 3mls s TYR 90 Cb -0.14 -2.22 -0.04 0.00 -0.11 0.00 0.00 41.96 39.45 3mls s TYR 90 CO 0.05 -0.10 0.08 -0.06 -1.11 0.00 0.00 175.55 174.41 3mls s PHE 91 N 1.18 3.27 -0.13 2.71 0.40 0.58 -0.80 117.98 125.18 3mls s PHE 91 Ca 0.06 0.18 0.00 0.00 -0.60 0.00 0.00 56.93 56.57 3mls s PHE 91 Cb -0.14 -1.72 -0.01 0.00 0.51 0.00 0.00 43.02 41.66 3mls s PHE 91 CO 0.04 0.54 -0.14 0.00 0.70 0.00 0.00 175.22 176.36 3mls s THR 93 N 0.48 0.11 -0.16 0.00 -1.32 -0.69 0.81 115.64 114.86 3mls s THR 93 Ca -0.10 -0.87 -0.06 0.00 -1.21 0.00 0.00 61.69 59.45 3mls s THR 93 Cb -0.16 -0.42 -0.04 0.00 -1.51 0.00 0.00 72.50 70.38 3mls s THR 93 CO 0.05 -0.48 0.05 0.00 -2.21 0.00 0.00 174.62 172.03 3mls s ARG 94 N -1.60 3.74 -0.33 7.08 1.04 0.27 0.12 118.95 129.27 3mls s ARG 94 Ca -0.14 -0.35 -0.24 0.00 -1.04 0.00 0.00 55.73 53.96 3mls s ARG 94 Cb -0.08 -3.11 0.01 0.00 -2.04 0.00 0.00 34.95 29.72 3mls s ARG 94 CO -0.01 0.39 0.83 -1.17 -0.04 0.00 0.00 175.30 175.30 3mls s LEU 95 N 0.04 4.07 0.01 -1.89 2.96 -0.16 -2.87 118.68 120.83 3mls s LEU 95 Ca 0.05 0.63 -0.16 0.00 -0.22 0.00 0.00 54.13 54.43 3mls s LEU 95 Cb -0.12 -3.14 -0.06 0.00 0.50 0.00 0.00 46.19 43.37 3mls s LEU 95 CO 0.01 -0.70 0.45 -0.47 -1.32 0.00 0.00 176.35 174.32 3mls s TYR 96 N 3.12 3.73 -0.38 5.38 6.14 0.85 -4.07 117.35 132.12 3mls s TYR 96 Ca 0.34 1.05 -0.17 0.00 0.64 0.00 0.00 57.07 58.93 3mls s TYR 96 Cb -0.13 -2.36 0.00 0.00 0.42 0.00 0.00 41.96 39.89 3mls s TYR 96 CO 0.14 0.59 0.42 -1.17 0.64 0.00 0.00 175.55 176.18 3mls s LEU 97 N -0.94 4.59 -0.51 6.97 2.96 -1.26 -2.34 118.68 128.15 3mls s LEU 97 Ca 0.25 -0.37 -0.19 0.00 -0.22 0.00 0.00 54.13 53.60 3mls s LEU 97 Cb -0.17 -2.41 0.06 0.00 0.50 0.00 0.00 46.19 44.17 3mls s LEU 97 CO 0.14 -0.47 0.63 -0.36 -1.32 0.00 0.00 176.35 174.98 3mls s PHE 98 N 2.14 3.05 -0.01 5.38 0.40 0.70 -4.97 117.98 124.66 3mls s PHE 98 Ca 0.13 -0.58 -0.20 0.00 -0.60 0.00 0.00 56.93 55.68 3mls s PHE 98 Cb -0.16 -3.58 -0.05 0.00 0.51 0.00 0.00 43.02 39.73 3mls s PHE 98 CO 0.13 -1.05 0.57 -1.21 0.70 0.00 0.00 175.22 174.35 3mls s GLU 99 N 2.62 4.29 0.00 0.44 2.02 -1.26 -1.63 118.70 125.17 3mls s GLU 99 Ca 0.15 0.68 0.00 0.00 0.02 0.00 0.00 54.97 55.82 3mls s GLU 99 Cb -0.20 -3.34 0.00 0.00 0.10 0.00 0.00 34.13 30.69 3mls s GLU 99 CO 0.11 0.37 0.00 0.41 0.02 0.00 0.00 175.26 176.17 3mls n GLY 100 N 2.48 1.54 0.44 -1.39 0.00 -1.26 -5.01 105.19 101.99 3mls n GLY 100 Ca -0.07 -0.32 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 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 2.00 -0.66 -4.87 4.61 0.00 -2.08 -3.50 119.26 114.76 3mls h ALA 100 Ca 0.00 0.03 -0.53 0.00 0.00 0.00 0.00 54.91 54.40 3mls h ALA 100 Cb 0.00 1.07 -0.12 0.00 0.00 0.00 0.00 17.79 18.74 3mls h ALA 100 CO 0.00 -0.99 -0.44 1.04 0.00 0.00 0.00 179.25 178.86 3mls n GLN 100 N -5.39 0.63 0.00 0.00 3.00 -1.26 -5.30 117.38 109.06 3mls n GLN 100 Ca -0.02 -3.27 0.00 0.00 -0.01 0.00 0.00 57.00 53.70 3mls n GLN 100 Cb 0.34 1.68 0.00 0.00 0.00 0.00 0.00 30.24 32.26 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 -1.52 0.00 -3.98 1.08 3.41 -0.65 -4.94 113.62 107.02 3mls n SER 100 Ca -0.07 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.43 3mls n SER 100 Cb 0.58 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.41 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 0.37 0.09 4.04 -0.87 -1.26 -0.22 114.94 117.10 3mls s ASN 100 Ca 0.00 -0.40 -0.24 0.00 -1.57 0.00 0.00 52.86 50.65 3mls s ASN 100 Cb 0.00 0.06 0.06 0.00 -0.02 0.00 0.00 41.25 41.35 3mls s ASN 100 CO 0.00 -0.20 0.59 0.00 -2.57 0.00 0.00 177.10 174.92 3mls s ALA 100 N -1.09 -1.53 -0.80 0.60 0.00 -0.99 -4.96 121.76 112.99 3mls s ALA 100 Ca -0.11 0.64 -0.22 0.00 0.00 0.00 0.00 51.96 52.27 3mls s ALA 100 Cb -0.08 0.60 0.08 0.00 0.00 0.00 0.00 23.12 23.72 3mls s ALA 100 CO -0.00 -0.63 1.13 -0.06 0.00 0.00 0.00 175.76 176.20 3mls s PHE 100 N -3.00 2.70 -0.02 0.00 0.08 -1.26 -0.11 117.98 116.37 3mls s PHE 100 Ca -0.02 -0.73 0.02 0.00 0.12 0.00 0.00 56.93 56.32 3mls s PHE 100 Cb -0.01 -4.41 -0.25 0.00 -0.57 0.00 0.00 43.02 37.78 3mls s PHE 100 CO -0.06 -1.72 0.74 0.38 -0.10 0.00 0.00 175.22 174.46 3mls h ASP 101 N 9.49 0.23 -3.40 1.36 2.03 -1.90 -3.47 116.42 120.78 3mls h ASP 101 Ca -0.10 -0.40 -0.65 0.00 -0.73 0.00 0.00 57.03 55.15 3mls h