#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b0s s ILE 2 N 0.00 5.11 -0.01 6.31 1.01 -1.26 -4.17 121.20 128.18 2b0s s ILE 2 Ca 0.00 1.24 -0.03 0.00 0.00 0.00 0.00 60.65 61.86 2b0s s ILE 2 Cb 0.00 -3.95 0.00 0.00 0.01 0.00 0.00 42.46 38.52 2b0s s ILE 2 CO 0.00 0.28 0.06 -1.10 0.00 0.00 0.00 174.94 174.19 2b0s s GLN 3 N 0.73 0.18 -0.11 2.79 -0.21 -0.89 -5.00 119.66 117.15 2b0s s GLN 3 Ca 0.33 -0.10 0.01 0.00 0.02 0.00 0.00 55.36 55.62 2b0s s GLN 3 Cb -0.17 0.08 -0.01 0.00 1.00 0.00 0.00 33.01 33.91 2b0s s GLN 3 CO 0.15 -0.03 -0.15 -0.51 -2.12 0.00 0.00 175.29 172.63 2b0s s LEU 4 N -0.43 2.63 -0.18 2.90 1.43 -1.26 -0.59 118.68 123.17 2b0s s LEU 4 Ca -0.05 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 2b0s s LEU 4 Cb -0.03 -1.58 0.02 0.00 0.03 0.00 0.00 46.19 44.63 2b0s s LEU 4 CO 0.00 0.19 -0.19 -0.70 0.23 0.00 0.00 176.35 175.88 2b0s s GLU 5 N 0.20 2.97 0.35 1.70 2.56 0.78 -4.14 118.70 123.13 2b0s s GLU 5 Ca -0.09 -0.84 -0.02 0.00 0.00 0.00 0.00 54.97 54.02 2b0s s GLU 5 Cb -0.15 -2.59 -0.04 0.00 2.00 0.00 0.00 34.13 33.35 2b0s s GLU 5 CO 0.05 -0.22 0.58 -0.65 -0.56 0.00 0.00 175.26 174.46 2b0s s GLN 6 N 1.29 3.52 0.88 4.30 -0.21 -1.26 -0.32 119.66 127.86 2b0s s GLN 6 Ca 0.05 -0.18 -0.12 0.00 0.02 0.00 0.00 55.36 55.12 2b0s s GLN 6 Cb -0.13 -2.62 0.12 0.00 1.00 0.00 0.00 33.01 31.38 2b0s s GLN 6 CO -0.13 0.11 1.14 -1.54 -2.12 0.00 0.00 175.29 172.76 2b0s s SER 7 N -3.84 3.81 0.75 5.90 1.04 -0.47 -4.97 113.70 115.91 2b0s s SER 7 Ca 0.42 0.95 -0.12 0.00 0.48 0.00 0.00 55.95 57.68 2b0s s SER 7 Cb -0.10 -1.52 0.04 0.00 0.10 0.00 0.00 66.02 64.55 2b0s s SER 7 CO 0.36 -2.36 1.13 -0.83 0.98 0.00 0.00 173.24 172.52 2b0s s GLY 8 N -4.14 1.61 0.26 7.32 0.00 -1.26 -4.60 107.32 106.51 2b0s s GLY 8 Ca 0.63 -0.49 -0.26 0.00 0.00 0.00 0.00 44.72 44.60 2b0s s GLY 8 CO 0.52 -0.07 0.46 0.00 0.00 0.00 0.00 173.10 174.01 2b0s n ALA 9 N -3.13 -2.70 -3.32 3.20 0.00 -1.26 -4.78 120.51 108.52 2b0s n ALA 9 Ca 0.07 0.36 -0.26 0.00 0.00 0.00 0.00 53.44 53.61 2b0s n ALA 9 Cb 0.59 -1.61 -0.17 0.00 0.00 0.00 0.00 19.45 18.26 2b0s n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2b0s s GLU 10 N -1.06 1.91 -0.29 0.00 0.41 0.12 -4.99 118.70 114.81 2b0s s GLU 10 Ca 0.63 -0.51 0.01 0.00 -0.41 0.00 0.00 54.97 54.68 2b0s s GLU 10 Cb -0.84 -1.55 0.06 0.00 -1.78 0.00 0.00 34.13 30.01 2b0s s GLU 10 CO 0.58 0.09 -0.05 0.08 -0.49 0.00 0.00 175.26 175.47 2b0s s VAL 11 N 0.50 2.56 0.19 2.63 1.01 -1.26 -0.36 120.40 125.67 2b0s s VAL 11 Ca -0.13 -1.58 0.09 0.00 0.00 0.00 0.00 61.98 60.36 2b0s s VAL 11 Cb -0.15 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2b0s s VAL 11 CO 0.04 -0.11 -0.19 -0.54 0.00 0.00 0.00 175.10 174.30 2b0s s LYS 12 N 1.16 1.36 0.11 2.72 -0.14 0.21 -4.99 119.74 120.16 2b0s s LYS 12 Ca -0.06 -1.49 -0.13 0.00 -1.36 0.00 0.00 55.97 52.93 2b0s s LYS 12 Cb -0.20 -1.43 -0.06 0.00 -1.68 0.00 0.00 37.83 34.46 2b0s s