ASP 101 Cb 1.05 -0.08 -0.21 0.00 -0.83 0.00 0.00 39.33 39.26 3mls h ASP 101 CO 1.22 1.34 -0.69 -0.22 -1.03 0.00 0.00 179.24 179.86 3mls s LEU 102 N -6.68 3.16 0.06 0.15 1.98 -1.23 -5.01 118.68 111.11 3mls s LEU 102 Ca -0.09 -0.12 0.05 0.00 -2.89 0.00 0.00 54.13 51.07 3mls s LEU 102 Cb 0.07 -1.73 -0.03 0.00 0.66 0.00 0.00 46.19 45.16 3mls s LEU 102 CO 0.83 0.23 -0.13 0.26 -1.89 0.00 0.00 176.35 175.64 3mls s TRP 103 N 0.02 1.13 0.92 5.38 0.52 -1.26 -0.57 118.94 125.07 3mls s TRP 103 Ca -0.00 -0.45 -0.14 0.00 0.02 0.00 0.00 56.10 55.53 3mls s TRP 103 Cb -0.14 -0.64 0.18 0.00 -1.15 0.00 0.00 33.47 31.72 3mls s TRP 103 CO 0.03 0.03 1.27 0.20 0.02 0.00 0.00 176.95 178.50 3mls s GLY 104 N -1.63 1.77 0.08 0.98 0.00 0.24 -4.52 107.32 104.24 3mls s GLY 104 Ca -0.03 -1.23 0.28 0.00 0.00 0.00 0.00 44.72 43.74 3mls s GLY 104 CO 0.02 -0.51 1.82 0.61 0.00 0.00 0.00 173.10 175.04 3mls n GLN 105 N -3.61 0.10 0.00 2.90 0.00 -1.26 -4.74 117.38 110.77 3mls n GLN 105 Ca 0.15 0.08 0.00 0.00 0.00 0.00 0.00 57.00 57.22 3mls n GLN 105 Cb 0.60 -1.61 0.00 0.00 0.00 0.00 0.00 30.24 29.23 3mls n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3mls n GLY 106 N 1.43 0.05 3.07 2.61 0.00 -1.26 -5.00 105.19 106.09 3mls n GLY 106 Ca 0.06 -1.51 -0.32 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.47 2.22 0.06 2.61 2.01 0.02 -4.87 115.64 115.22 3mls s THR 107 Ca 0.00 -1.64 -0.31 0.00 0.31 0.00 0.00 61.69 60.05 3mls s THR 107 Cb 0.00 -2.31 -0.06 0.00 0.01 0.00 0.00 72.50 70.13 3mls s THR 107 CO 0.00 -0.05 1.27 -0.32 -0.69 0.00 0.00 174.62 174.83 3mls s MET 108 N 1.10 4.38 -0.15 4.92 0.00 -1.26 -1.64 119.30 126.66 3mls s MET 108 Ca -0.08 1.87 0.00 0.00 0.00 0.00 0.00 55.69 57.47 3mls s MET 108 Cb -0.20 -3.35 0.03 0.00 0.00 0.00 0.00 34.83 31.30 3mls s MET 108 CO -0.05 -0.35 -0.11 0.42 0.00 0.00 0.00 175.02 174.93 3mls s ILE 109 N 1.27 1.38 -0.28 10.11 -1.09 0.48 -1.42 121.20 131.65 3mls s ILE 109 Ca 0.61 -0.58 -0.06 0.00 -2.23 0.00 0.00 60.65 58.39 3mls s ILE 109 Cb -0.31 -1.36 0.01 0.00 -1.58 0.00 0.00 42.46 39.21 3mls s ILE 109 CO 0.29 0.37 0.04 -0.22 -1.23 0.00 0.00 174.94 174.19 3mls s LEU 110 N 1.55 3.60 -0.38 2.97 2.96 -0.41 -0.63 118.68 128.34 3mls s LEU 110 Ca 0.04 -0.66 -0.13 0.00 -0.22 0.00 0.00 54.13 53.16 3mls s LEU 110 Cb -0.13 -1.83 0.01 0.00 0.50 0.00 0.00 46.19 44.74 3mls s LEU 110 CO -0.09 -0.15 0.25 -0.69 -1.32 0.00 0.00 176.35 174.35 3mls s VAL 111 N 1.48 5.02 0.10 1.68 1.01 -1.26 -0.74 120.40 127.68 3mls s VAL 111 Ca 0.03 -0.60 -0.15 0.00 0.00 0.00 0.00 61.98 61.25 3mls s VAL 111 Cb -0.17 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.51 3mls s VAL 111 CO 0.01 -0.20 0.37 -0.55 0.00 0.00 0.00 175.10 174.73 3mls s SER 112 N 1.65 -0.19 0.22 3.32 0.15 0.41 -4.62 113.70 114.65 3mls s SER 112 Ca 0.04 -0.31 0.24 0.00 0.70 0.00 0.00 55.95 56.62 3mls s SER 112 Cb -0.19 0.44 0.26 0.00 -1.71 0.00 0.00 66.02 64.83 3mls s SER 112 CO 0.09 -0.79 1.32 0.77 1.20 0.00 0.00 173.24 175.83 3mls h SER 113 N 2.58 0.00 -3.63 5.45 4.64 -1.91 -3.34 113.55 117.34 3mls h SER 113 Ca -0.33 -0.08 -0.56 0.00 -0.47 0.00 0.00 61.79 60.35 3mls h SER 113 Cb 1.24 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 63.50 3mls h SER 113 CO 0.48 0.04 0.02 0.61 -0.87 0.00 0.00 176.83 177.10 3mls n GLY 114 N 1.23 -0.61 3.04 -0.77 0.00 -1.26 -5.04 105.19 101.79 3mls n GLY 114 Ca 0.02 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.59 3mls n GLY 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mls s THR 115 N -1.77 0.62 -0.34 2.61 -4.23 -1.26 -5.05 115.64 106.22 3mls s THR 115 Ca 0.73 -0.78 -0.42 0.00 -1.18 0.00 0.00 61.69 60.04 3mls s THR 115 Cb -0.36 -0.61 -0.17 0.00 1.34 0.00 0.00 72.50 72.70 3mls s THR 115 CO 0.51 -0.13 1.73 0.41 -0.54 0.00 0.00 174.62 176.59 3mls n THR 116 N 2.05 0.22 -3.87 3.99 -1.04 -1.24 -4.67 114.28 109.73 3mls n THR 116 Ca -0.18 -0.04 -0.11 0.00 -2.04 0.00 0.00 64.05 61.67 3mls n THR 116 Cb 0.56 -1.04 -0.10 0.00 -1.82 0.00 0.00 70.33 67.93 3mls n THR 116 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3mls s LYS 117 N 3.53 0.47 0.66 -2.82 1.02 0.51 -4.96 119.74 118.16 3mls s LYS 117 Ca 1.01 -0.36 -0.11 0.00 0.02 0.00 0.00 55.97 56.53 3mls s LYS 117 Cb -1.19 0.20 -0.01 0.00 -0.52 0.00 0.00 37.83 36.32 3mls s LYS 117 CO 0.70 -0.11 1.05 0.20 -0.92 0.00 0.00 175.35 176.27 3mls s GLY 118 N -1.31 1.63 0.31 -3.33 0.00 -1.26 -2.85 107.32 100.51 3mls s GLY 118 Ca -0.14 -0.30 0.02 0.00 0.00 0.00 0.00 44.72 44.31 3mls s GLY 118 CO 0.02 0.03 0.48 2.56 0.00 0.00 0.00 173.10 176.19 3mls s PRO 119 N -5.25 3.47 -0.08 2.90 0.04 -1.26 -4.60 135.00 130.22 3mls s PRO 119 Ca 0.56 -0.48 -0.14 0.00 0.04 0.00 0.00 61.00 60.98 3mls s PRO 119 Cb -0.11 -2.74 -0.05 0.00 0.04 0.00 0.00 34.50 31.64 3mls s PRO 119 CO 0.52 0.24 0.35 -1.12 0.04 0.00 0.00 177.00 177.03 3mls s SER 120 N -4.02 6.63 -0.18 6.66 0.01 -0.51 -4.87 113.70 117.43 3mls s SER 120 Ca 0.38 0.75 -0.02 0.00 1.31 0.00 0.00 55.95 58.37 3mls s SER 120 Cb -0.09 -2.21 -0.01 0.00 0.21 0.00 0.00 66.02 63.91 3mls s SER 120 CO 0.34 0.22 -0.08 -0.69 0.41 0.00 0.00 173.24 173.44 3mls s VAL 121 N -0.38 3.28 -0.05 3.43 1.01 -1.26 -0.36 120.40 126.06 3mls s VAL 121 Ca 0.21 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 61.69 3mls s VAL 121 Cb -0.15 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 3mls s VAL 121 CO 0.09 0.47 -0.19 -0.36 0.00 0.00 0.00 175.10 175.11 3mls s PHE 122 N 0.90 2.58 0.34 5.22 0.08 0.45 -4.92 117.98 122.63 3mls s PHE 122 Ca -0.02 -0.40 -0.27 0.00 0.12 0.00 0.00 56.93 56.36 3mls s PHE 122 Cb -0.15 -1.62 -0.09 0.00 -0.57 0.00 0.00 43.02 40.59 3mls s PHE 122 CO 0.00 -0.00 1.07 -1.25 -0.10 0.00 0.00 175.22 174.94 3mls s PRO 123 N -0.45 4.41 -0.82 0.24 0.04 -1.26 0.11 135.00 137.28 3mls s PRO 123 Ca 0.05 1.65 0.02 0.00 0.04 0.00 0.00 61.00 62.76 3mls s PRO 123 Cb -0.12 -2.88 0.26 0.00 0.04 0.00 0.00 34.50 31.80 3mls s PRO 123 CO 0.02 0.05 0.95 1.28 0.04 0.00 0.00 177.00 179.33 3mls n LEU 124 N 0.58 4.56 -4.51 -3.56 4.77 0.25 -4.83 117.00 114.27 3mls n LEU 124 Ca 0.02 -5.31 -0.45 0.00 -0.03 0.00 0.00 56.01 50.23 3mls n LEU 124 Cb 0.47 -0.92 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 3mls n LEU 124 CO 0.49 1.85 0.32 0.00 -1.33 0.00 0.00 177.39 178.73 3mls n ALA 125 N 1.31 -1.21 -1.72 -1.18 0.00 -1.26 -1.05 120.51 115.39 3mls n ALA 125 Ca 0.27 0.38 -0.32 0.00 0.00 0.00 0.00 53.44 53.76 3mls n ALA 125 Cb 0.38 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 17.97 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 -1.39 3.47 0.37 0.00 0.04 -1.26 -4.78 135.00 131.45 3mls s PRO 126 Ca 0.61 1.05 -0.12 0.00 0.04 0.00 0.00 61.00 62.58 3mls s PRO 126 Cb -0.76 -2.06 0.05 0.00 0.04 0.00 0.00 34.50 31.77 3mls s PRO 126 CO 0.58 -0.67 0.70 0.43 0.04 0.00 0.00 177.00 178.08 3mls n SER 127 N -2.12 -2.03 0.00 6.66 7.64 -1.26 -2.48 113.62 120.02 3mls n SER 127 Ca 0.08 -2.58 0.05 0.00 1.01 0.00 0.00 58.87 57.43 3mls n SER 127 Cb 0.53 3.43 0.24 0.00 -1.01 0.00 0.00 64.21 67.40 3mls n SER 127 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3mls n SER 128 N -1.53 0.00 0.06 6.43 3.41 -1.26 0.20 113.62 120.93 3mls n SER 128 Ca -0.07 0.44 0.08 0.00 -0.26 0.00 0.00 58.87 59.06 3mls n SER 128 Cb 0.57 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 64.00 3mls n SER 128 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3mls n LYS 129 N -1.47 0.62 -0.13 4.33 4.76 -1.26 -3.98 118.16 121.04 3mls n LYS 129 Ca 0.03 0.10 0.08 0.00 -2.87 0.00 0.00 58.31 55.64 3mls n LYS 129 Cb 0.12 -1.77 0.14 0.00 -1.84 0.00 0.00 35.03 31.68 3mls n LYS 129 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 3mls n SER 130 N -2.68 2.78 -4.53 4.39 7.64 0.13 -4.93 113.62 116.43 3mls n SER 130 Ca -0.04 -1.83 -0.37 0.00 1.01 0.00 0.00 58.87 57.64 3mls n SER 130 Cb 0.65 -0.17 -0.12 0.00 -1.01 0.00 0.00 64.21 63.57 3mls n SER 130 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3mls s THR 131 N -1.12 4.89 0.00 0.44 -4.23 0.64 -0.40 115.64 115.86 3mls s THR 131 Ca 0.25 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.76 3mls s THR 131 Cb 0.15 -3.33 0.00 0.00 1.34 0.00 0.00 72.50 70.66 3mls s THR 131 CO 0.20 0.27 0.00 -0.24 -0.54 0.00 0.00 174.62 174.31 3mls n SER 132 N 5.01 0.00 -4.04 3.99 2.88 0.17 -4.93 113.62 116.69 3mls n SER 132 Ca -0.15 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 56.97 3mls n SER 132 Cb 0.52 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.97 3mls n SER 132 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3mls n GLY 133 N 5.00 4.87 2.78 0.46 0.00 -1.26 -4.55 105.19 112.49 3mls n GLY 133 Ca 