LYS 12 CO -0.03 0.28 0.49 0.15 -0.76 0.00 0.00 175.35 175.48 2b0s s LYS 13 N -2.96 3.92 0.22 1.68 1.02 -1.26 -2.19 119.74 120.17 2b0s s LYS 13 Ca 0.19 0.41 -0.32 0.00 0.02 0.00 0.00 55.97 56.27 2b0s s LYS 13 Cb -0.05 -3.00 -0.13 0.00 -0.52 0.00 0.00 37.83 34.12 2b0s s LYS 13 CO 0.08 0.54 1.52 0.45 -0.92 0.00 0.00 175.35 177.01 2b0s n SER 14 N 1.00 3.14 0.00 2.83 2.88 -0.76 -2.09 113.62 120.62 2b0s n SER 14 Ca -0.07 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.58 2b0s n SER 14 Cb 0.52 -1.47 0.00 0.00 -0.75 0.00 0.00 64.21 62.51 2b0s n SER 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2b0s n GLY 15 N 2.70 3.09 3.77 0.46 0.00 0.75 -4.95 105.19 111.01 2b0s n GLY 15 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2b0s n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b0s s GLU 16 N -0.64 3.65 0.39 1.61 2.02 -0.89 -4.23 118.70 120.60 2b0s s GLU 16 Ca 0.00 1.73 -0.11 0.00 0.02 0.00 0.00 54.97 56.61 2b0s s GLU 16 Cb 0.00 -2.30 -0.07 0.00 0.10 0.00 0.00 34.13 31.86 2b0s s GLU 16 CO 0.00 -0.63 0.76 -1.12 0.02 0.00 0.00 175.26 174.29 2b0s s SER 17 N -1.46 6.55 -0.24 -0.19 0.01 -1.26 -1.21 113.70 115.90 2b0s s SER 17 Ca 0.66 1.14 -0.15 0.00 1.31 0.00 0.00 55.95 58.91 2b0s s SER 17 Cb -0.27 -2.33 0.07 0.00 0.21 0.00 0.00 66.02 63.70 2b0s s SER 17 CO 0.33 -0.37 0.60 -0.22 0.41 0.00 0.00 173.24 173.99 2b0s s LEU 18 N -3.72 -0.63 -0.21 2.44 2.96 0.26 -4.98 118.68 114.79 2b0s s LEU 18 Ca 0.51 1.31 -0.01 0.00 -0.22 0.00 0.00 54.13 55.73 2b0s s LEU 18 Cb -0.10 2.06 0.02 0.00 0.50 0.00 0.00 46.19 48.67 2b0s s LEU 18 CO 0.29 -0.22 -0.12 -0.75 -1.32 0.00 0.00 176.35 174.23 2b0s s LYS 19 N 1.40 2.97 0.22 1.98 2.20 -1.26 -0.86 119.74 126.39 2b0s s LYS 19 Ca -0.09 -0.87 0.04 0.00 -0.36 0.00 0.00 55.97 54.70 2b0s s LYS 19 Cb -0.06 -2.80 -0.03 0.00 -1.51 0.00 0.00 37.83 33.43 2b0s s LYS 19 CO -0.15 -0.29 0.35 0.96 -0.36 0.00 0.00 175.35 175.86 2b0s s ILE 20 N 1.32 5.27 0.10 5.43 -4.36 -0.49 -4.96 121.20 123.50 2b0s s ILE 20 Ca 0.03 -0.87 0.06 0.00 -0.26 0.00 0.00 60.65 59.61 2b0s s ILE 20 Cb -0.15 -3.83 -0.03 0.00 1.25 0.00 0.00 42.46 39.70 2b0s s ILE 20 CO -0.08 -0.28 -0.15 -0.44 0.24 0.00 0.00 174.94 174.23 2b0s s SER 21 N -3.77 1.94 -0.21 4.36 0.01 -1.26 -2.06 113.70 112.71 2b0s s SER 21 Ca 0.35 -0.70 -0.03 0.00 1.31 0.00 0.00 55.95 56.88 2b0s s SER 21 Cb -0.10 -0.07 0.07 0.00 0.21 0.00 0.00 66.02 66.13 2b0s s SER 21 CO 0.29 -0.08 0.05 0.00 0.41 0.00 0.00 173.24 173.91 2b0s s GLN 23 N 1.85 4.11 0.09 0.00 0.74 0.57 -0.96 119.66 126.06 2b0s s GLN 23 Ca 0.01 -0.02 0.05 0.00 0.05 0.00 0.00 55.36 55.45 2b0s s GLN 23 Cb -0.17 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.52 2b0s s GLN 23 CO -0.11 0.35 0.01 0.95 -0.55 0.00 0.00 175.29 175.94 2b0s s THR 24 N 0.15 4.05 -0.01 -0.34 -4.23 -0.53 -0.15 115.64 114.59 2b0s s THR 24 Ca 0.14 -0.97 0.02 0.00 -1.18 0.00 0.00 61.69 59.69 2b0s s THR 24 Cb -0.12 -2.93 -0.00 