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 46.02 43.37 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 1.65 0.96 3.35 -0.02 0.00 -1.26 -5.01 105.19 104.86 3mls n GLY 134 Ca 0.26 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.82 2.42 0.03 2.61 -4.23 -1.26 -0.98 115.64 110.40 3mls s THR 135 Ca 0.00 -0.95 0.08 0.00 -1.18 0.00 0.00 61.69 59.64 3mls s THR 135 Cb 0.00 -1.90 -0.03 0.00 1.34 0.00 0.00 72.50 71.91 3mls s THR 135 CO 0.00 0.58 -0.23 0.00 -0.54 0.00 0.00 174.62 174.43 3mls s ALA 136 N -0.46 2.37 -0.19 3.99 0.00 0.32 0.43 121.76 128.22 3mls s ALA 136 Ca 0.05 -1.21 -0.04 0.00 0.00 0.00 0.00 51.96 50.76 3mls s ALA 136 Cb -0.12 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.39 3mls s ALA 136 CO 0.01 0.55 -0.03 0.00 0.00 0.00 0.00 175.76 176.29 3mls s ALA 137 N -0.81 2.94 0.09 0.00 0.00 0.46 0.34 121.76 124.79 3mls s ALA 137 Ca 0.12 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.13 3mls s ALA 137 Cb -0.10 -1.66 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 3mls s ALA 137 CO 0.03 -0.09 -0.08 -0.48 0.00 0.00 0.00 175.76 175.14 3mls s LEU 138 N 0.89 2.44 0.00 0.00 0.05 -0.85 -4.13 118.68 117.08 3mls s LEU 138 Ca -0.00 -0.88 0.00 0.00 0.05 0.00 0.00 54.13 53.30 3mls s LEU 138 Cb -0.14 -0.18 0.00 0.00 -2.05 0.00 0.00 46.19 43.81 3mls s LEU 138 CO 0.01 -0.35 0.00 0.61 -0.55 0.00 0.00 176.35 176.07 3mls n GLY 139 N 0.34 2.36 2.97 -3.48 0.00 -0.21 -0.29 105.19 106.88 3mls n GLY 139 Ca -0.15 -0.92 -0.15 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.33 4.04 -0.58 0.00 2.96 0.31 -2.07 118.68 123.01 3mls s LEU 141 Ca 0.00 -0.81 -0.17 0.00 -0.22 0.00 0.00 54.13 52.94 3mls s LEU 141 Cb -0.03 -1.90 0.13 0.00 0.50 0.00 0.00 46.19 44.89 3mls s LEU 141 CO -0.00 -0.24 0.58 -0.69 -1.32 0.00 0.00 176.35 174.68 3mls s VAL 142 N 1.49 5.14 0.10 1.68 1.01 0.96 -0.41 120.40 130.37 3mls s VAL 142 Ca 0.02 -1.44 0.03 0.00 0.00 0.00 0.00 61.98 60.59 3mls s VAL 142 Cb -0.18 -4.39 -0.04 0.00 0.00 0.00 0.00 36.38 31.77 3mls s VAL 142 CO 0.03 -0.95 0.13 -0.75 0.00 0.00 0.00 175.10 173.56 3mls s LYS 143 N 1.78 3.01 -0.95 2.72 2.20 0.51 0.25 119.74 129.26 3mls s LYS 143 Ca 0.06 -0.69 -0.11 0.00 -0.36 0.00 0.00 55.97 54.88 3mls s LYS 143 Cb -0.27 -2.77 0.00 0.00 -1.51 0.00 0.00 37.83 33.28 3mls s LYS 143 CO 0.03 0.55 0.70 -0.25 -0.36 0.00 0.00 175.35 176.01 3mls n ASP 144 N 0.16 -5.57 -4.53 1.43 8.00 -0.32 -1.42 116.55 114.30 3mls n ASP 144 Ca -0.08 -0.83 -0.25 0.00 0.71 0.00 0.00 54.79 54.34 3mls n ASP 144 Cb 0.52 -3.00 -0.11 0.00 -0.02 0.00 0.00 41.12 38.52 3mls n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3mls s TYR 145 N -3.20 2.34 -0.30 1.24 -0.85 0.60 -4.44 117.35 112.74 3mls s TYR 145 Ca 0.21 -0.56 -0.18 0.00 -0.52 0.00 0.00 57.07 56.01 3mls s TYR 145 Cb -0.08 -1.39 0.19 0.00 0.38 0.00 0.00 41.96 41.05 3mls s TYR 145 CO 0.86 0.51 1.21 0.12 -1.52 0.00 0.00 175.55 176.73 3mls s PHE 146 N -2.70 -0.21 0.00 -3.49 5.36 -1.13 0.37 117.98 116.17 3mls s PHE 146 Ca 0.32 0.45 0.00 0.00 -0.96 0.00 0.00 56.93 56.74 3mls s PHE 146 Cb 0.04 0.21 0.00 0.00 -0.34 0.00 0.00 43.02 42.93 3mls s PHE 146 CO 0.16 -0.11 0.00 -0.35 -1.46 0.00 0.00 175.22 173.46 3mls n PRO 147 N 2.92 3.42 -1.83 10.12 -0.04 -1.26 -0.36 135.00 147.96 3mls n PRO 147 Ca -0.16 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 62.99 3mls n PRO 147 Cb 0.57 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 34.05 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 3.05 3.40 0.46 0.54 0.41 -1.26 -4.78 118.70 120.53 3mls s GLU 148 Ca 0.00 0.86 0.04 0.00 -0.41 0.00 0.00 54.97 55.46 3mls s GLU 148 Cb 0.00 -2.05 -0.04 0.00 -1.78 0.00 0.00 34.13 30.25 3mls s GLU 148 CO 0.00 -0.73 0.04 -1.25 -0.49 0.00 0.00 175.26 172.83 3mls s PRO 149 N -4.98 2.10 0.00 0.39 0.04 -1.26 -4.86 135.00 126.43 3mls s PRO 149 Ca 0.57 -2.21 0.04 0.00 0.04 0.00 0.00 61.00 59.44 3mls s PRO 149 Cb -0.12 -1.64 -0.01 0.00 0.04 0.00 0.00 34.50 32.77 3mls s PRO 149 CO 0.51 -0.21 -0.12 0.14 0.04 0.00 0.00 177.00 177.36 3mls s VAL 150 N -2.78 0.93 0.16 -0.36 -7.23 -1.26 -4.33 120.40 105.53 3mls s VAL 150 Ca 0.23 -0.62 0.07 0.00 -1.81 0.00 0.00 61.98 59.85 3mls s VAL 150 Cb 0.05 -0.80 -0.04 0.00 0.56 0.00 0.00 36.38 36.15 3mls s VAL 150 CO 0.12 0.17 -0.01 0.42 -0.31 0.00 0.00 175.10 175.49 3mls s