0.00 1.34 0.00 0.00 72.50 70.78 2b0s s THR 24 CO 0.03 0.12 -0.05 -0.44 -0.54 0.00 0.00 174.62 173.74 2b0s s SER 25 N -2.31 0.66 0.00 3.99 0.01 0.24 -4.93 113.70 111.37 2b0s s SER 25 Ca 0.26 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.42 2b0s s SER 25 Cb -0.12 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.00 2b0s s SER 25 CO 0.19 0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.49 2b0s n GLY 26 N 3.11 0.89 3.79 3.44 0.00 -1.26 -2.08 105.19 113.08 2b0s n GLY 26 Ca -0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 2b0s n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2b0s s TYR 27 N -2.00 -0.14 -0.51 1.61 -0.85 -1.26 -4.64 117.35 109.56 2b0s s TYR 27 Ca 0.00 -0.22 -0.27 0.00 -0.52 0.00 0.00 57.07 56.06 2b0s s TYR 27 Cb 0.00 0.66 -0.01 0.00 0.38 0.00 0.00 41.96 42.99 2b0s s TYR 27 CO 0.00 -0.95 1.72 0.45 -1.52 0.00 0.00 175.55 175.25 2b0s s SER 28 N -2.95 5.69 0.27 -0.18 0.15 -1.26 -4.88 113.70 110.54 2b0s s SER 28 Ca 0.12 0.64 -0.00 0.00 0.70 0.00 0.00 55.95 57.41 2b0s s SER 28 Cb -0.03 -2.53 0.59 0.00 -1.71 0.00 0.00 66.02 62.34 2b0s s SER 28 CO 0.04 -1.99 1.71 0.15 1.20 0.00 0.00 173.24 174.35 2b0s h PHE 29 N 13.30 0.54 0.00 3.44 3.57 -1.95 -2.03 116.94 133.81 2b0s h PHE 29 Ca -0.28 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.25 2b0s h PHE 29 Cb 1.15 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.77 2b0s h PHE 29 CO 1.01 -0.01 -0.04 0.77 -2.23 0.00 0.00 178.31 177.80 2b0s h SER 30 N 0.40 0.00 0.75 0.41 0.02 -1.91 -3.30 113.55 109.92 2b0s h SER 30 Ca 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 2b0s h SER 30 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 2b0s h SER 30 CO -0.49 0.04 -0.44 0.47 -1.14 0.00 0.00 176.83 175.28 2b0s n ASP 31 N -4.14 0.51 -4.25 3.07 8.00 -0.76 -1.96 116.55 117.01 2b0s n ASP 31 Ca -0.03 0.03 -0.25 0.00 0.71 0.00 0.00 54.79 55.26 2b0s n ASP 31 Cb 0.13 0.05 -0.14 0.00 -0.02 0.00 0.00 41.12 41.15 2b0s n ASP 31 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2b0s s TYR 32 N -3.06 1.76 0.52 1.24 1.51 -1.24 -5.03 117.35 113.04 2b0s s TYR 32 Ca 0.10 -0.38 -0.21 0.00 -1.01 0.00 0.00 57.07 55.57 2b0s s TYR 32 Cb 0.16 -1.04 -0.06 0.00 -0.11 0.00 0.00 41.96 40.92 2b0s s TYR 32 CO 0.68 0.11 1.17 -1.58 -1.11 0.00 0.00 175.55 174.82 2b0s s TRP 33 N -0.87 2.68 -0.10 2.71 0.52 -1.26 -4.38 118.94 118.24 2b0s s TRP 33 Ca 0.07 1.52 0.02 0.00 0.02 0.00 0.00 56.10 57.73 2b0s s TRP 33 Cb -0.09 -3.39 -0.02 0.00 -1.15 0.00 0.00 33.47 28.82 2b0s s TRP 33 CO 0.02 -1.74 -0.16 0.42 0.02 0.00 0.00 176.95 175.51 2b0s s ILE 34 N -1.62 2.82 0.16 2.03 -1.09 -0.07 -0.91 121.20 122.52 2b0s s ILE 34 Ca 0.70 -0.77 0.06 0.00 -2.23 0.00 0.00 60.65 58.41 2b0s s ILE 34 Cb -0.28 -2.13 -0.04 0.00 -1.58 0.00 0.00 42.46 38.43 2b0s s ILE 34 CO 0.32 0.55 0.03 -0.83 -1.23 0.00 0.00 174.94 173.79 2b0s s GLY 35 N -0.01 1.75 0.01 6.18 0.00 0.14 -0.32 107.32 115.06 2b0s s GLY 35 Ca -0.05 -1.30 0.07 0.00 0.00 0.00 0.00 44.72 43.45 2b0s s GLY 35 CO 0.04 -1.31 -0.21 -0.98 0.00 0.00 0.00 173.10 170.64 2b0s s TRP 36 N -1.68 1.89 -0.03 1.90 0.52 -0.76 -1.20 118.94 119.58 2b0s s TRP 36 Ca 0.28 -0.37 -0.01 0.00 0.02 0.00 0.00 56.10 56.03 2b0s s TRP 36 Cb -0.10 -1.18 0.03 0.00 -1.15 0.00 0.00 33.47 31.07 2b0s s TRP 36 CO 0.20 0.02 0.05 0.08 0.02 0.00 0.00 176.95 177.32 2b0s s VAL 37 N -0.62 -0.07 -0.02 4.03 1.01 -0.24 -0.89 120.40 123.60 2b0s s VAL 37 Ca 0.08 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.31 2b0s s VAL 37 Cb -0.08 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.15 2b0s s VAL 37 CO 0.00 0.10 0.00 -0.60 0.00 0.00 0.00 175.10 174.61 2b0s s ARG 38 N 1.26 2.84 -0.23 2.72 3.52 0.91 -0.31 118.95 129.66 2b0s s ARG 38 Ca -0.07 -0.56 -0.01 0.00 -0.13 0.00 0.00 55.73 54.96 2b0s s ARG 38 Cb -0.13 -2.70 0.06 0.00 -1.56 0.00 0.00 34.95 30.63 2b0s s ARG 38 CO -0.03 0.65 0.00 -1.14 -0.81 0.00 0.00 175.30 173.97 2b0s s GLN 39 N -1.38 1.09 0.51 5.12 0.74 0.58 -0.11 119.66 126.20 2b0s s GLN 39 Ca 0.18 -0.76 -0.19 0.00 0.05 0.00 0.00 55.36 54.65 2b0s s GLN 39 Cb -0.11 -2.32 -0.07 0.00 1.10 0.00 0.00 33.01 31.60 2b0s s GLN 39 CO 0.08 -0.66 1.02 -1.64 -0.55 0.00 0.00 175.29 173.54 2b0s s MET 40 N 1.62 3.75 0.08 1.67 -1.94 -1.26 -1.66 119.30 121.56 2b0s s MET 40 Ca -0.02 1.23 -0.34 0.00 -1.71 0.00 0.00 55.69 54.86 2b0s s MET 40 Cb -0.18 -2.09 -0.13 0.00 2.01 0.00 0.00 34.83 34.44 2b0s s MET 40 CO -0.09 -0.46 1.70 -2.30 -0.01 0.00 0.00 175.02 173.87 2b0s n PRO 41 N -1.29 2.24 -0.97 2.03 -0.02 -1.26 -0.49 135.00 135.24 2b0s n PRO 41 Ca 0.08 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 2b0s n PRO 41 Cb 0.53 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 2b0s n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b0s n GLY 42 N 3.82 0.42 3.76 -1.23 0.00 -1.26 -5.02 105.19 105.67 2b0s n GLY 42 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2b0s n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b0s s LYS 43 N -0.56 2.20 0.64 1.61 -0.14 0.36 -5.15 119.74 118.70 2b0s s LYS 43 Ca 0.00 -2.41 -0.06 0.00 -1.36 0.00 0.00 55.97 52.13 2b0s s LYS 43 Cb 0.00 -1.47 0.03 0.00 -1.68 0.00 0.00 37.83 34.71 2b0s s LYS 43 CO 0.00 -0.39 0.96 0.20 -0.76 0.00 0.00 175.35 175.36 2b0s s GLY 44 N -3.88 1.65 0.35 -3.33 0.00 -1.26 -4.59 107.32 96.26 2b0s s GLY 44 Ca 0.04 -0.79 -0.29 0.00 0.00 0.00 0.00 44.72 43.69 2b0s s GLY 44 CO 0.02 -0.45 1.53 1.08 0.00 0.00 0.00 173.10 175.28 2b0s s LEU 45 N -5.12 4.32 -0.03 0.66 1.43 -1.26 -4.30 118.68 114.38 2b0s s LEU 45 Ca 0.57 3.03 0.01 0.00 -1.03 0.00 0.00 54.13 56.70 2b0s s LEU 45 Cb -0.11 -3.66 0.02 0.00 0.03 0.00 0.00 46.19 42.48 2b0s s LEU 45 CO 0.45 -0.90 -0.02 -0.70 0.23 0.00 0.00 176.35 175.41 2b0s s GLU 46 N -1.58 0.56 0.10 1.70 2.12 0.84 -4.99 118.70 117.46 2b0s s GLU 46 Ca 0.56 -0.03 -0.30 0.00 0.36 0.00 0.00 54.97 55.56 2b0s s GLU 