THR 151 N -0.44 3.70 -0.02 5.32 -4.23 -0.41 -4.94 115.64 114.62 3mls s THR 151 Ca 0.03 -1.36 -0.01 0.00 -1.18 0.00 0.00 61.69 59.17 3mls s THR 151 Cb -0.05 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 70.97 3mls s THR 151 CO -0.00 -0.06 0.05 -0.69 -0.54 0.00 0.00 174.62 173.38 3mls s VAL 152 N -1.62 -0.03 0.27 2.29 1.01 -1.26 -1.03 120.40 120.03 3mls s VAL 152 Ca 0.26 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.37 3mls s VAL 152 Cb -0.10 -0.10 -0.05 0.00 0.00 0.00 0.00 36.38 36.14 3mls s VAL 152 CO 0.18 0.05 0.12 -0.94 0.00 0.00 0.00 175.10 174.50 3mls s SER 153 N 0.61 1.21 -0.04 3.32 1.04 -0.32 -4.95 113.70 114.58 3mls s SER 153 Ca -0.05 -1.44 0.05 0.00 0.48 0.00 0.00 55.95 54.99 3mls s SER 153 Cb -0.07 0.25 -0.01 0.00 0.10 0.00 0.00 66.02 66.29 3mls s SER 153 CO -0.02 -0.79 -0.18 0.26 0.98 0.00 0.00 173.24 173.49 3mls s TRP 154 N -3.74 1.76 -1.34 5.02 0.52 -1.26 0.44 118.94 120.34 3mls s TRP 154 Ca 0.37 -0.47 -0.04 0.00 0.02 0.00 0.00 56.10 55.99 3mls s TRP 154 Cb 0.07 -1.17 -0.00 0.00 -1.15 0.00 0.00 33.47 31.22 3mls s TRP 154 CO 0.15 -0.14 0.52 0.09 0.02 0.00 0.00 176.95 177.59 3mls n ASN 155 N 3.00 -1.31 -2.88 2.95 3.02 0.56 -1.53 115.26 119.06 3mls n ASN 155 Ca -0.17 -0.98 -0.19 0.00 -0.03 0.00 0.00 54.58 53.21 3mls n ASN 155 Cb 0.53 -3.25 0.00 0.00 -0.61 0.00 0.00 39.78 36.46 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 -2.94 -4.40 0.00 6.41 7.64 -1.26 -1.31 113.62 117.77 3mls n SER 156 Ca -0.27 -0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.49 3mls n SER 156 Cb 0.67 -3.65 0.00 0.00 -1.01 0.00 0.00 64.21 60.22 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 -1.09 0.76 0.12 0.23 0.00 -0.58 -4.92 105.19 99.69 3mls n GLY 157 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 0.61 -3.00 4.61 0.00 -1.01 -3.43 119.26 117.04 3mls h ALA 158 Ca 0.00 -0.63 -0.68 0.00 0.00 0.00 0.00 54.91 53.61 3mls h ALA 158 Cb 0.00 -0.02 -0.26 0.00 0.00 0.00 0.00 17.79 17.51 3mls h ALA 158 CO 0.00 0.81 -0.61 -1.17 0.00 0.00 0.00 179.25 178.28 3mls s LEU 159 N -6.37 3.94 0.00 0.00 2.96 -0.98 -4.90 118.68 113.32 3mls s LEU 159 Ca 0.02 -0.73 0.00 0.00 -0.22 0.00 0.00 54.13 53.20 3mls s LEU 159 Cb 0.08 -1.90 0.00 0.00 0.50 0.00 0.00 46.19 44.87 3mls s LEU 159 CO 0.77 -0.21 0.00 0.35 -1.32 0.00 0.00 176.35 175.94 3mls n THR 160 N 4.88 0.00 -1.72 3.68 -2.24 -1.26 -4.05 114.28 113.58 3mls n THR 160 Ca -0.14 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.22 3mls n THR 160 Cb 0.48 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 3mls n THR 160 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3mls n SER 161 N -2.34 2.86 -0.27 3.42 7.64 -1.26 -1.96 113.62 121.72 3mls n SER 161 Ca 0.00 1.16 -0.04 0.00 1.01 0.00 0.00 58.87 61.01 3mls n SER 161 Cb 0.33 -1.52 -0.02 0.00 -1.01 0.00 0.00 64.21 61.99 3mls n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mls n GLY 162 N 0.73 0.50 3.71 0.23 0.00 -1.26 -4.79 105.19 104.31 3mls n GLY 162 Ca 0.05 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.66 5.16 -0.28 1.61 1.01 -0.83 -2.02 120.40 123.39 3mls s VAL 163 Ca 0.00 1.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.97 3mls s VAL 163 Cb 0.00 -3.85 0.09 0.00 0.00 0.00 0.00 36.38 32.62 3mls s VAL 163 CO 0.00 0.29 0.10 -2.28 0.00 0.00 0.00 175.10 173.21 3mls s HIS 164 N 0.79 1.04 -0.33 5.22 2.46 0.96 -5.00 115.29 120.43 3mls s HIS 164 Ca 0.27 -1.24 -0.18 0.00 0.47 0.00 0.00 55.06 54.38 3mls s HIS 164 Cb -0.15 -1.28 -0.01 0.00 -0.13 0.00 0.00 32.58 31.01 3mls s HIS 164 CO 0.11 -0.81 0.52 0.99 -2.47 0.00 0.00 174.74 173.09 3mls s THR 165 N 1.85 5.02 0.26 0.89 2.01 -1.26 -1.62 115.64 122.79 3mls s THR 165 Ca 0.08 0.48 -0.22 0.00 0.31 0.00 0.00 61.69 62.34 3mls s THR 165 Cb -0.17 -3.94 -0.09 0.00 0.01 0.00 0.00 72.50 68.31 3mls s THR 165 CO -0.26 -0.15 0.80 -0.36 -0.69 0.00 0.00 174.62 173.95 3mls s PHE 166 N 2.40 3.65 0.54 4.92 0.40 -0.16 -4.99 117.98 124.74 3mls s PHE 166 Ca 0.20 1.51 -0.22 0.00 -0.60 0.00 0.00 56.93 57.82 3mls s PHE 166 Cb -0.15 -2.72 -0.05 0.00 0.51 0.00 0.00 43.02 40.61 3mls s PHE 166 CO 0.13 0.28 1.37 -2.14 0.70 0.00 0.00 175.22 175.55 3mls s PRO 167 N -2.05 3.18 0.98 0.24 0.02 -1.26 -4.22 135.00 131.89 3mls s PRO 167 Ca 0.46 2.25 -0.12 0.00 0.02 0.00 0.00 61.00 63.61 3mls s PRO 167 Cb -0.17 -2.29 0.18 0.00 0.02 0.00 0.00 34.50 32.24 3mls s PRO 167 CO 0.22 -1.17 1.10 0.00 -0.33 0.00 0.00 177.00 176.82 3mls s ALA 168 N -1.29 1.13 -0.08 -1.55 0.00 -1.26 -4.81 121.76 113.90 3mls s ALA 168 Ca 0.71 -0.40 0.03 0.00 0.00 0.00 0.00 51.96 52.29 3mls s ALA 168 Cb -0.41 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 3mls s ALA 168 CO 0.49 -2.72 -0.16 0.14 0.00 0.00 0.00 175.76 173.51 3mls s VAL 169 N -3.04 2.90 -0.46 0.00 -7.23 0.18 -4.94 120.40 107.81 3mls s VAL 169 Ca 0.65 -0.76 -0.20 0.00 -1.81 0.00 0.00 61.98 59.87 3mls s VAL 169 Cb -0.18 -2.15 0.03 0.00 0.56 0.00 0.00 36.38 34.64 3mls s VAL 169 CO 0.57 0.57 0.61 -0.22 -0.31 0.00 0.00 175.10 176.31 3mls s LEU 170 N -0.28 4.71 0.83 1.32 2.96 -1.26 -1.58 118.68 125.38 3mls s LEU 170 Ca 0.02 -0.59 -0.11 0.00 -0.22 0.00 0.00 54.13 53.23 3mls s LEU 170 Cb -0.13 -2.57 0.09 0.00 0.50 0.00 0.00 46.19 44.08 3mls s LEU 170 CO 0.03 -0.79 1.10 -1.10 -1.32 0.00 0.00 176.35 174.27 3mls s GLN 171 N 2.66 1.76 0.55 1.98 -0.21 0.16 -4.86 119.66 121.69 3mls s GLN 171 Ca 0.18 1.22 0.37 0.00 0.02 0.00 0.00 55.36 57.15 3mls s GLN 171 Cb -0.16 -1.84 1.96 0.00 1.00 0.00 0.00 33.01 33.97 3mls s GLN 171 CO 0.16 -2.01 2.12 0.66 -2.12 0.00 0.00 175.29 174.10 3mls h SER 172 N -1.40 0.00 1.07 5.90 4.64 -1.96 0.28 113.55 122.08 3mls h SER 172 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3mls h SER 172 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3mls h SER 172 CO 0.49 0.00 -0.05 -1.54 -0.87 0.00 0.00 176.83 174.86 3mls n SER 173 N -2.81 0.23 0.00 4.97 3.41 -1.26 -4.92 113.62 113.25 3mls n SER 173 Ca -0.02 0.46 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 3mls n SER 173 Cb 0.08 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 3mls n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mls n GLY 174 N 1.45 1.77 3.90 5.00 0.00 0.98 -4.69 105.19 113.60 3mls n GLY 174 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 4.07 0.25 0.99 1.43 -1.26 -4.76 118.68 119.40 3mls s LEU 175 Ca 0.00 0.75 -0.01 0.00 -1.03 0.00 0.00 54.13 53.84 3mls s LEU 175 Cb 0.00 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 3mls s LEU 175 CO 0.00 -0.17 0.45 -0.31 0.23 0.00 0.00 176.35 176.55 3mls s TYR 176 N -2.04 3.48 -0.02 0.29 1.51 0.16 -0.66 117.35 120.07 3mls s TYR 176 Ca 0.45 0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 56.88 3mls s TYR 176 Cb -0.11 -1.90 0.01 0.00 -0.11 0.00 0.00 41.96 39.85 3mls s TYR 176 CO 0.28 0.30 0.05 -1.12 -1.11 0.00 0.00 175.55 173.95 3mls s SER 177 N -3.34 -0.04 0.11 2.29 0.01 -0.61 -0.29 113.70 111.82 3mls s SER 177 Ca 0.40 0.10 0.01 0.00 1.31 0.00 0.00 55.95 57.77 3mls s SER 177 Cb -0.11 0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.17 3mls s SER 177 CO 0.30 -0.03 -0.05 -0.22 0.41 0.00 0.00 173.24 173.65 3mls s LEU 178 N 0.17 2.42 -0.00 2.44 0.20 0.14 -0.65 118.68 123.40 3mls s LEU 178 Ca -0.01 -1.04 0.00 0.00 0.69 0.00 0.00 54.13 53.77 3mls s LEU 178 Cb -0.02 -0.04 0.01 0.00 -0.43 0.00 0.00 46.19 45.70 3mls s LEU 178 CO -0.00 -0.50 0.00 -0.44 -0.29 0.00 0.00 176.35 175.12 3mls s SER 179 N -3.06 0.07 -0.08 3.68 0.01 -1.26 -0.03 113.70 113.04 3mls s SER 179 Ca 0.14 -0.00 0.01 0.00 1.31 0.00 0.00 55.95 57.41 3mls s SER 179 Cb 0.06 -0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.28 3mls s SER 179 CO -0.03 -0.02 -0.11 -0.55 0.41 0.00 0.00 173.24 172.94 3mls s SER 180 N 0.19 1.93 0.09 2.44 0.15 -0.88 -0.98 113.70 116.64 3mls s SER 180 Ca -0.02 -0.31 0.08 0.00 0.70 0.00 0.00 55.95 56.41 3mls s SER 180 Cb -0.03 -0.84 -0.03 0.00 -1.71 0.00 0.00 66.02 63.41 3mls s SER 180 CO -0.01 -0.01 -0.22 0.54 1.20 0.00 0.00 173.24 174.74 3mls s VAL 181 N 1.00 1.77 -0.05 4.45 0.11 -0.64 -0.99 120.40 126.05 3mls s VAL 181 Ca -0.08 -1.51 0.00 0.00 -2.93 0.00 0.00 61.98 57.46 3mls s VAL 181 Cb -0.15 -1.59 0.02 0.00 -1.53 0.00 0.00 36.38 33.13 3mls s VAL 181 CO -0.00 0.01 -0.03 -0.69 -3.33 0.00 0.00 175.10 171.05 3mls s VAL 182 N -1.09 0.50 -0.19 2.04 1.01 0.60 -0.03 120.40 123.24 3mls s VAL 182 Ca 0.07 -0.06 -0.18 0.00 0.00 0.00 0.00 61.98 61.81 3mls s VAL 182 Cb -0.10 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 3mls s VAL 182 CO 0.04 0.23 0.48 0.42 0.00 0.00 0.00 175.10 176.27 3mls s THR 183 N 1.17 5.14 0.22 3.92 -4.23 -0.86 -2.01 115.64 119.00 3mls