46 Cb -0.47 -0.64 -0.06 0.00 0.26 0.00 0.00 34.13 33.22 2b0s s GLU 46 CO 0.58 -0.09 1.17 -0.46 -0.54 0.00 0.00 175.26 175.93 2b0s s TRP 47 N 0.87 3.47 -0.25 5.30 -0.00 -1.26 -0.07 118.94 127.01 2b0s s TRP 47 Ca -0.10 1.39 -0.14 0.00 -0.00 0.00 0.00 56.10 57.25 2b0s s TRP 47 Cb -0.13 -3.38 -0.15 0.00 -0.00 0.00 0.00 33.47 29.80 2b0s s TRP 47 CO -0.01 -1.09 -0.16 -1.33 -0.00 0.00 0.00 176.95 174.36 2b0s n MET 48 N 3.36 0.60 -3.34 5.86 2.81 -0.06 -4.72 117.12 121.62 2b0s n MET 48 Ca 0.07 0.34 0.00 0.00 -1.81 0.00 0.00 57.70 56.29 2b0s n MET 48 Cb 0.46 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 31.40 2b0s n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2b0s n GLY 49 N 1.42 -1.47 3.09 3.03 0.00 -1.22 -0.05 105.19 110.00 2b0s n GLY 49 Ca -0.47 -1.02 -0.12 0.00 0.00 0.00 0.00 46.02 44.41 2b0s n GLY 49 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2b0s s ILE 50 N -2.60 0.56 -0.02 -0.61 -4.36 0.72 -1.82 121.20 113.07 2b0s s ILE 50 Ca 0.00 -1.38 0.02 0.00 -0.26 0.00 0.00 60.65 59.03 2b0s s ILE 50 Cb 0.00 -0.97 0.00 0.00 1.25 0.00 0.00 42.46 42.74 2b0s s ILE 50 CO 0.00 -0.57 -0.07 0.12 0.24 0.00 0.00 174.94 174.66 2b0s s PHE 51 N -2.21 0.77 -0.42 1.37 5.36 0.56 -1.17 117.98 122.24 2b0s s PHE 51 Ca -0.03 -0.18 -0.09 0.00 -0.96 0.00 0.00 56.93 55.68 2b0s s PHE 51 Cb -0.04 -0.56 0.08 0.00 -0.34 0.00 0.00 43.02 42.16 2b0s s PHE 51 CO -0.02 -0.08 0.25 -0.47 -1.46 0.00 0.00 175.22 173.45 2b0s s TYR 52 N 0.20 3.36 0.50 10.12 5.04 -0.33 -0.89 117.35 135.36 2b0s s TYR 52 Ca -0.03 -1.61 0.15 0.00 -2.44 0.00 0.00 57.07 53.14 2b0s s TYR 52 Cb -0.07 -2.98 1.19 0.00 0.35 0.00 0.00 41.96 40.45 2b0s s TYR 52 CO 0.00 -0.86 2.12 -1.35 -1.34 0.00 0.00 175.55 174.12 2b0s h PRO 52 N 8.38 0.07 -0.66 4.97 0.11 -1.77 0.29 132.00 143.39 2b0s h PRO 52 Ca -0.22 -0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.98 2b0s h PRO 52 Cb 1.08 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.10 2b0s h PRO 52 CO 0.75 0.06 0.28 0.78 -0.21 0.00 0.00 178.00 179.67 2b0s h GLY 53 N 0.12 0.97 -0.44 -0.55 0.00 -1.67 -3.30 103.07 98.20 2b0s h GLY 53 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2b0s h GLY 53 CO -0.00 -0.00 -0.22 2.09 0.00 0.00 0.00 176.54 178.41 2b0s n ASP 54 N -4.95 0.56 -0.83 0.19 3.85 -1.14 -5.02 116.55 109.22 2b0s n ASP 54 Ca 0.10 -1.85 -0.11 0.00 -0.71 0.00 0.00 54.79 52.22 2b0s n ASP 54 Cb 0.29 -0.15 -0.05 0.00 -1.35 0.00 0.00 41.12 39.87 2b0s n ASP 54 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 2b0s n SER 55 N -0.27 -5.28 -4.70 -1.12 7.64 0.10 -4.99 113.62 105.01 2b0s n SER 55 Ca 0.02 0.27 -0.31 0.00 1.01 0.00 0.00 58.87 59.86 2b0s n SER 55 Cb 0.58 -3.73 0.14 0.00 -1.01 0.00 0.00 64.21 60.20 2b0s n SER 55 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2b0s s ASP 56 N -2.50 3.39 0.03 6.43 -1.08 -1.17 -4.75 116.67 117.02 2b0s s ASP 56 Ca 0.00 2.02 -0.22 0.00 -0.52 0.00 0.00 52.55 53.83 2b0s s ASP 56 Cb 0.00 -2.53 0.05 0.00 -1.46 0.00 0.00 42.92 38.98 2b0s s ASP 56 CO 0.00 -2.78 0.50 -0.94 0.52 0.00 0.00 175.17 172.47 2b0s s SER 57 N -2.94 -0.41 -0.04 -0.34 1.04 -1.26 -1.18 113.70 108.57 2b0s s SER 57 Ca 0.65 0.20 0.00 0.00 0.48 0.00 0.00 55.95 57.28 2b0s s SER 57 Cb -0.21 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.40 2b0s s SER 57 CO 0.57 -0.67 -0.01 -0.60 0.98 0.00 0.00 173.24 173.52 2b0s s ARG 58 N -2.18 0.52 -0.14 4.02 3.52 -0.31 -5.00 118.95 119.38 2b0s s ARG 58 Ca -0.07 0.04 -0.04 0.00 -0.13 0.00 0.00 55.73 55.53 2b0s s ARG 58 Cb -0.01 -0.71 -0.03 0.00 -1.56 0.00 0.00 34.95 32.63 2b0s s ARG 58 CO 0.00 -0.17 0.02 0.71 -0.81 0.00 0.00 175.30 175.05 2b0s s TYR 59 N 1.27 3.18 0.43 5.12 1.51 -1.26 -0.20 117.35 127.40 2b0s s TYR 59 Ca -0.06 0.05 -0.24 0.00 -1.01 0.00 0.00 57.07 55.81 2b0s s TYR 59 Cb -0.13 -1.93 -0.10 0.00 -0.11 0.00 0.00 41.96 39.68 2b0s s TYR 59 CO -0.02 0.25 1.10 0.45 -1.11 0.00 0.00 175.55 176.22 2b0s n SER 60 N 2.94 1.68 -0.33 2.29 2.88 0.93 -4.78 113.62 119.22 2b0s n SER 60 Ca -0.18 1.04 0.21 0.00 -1.33 0.00 0.00 58.87 58.62 2b0s n SER 60 Cb 0.53 -1.41 0.48 0.00 -0.75 0.00 0.00 64.21 63.06 2b0s n SER 60 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2b0s h PRO 61 N 1.64 0.43 0.00 -1.46 0.11 -1.95 0.26 132.00 131.03 2b0s h PRO 61 Ca -0.46 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2b0s h PRO 61 Cb 1.32 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2b0s h PRO 61 CO 0.57 0.28 -0.10 0.66 -0.21 0.00 0.00 178.00 179.21 2b0s h SER 62 N 0.44 0.00 0.19 -2.05 4.64 -1.94 -3.21 113.55 111.63 2b0s h SER 62 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 2b0s h SER 62 Cb 1.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 2b0s h SER 62 CO -0.33 0.10 -1.33 0.49 -0.87 0.00 0.00 176.83 174.89 2b0s n PHE 63 N -3.17 0.13 -1.69 4.77 3.72 0.02 -4.77 117.46 116.48 2b0s n PHE 63 Ca 0.02 0.04 -0.51 0.00 -0.05 0.00 0.00 57.45 56.94 2b0s n PHE 63 Cb 0.45 -0.35 -0.06 0.00 -0.94 0.00 0.00 39.48 38.59 2b0s n PHE 63 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 2b0s n GLU 64 N -1.95 1.79 0.00 -1.08 4.07 -0.87 -0.56 120.64 122.04 2b0s n GLU 64 Ca 0.01 0.66 0.00 0.00 -0.06 0.00 0.00 57.16 57.76 2b0s n GLU 64 Cb 0.45 -2.43 0.00 0.00 -0.06 0.00 0.00 31.44 29.40 2b0s n GLU 64 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2b0s n GLY 65 N 4.16 2.69 0.04 8.31 0.00 -1.26 -4.84 105.19 114.29 2b0s n GLY 65 Ca 0.23 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.36 2b0s n GLY 65 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2b0s n GLN 66 N -2.00 0.34 -3.47 1.61 1.13 0.27 -4.98 117.38 110.27 2b0s n GLN 66 Ca 0.00 -0.01 -0.12 0.00 -1.94 0.00 0.00 57.00 54.94 2b0s n GLN 66 Cb 0.00 -1.61 -0.03 0.00 0.11 0.00 0.00 30.24 28.71 2b0s n GLN 66 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2b0s s VAL 67 N -3.23 0.00 -0.17 5.09 0.11 -1.22 -4.89 