s THR 183 Ca -0.07 0.88 0.04 0.00 -1.18 0.00 0.00 61.69 61.36 3mls s THR 183 Cb -0.14 -3.80 -0.05 0.00 1.34 0.00 0.00 72.50 69.85 3mls s THR 183 CO -0.01 0.21 -0.03 0.68 -0.54 0.00 0.00 174.62 174.93 3mls s VAL 184 N 1.46 1.13 0.26 2.29 -7.23 0.15 -4.71 120.40 113.75 3mls s VAL 184 Ca 0.23 -2.05 -0.31 0.00 -1.81 0.00 0.00 61.98 58.04 3mls s VAL 184 Cb -0.15 -2.28 -0.12 0.00 0.56 0.00 0.00 36.38 34.39 3mls s VAL 184 CO 0.09 -0.39 1.62 -2.65 -0.31 0.00 0.00 175.10 173.46 3mls n PRO 185 N -0.40 2.66 -0.04 4.82 -0.02 -1.26 0.12 135.00 140.87 3mls n PRO 185 Ca -0.06 0.95 -0.03 0.00 -2.02 0.00 0.00 63.50 62.34 3mls n PRO 185 Cb 0.63 -2.74 0.20 0.00 -0.02 0.00 0.00 33.50 31.58 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 5.32 0.61 -0.84 2.55 0.02 -1.35 -2.84 113.55 117.01 3mls h SER 186 Ca -0.46 -0.16 0.14 0.00 -0.84 0.00 0.00 61.79 60.48 3mls h SER 186 Cb 1.22 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.54 3mls h SER 186 CO 0.84 0.74 0.55 0.28 -1.14 0.00 0.00 176.83 178.10 3mls h SER 187 N 0.57 0.56 1.15 3.07 0.02 -1.90 -1.91 113.55 115.12 3mls h SER 187 Ca 0.11 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3mls h SER 187 Cb 0.51 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.97 3mls h SER 187 CO 0.03 0.29 0.00 0.77 -1.14 0.00 0.00 176.83 176.78 3mls h SER 188 N 0.60 0.00 -1.17 3.07 4.64 -1.89 -3.37 113.55 115.43 3mls h SER 188 Ca 0.42 0.00 0.37 0.00 -0.47 0.00 0.00 61.79 62.11 3mls h SER 188 Cb 0.76 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.73 3mls h SER 188 CO -0.17 0.00 0.73 -0.07 -0.87 0.00 0.00 176.83 176.45 3mls h LEU 189 N 0.00 0.35 0.00 5.97 4.07 -1.44 -0.32 115.31 123.94 3mls h LEU 189 Ca 0.00 0.14 0.00 0.00 0.08 0.00 0.00 57.88 58.10 3mls h LEU 189 Cb 0.57 0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.42 3mls h LEU 189 CO 0.00 -0.12 -0.24 0.61 -1.08 0.00 0.00 178.44 177.61 3mls n GLY 190 N -1.45 -1.39 0.00 0.83 0.00 -1.26 -4.37 105.19 97.55 3mls n GLY 190 Ca 0.33 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3mls n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3mls n THR 191 N -1.53 0.00 -3.68 2.61 -2.24 -0.26 -5.04 114.28 104.14 3mls n THR 191 Ca 0.06 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.47 3mls n THR 191 Cb 0.34 0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.75 3mls n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3mls s GLN 192 N -1.62 3.80 -0.09 -0.78 2.00 -0.47 -5.07 119.66 117.41 3mls s GLN 192 Ca 0.00 0.09 -0.16 0.00 -2.00 0.00 0.00 55.36 53.29 3mls s GLN 192 Cb 0.00 -3.26 -0.05 0.00 0.80 0.00 0.00 33.01 30.50 3mls s GLN 192 CO 0.00 0.62 0.39 0.99 -0.50 0.00 0.00 175.29 176.79 3mls s THR 193 N -0.69 5.18 -0.15 -0.34 2.01 -1.26 -4.84 115.64 115.56 3mls s THR 193 Ca 0.18 0.78 0.02 0.00 0.31 0.00 0.00 61.69 62.98 3mls s THR 193 Cb -0.14 -3.72 0.01 0.00 0.01 0.00 0.00 72.50 68.67 3mls s THR 193 CO 0.07 0.43 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.91 3mls s TYR 194 N 0.01 2.70 -0.05 4.92 2.02 -1.26 -4.95 117.35 120.74 3mls s TYR 194 Ca 0.22 -1.40 0.01 0.00 -0.37 0.00 0.00 57.07 55.54 3mls s TYR 194 Cb -0.15 -1.84 0.02 0.00 -0.40 0.00 0.00 41.96 39.59 3mls s TYR 194 CO 0.09 -0.65 -0.06 0.42 -1.57 0.00 0.00 175.55 173.78 3mls s ILE 195 N 0.91 0.68 -0.19 2.71 -1.09 -1.26 0.43 121.20 123.40 3mls s ILE 195 Ca -0.04 -0.20 -0.09 0.00 -2.23 0.00 0.00 60.65 58.09 3mls s ILE 195 Cb -0.15 -0.69 -0.05 0.00 -1.58 0.00 0.00 42.46 40.00 3mls s ILE 195 CO -0.04 0.26 0.11 0.00 -1.23 0.00 0.00 174.94 174.04 3mls s ASN 197 N 0.21 6.02 -0.16 0.00 -0.87 0.17 -1.54 114.94 118.77 3mls s ASN 197 Ca 0.07 -0.89 -0.06 0.00 -1.57 0.00 0.00 52.86 50.41 3mls s ASN 197 Cb -0.11 -2.13 -0.04 0.00 -0.02 0.00 0.00 41.25 38.95 3mls s ASN 197 CO -0.01 -0.42 0.06 -0.69 -2.57 0.00 0.00 177.10 173.47 3mls s VAL 198 N 1.65 4.75 -0.09 1.60 1.01 -0.45 -1.18 120.40 127.70 3mls s VAL 198 Ca 0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.97 3mls s VAL 198 Cb -0.19 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.10 3mls s VAL 198 CO 0.09 0.50 -0.06 0.21 0.00 0.00 0.00 175.10 175.85 3mls s ASN 199 N 0.03 1.85 -0.63 3.32 2.47 -0.20 -1.38 114.94 120.41 3mls s ASN 199 Ca 0.05 -0.22 0.03 0.00 0.42 0.00 0.00 52.86 53.14 3mls s ASN 199 Cb -0.12 -0.69 0.15 0.00 -1.45 0.00 0.00 41.25 39.14 3mls s ASN 199 CO 0.01 -0.12 0.40 -2.28 -3.72 0.00 0.00 177.10 171.39 3mls s HIS 200 N 1.60 3.40 0.23 0.43 5.65 0.10 -1.29 115.29 125.42 3mls s HIS 200 Ca 0.01 -3.20 -0.10 0.00 0.25 0.00 0.00 55.06 52.03 3mls s HIS 200 Cb -0.13 -2.84 0.34 0.00 -1.18 0.00 0.00 32.58 28.78 3mls s HIS 200 CO -0.05 -0.67 1.64 0.87 -0.65 0.00 0.00 174.74 175.88 3mls h LYS 201 N 6.07 0.08 -1.27 2.88 1.79 -1.82 -2.13 116.57 122.18 3mls h LYS 201 Ca 0.03 -0.00 0.37 0.00 -2.18 0.00 0.00 60.65 58.87 3mls h LYS 201 Cb 0.84 -0.02 -0.09 0.00 -1.58 0.00 0.00 32.23 31.38 3mls h LYS 201 CO 0.71 0.05 0.86 -1.35 -1.08 0.00 0.00 179.45 178.65 3mls h PRO 202 N 0.09 0.14 -0.05 3.15 0.11 -1.89 -1.15 132.00 132.39 3mls h PRO 202 Ca 0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.46 3mls h PRO 202 Cb 0.60 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.68 3mls h PRO 202 CO -0.62 0.09 0.00 -1.13 -0.21 0.00 0.00 178.00 176.13 3mls n SER 203 N -4.42 2.01 -3.54 -2.05 3.41 -0.96 -4.97 113.62 103.10 3mls n SER 203 Ca 0.31 -1.88 -0.20 0.00 -0.26 0.00 0.00 58.87 56.84 3mls n SER 203 Cb 1.27 -0.03 0.07 0.00 -0.26 0.00 0.00 64.21 65.26 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 -0.29 -2.56 -4.16 4.04 3.02 -0.44 -4.85 115.26 110.03 3mls n ASN 204 Ca 0.02 -0.66 -0.34 0.00 -0.03 0.00 0.00 54.58 53.57 3mls n ASN 204 Cb 0.25 -4.81 -0.15 0.00 -0.61 0.00 0.00 39.78 34.46 3mls n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3mls s THR 205 N -3.42 2.63 -0.09 3.41 2.01 -0.93 -5.02 115.64 114.23 3mls s THR 205 Ca 0.11 -1.19 0.03 0.00 0.31 0.00 0.00 61.69 60.96 3mls s THR 205 Cb -0.05 -2.37 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 3mls s THR 205 CO 0.75 0.16 -0.21 -0.54 -0.69 0.00 0.00 174.62 174.09 3mls s LYS 206 N 1.26 2.97 -0.11 4.92 1.02 -1.26 -0.72 119.74 127.82 3mls s LYS 206 Ca -0.02 -0.82 -0.06 0.00 0.02 0.00 0.00 55.97 55.08 3mls s LYS 206 Cb -0.17 -2.35 0.05 0.00 -0.52 0.00 0.00 37.83 34.83 3mls s LYS 206 CO -0.05 0.27 0.27 0.54 -0.92 0.00 0.00 175.35 175.46 3mls s VAL 207 N 0.14 -0.03 -0.16 3.17 0.11 -0.48 -5.02 120.40 118.13 3mls s VAL 207 Ca -0.11 0.12 -0.06 0.00 -2.93 0.00 0.00 61.98 59.00 3mls s VAL 207 Cb -0.16 -0.41 -0.04 0.00 -1.53 0.00 0.00 36.38 34.24 3mls s VAL 207 CO 0.06 0.05 0.03 -1.81 -3.33 0.00 0.00 175.10 170.10 3mls s ASP 208 N 1.14 5.41 -0.17 3.54 1.01 -1.26 -1.35 116.67 124.99 3mls s ASP 208 Ca -0.08 0.05 0.00 0.00 0.71 0.00 0.00 52.55 53.23 3mls s ASP 208 Cb -0.09 -1.87 0.04 0.00 1.01 0.00 0.00 42.92 42.00 3mls s ASP 208 CO -0.08 0.20 -0.09 -0.75 0.21 0.00 0.00 175.17 174.66 3mls s LYS 209 N 0.19 1.80 -0.05 8.23 2.47 -0.59 -4.94 119.74 126.85 3mls s LYS 209 Ca 0.03 -0.62 -0.30 0.00 -1.56 0.00 0.00 55.97 53.51 3mls s LYS 209 Cb -0.13 -2.14 -0.03 0.00 -1.46 0.00 0.00 37.83 34.07 3mls s LYS 209 CO 0.01 -0.39 1.11 0.21 0.16 0.00 0.00 175.35 176.46 3mls s LYS 210 N 1.53 4.40 -0.38 4.03 2.20 -1.26 -1.26 119.74 129.00 3mls s LYS 210 Ca 0.01 1.56 -0.07 0.00 -0.36 0.00 0.00 55.97 57.11 3mls s LYS 210 Cb -0.15 -3.52 0.07 0.00 -1.51 0.00 0.00 37.83 32.72 3mls s LYS 210 CO -0.08 -0.34 0.19 0.08 -0.36 0.00 0.00 175.35 174.83 3mls s VAL 211 N 1.91 3.88 0.14 4.02 1.01 0.17 -4.89 120.40 126.65 3mls s VAL 211 Ca 0.53 -1.40 0.00 0.00 0.00 0.00 0.00 61.98 61.12 3mls s VAL 211 Cb -0.23 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 3mls s VAL 211 CO 0.22 -0.40 0.31 -1.61 0.00 0.00 0.00 175.10 173.61 3mls s GLU 212 N 1.37 3.48 0.22 2.72 2.02 -1.26 -4.36 118.70 122.88 3mls s GLU 212 Ca 0.02 -0.45 -0.31 0.00 0.02 0.00 0.00 54.97 54.24 3mls s GLU 212 Cb -0.22 -2.94 -0.14 0.00 0.10 0.00 0.00 34.13 30.94 3mls s GLU 212 CO 0.01 0.50 1.29 -2.30 0.02 0.00 0.00 175.26 174.79 3mls n PRO 213 N -0.34 1.68 -0.62 0.39 -0.02 -1.26 -4.50 135.00 130.33 3mls n PRO 213 Ca -0.06 0.60 -0.23 0.00 -2.02 0.00 0.00 63.50 61.80 3mls n PRO 213 Cb 0.53 -2.18 0.02 0.00 -0.02 0.00 0.00 33.50 31.86 3mls n PRO 213 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 3mls n LYS 214 N 1.81 0.00 0.00 -0.52 2.85 -1.04 -4.96 118.16 116.30 3mls n LYS 214 Ca 0.12 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.38 3mls n LYS 214 Cb 0.29 -0.62 0.00 0.00 -0.65 0.00 0.00 35.03 34.05 3mls n LYS 214 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80