120.40 116.08 2b0s s VAL 67 Ca 0.03 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.08 2b0s s VAL 67 Cb 0.14 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 34.03 2b0s s VAL 67 CO 0.81 0.00 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.61 2b0s s THR 68 N -2.97 1.29 0.06 5.04 2.01 -0.59 -4.90 115.64 115.57 2b0s s THR 68 Ca 0.00 -0.72 -0.25 0.00 0.31 0.00 0.00 61.69 61.03 2b0s s THR 68 Cb -0.01 -1.41 -0.06 0.00 0.01 0.00 0.00 72.50 71.04 2b0s s THR 68 CO -0.07 0.17 0.77 -0.04 -0.69 0.00 0.00 174.62 174.76 2b0s s MET 69 N 1.56 4.51 0.33 4.92 -1.94 -1.26 -0.67 119.30 126.75 2b0s s MET 69 Ca 0.01 1.09 0.01 0.00 -1.71 0.00 0.00 55.69 55.08 2b0s s MET 69 Cb -0.15 -3.36 -0.00 0.00 2.01 0.00 0.00 34.83 33.33 2b0s s MET 69 CO -0.08 0.30 0.41 -1.13 -0.01 0.00 0.00 175.02 174.51 2b0s n SER 70 N 2.71 -1.11 -3.60 3.03 3.41 -0.32 -5.00 113.62 112.74 2b0s n SER 70 Ca -0.03 -2.92 -0.14 0.00 -0.26 0.00 0.00 58.87 55.52 2b0s n SER 70 Cb 0.50 2.18 -0.06 0.00 -0.26 0.00 0.00 64.21 66.58 2b0s n SER 70 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b0s s ALA 71 N -2.92 -1.27 -0.13 7.33 0.00 -1.26 -0.98 121.76 122.53 2b0s s ALA 71 Ca 0.31 0.58 0.03 0.00 0.00 0.00 0.00 51.96 52.88 2b0s s ALA 71 Cb -0.00 0.33 0.01 0.00 0.00 0.00 0.00 23.12 23.46 2b0s s ALA 71 CO 0.22 -0.47 -0.22 0.16 0.00 0.00 0.00 175.76 175.45 2b0s s ASP 72 N -1.89 3.10 0.11 0.00 -4.77 -0.08 -4.98 116.67 108.16 2b0s s ASP 72 Ca -0.06 -0.59 0.15 0.00 -3.30 0.00 0.00 52.55 48.75 2b0s s ASP 72 Cb -0.01 -1.44 0.67 0.00 -1.09 0.00 0.00 42.92 41.05 2b0s s ASP 72 CO -0.01 0.10 1.47 0.54 0.70 0.00 0.00 175.17 177.97 2b0s n ARG 73 N 3.94 0.07 0.14 2.11 1.74 -1.26 -1.79 116.66 121.61 2b0s n ARG 73 Ca -0.20 0.39 0.13 0.00 -0.77 0.00 0.00 57.85 57.40 2b0s n ARG 73 Cb 0.52 -1.66 0.40 0.00 -1.02 0.00 0.00 32.46 30.71 2b0s n ARG 73 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2b0s h SER 74 N 0.00 0.00 0.00 0.55 4.64 -1.95 -3.34 113.55 113.45 2b0s h SER 74 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b0s h SER 74 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2b0s h SER 74 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 2b0s n THR 75 N -2.44 0.00 -3.40 2.95 -2.24 -0.96 -5.02 114.28 103.18 2b0s n THR 75 Ca 0.04 -0.27 -0.23 0.00 -2.27 0.00 0.00 64.05 61.32 2b0s n THR 75 Cb 0.40 1.44 0.06 0.00 -2.10 0.00 0.00 70.33 70.13 2b0s n THR 75 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2b0s n ASN 76 N -0.02 -6.30 -4.12 3.42 5.03 -0.74 -4.82 115.26 107.71 2b0s n ASN 76 Ca 0.00 -0.45 -0.32 0.00 0.87 0.00 0.00 54.58 54.68 2b0s n ASN 76 Cb 0.11 -4.99 -0.16 0.00 -1.02 0.00 0.00 39.78 33.71 2b0s n ASN 76 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2b0s s THR 77 N -3.27 1.93 0.16 3.41 2.01 -1.11 -1.45 115.64 117.32 2b0s s THR 77 Ca 0.49 -0.88 -0.14 0.00 0.31 0.00 0.00 61.69 61.46 2b0s s THR 77 Cb -0.22 -1.73 -0.07 0.00 0.01 0.00 0.00 72.50 70.49 2b0s s THR 77 CO 0.61 0.52 0.56 0.00 -0.69 0.00 0.00 174.62 175.62 2b0s s ALA 78 N 1.04 3.56 0.08 7.40 0.00 -0.14 -0.90 121.76 132.81 2b0s s ALA 78 Ca -0.02 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 51.85 2b0s s ALA 78 Cb -0.14 -2.54 -0.03 0.00 0.00 0.00 0.00 23.12 20.40 2b0s s ALA 78 CO -0.06 0.45 -0.09 -1.01 0.00 0.00 0.00 175.76 175.04 2b0s s HIS 79 N -1.50 0.96 -0.12 0.00 3.76 -0.15 -0.32 115.29 117.92 2b0s s HIS 79 Ca 0.39 -0.64 -0.00 0.00 -0.15 0.00 0.00 55.06 54.66 2b0s s HIS 79 Cb -0.15 -0.54 0.02 0.00 1.11 0.00 0.00 32.58 33.03 2b0s s HIS 79 CO 0.19 -0.04 -0.09 -1.17 -0.85 0.00 0.00 174.74 172.79 2b0s s LEU 80 N -2.26 1.31 -0.06 0.89 2.96 -0.87 -1.17 118.68 119.48 2b0s s LEU 80 Ca 0.02 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 53.65 2b0s s LEU 80 Cb -0.04 -0.90 -0.01 0.00 0.50 0.00 0.00 46.19 45.74 2b0s s LEU 80 CO -0.00 -0.09 -0.23 -1.10 -1.32 0.00 0.00 176.35 173.60 2b0s s GLN 81 N 1.58 2.63 0.18 1.98 -0.21 0.15 -1.40 119.66 124.57 2b0s s GLN 81 Ca 0.03 -0.87 0.00 0.00 0.02 0.00 0.00 55.36 54.54 2b0s s GLN 81 Cb -0.13 -2.22 0.00 0.00 1.00 0.00 0.00 33.01 31.66 2b0s s GLN 81 CO -0.08 0.38 0.01 0.91 -2.12 0.00 0.00 175.29 174.40 2b0s n TRP 82 N 2.96 0.25 -0.54 0.91 8.01 -0.04 -1.54 117.44 127.46 2b0s n TRP 82 Ca -0.18 -0.87 0.00 0.00 -1.31 0.00 0.00 57.50 55.14 2b0s n TRP 82 Cb 0.52 -0.12 0.00 0.00 -2.01 0.00 0.00 31.31 29.70 2b0s n TRP 82 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 2b0s n SER 82 N -1.19 -1.03 -4.73 -0.99 2.88 -1.26 -0.58 113.62 106.72 2b0s n SER 82 Ca -0.07 -0.72 -0.42 0.00 -1.33 0.00 0.00 58.87 56.33 2b0s n SER 82 Cb 0.23 -0.30 -0.02 0.00 -0.75 0.00 0.00 64.21 63.37 2b0s n SER 82 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2b0s n LEU 82 N 2.37 4.09 -4.60 2.46 4.77 -0.35 -4.68 117.00 121.07 2b0s n LEU 82 Ca 0.00 1.12 -0.29 0.00 -0.03 0.00 0.00 56.01 56.81 2b0s n LEU 82 Cb 0.26 -1.56 -0.09 0.00 -2.33 0.00 0.00 43.42 39.69 2b0s n LEU 82 CO 0.26 0.07 -0.40 -0.54 -1.33 0.00 0.00 177.39 175.45 2b0s s LYS 83 N -0.06 2.21 0.41 3.23 1.02 -1.26 -0.18 119.74 125.11 2b0s s LYS 83 Ca 0.68 -1.04 0.19 0.00 0.02 0.00 0.00 55.97 55.81 2b0s s LYS 83 Cb -0.52 -2.32 1.12 0.00 -0.52 0.00 0.00 37.83 35.58 2b0s s LYS 83 CO 0.44 0.50 1.79 -1.35 -0.92 0.00 0.00 175.35 175.81 2b0s h PRO 84 N 3.38 0.37 0.00 -1.68 0.11 -1.93 -0.74 132.00 131.51 2b0s h PRO 84 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2b0s h PRO 84 Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2b0s h PRO 84 CO 0.54 0.25 0.00 -1.13 -0.21 0.00 0.00 178.00 177.45 2b0s n SER 85 N -4.58 0.00 -0.11 -2.05 3.41 -1.26 -1.65 113.62 107.38 2b0s n SER 85 Ca 0.24 0.20 0.15 0.00 -0.26 0.00 0.00 58.87 59.20 2b0s n SER 85 Cb 0.86 -0.35 0.81 0.00 -0.26 0.00 0.00 64.21 65.26 2b0s n SER 85 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2b0s n ASP 86 N -1.35 0.36 -4.63 4.04 8.00 -0.28 -4.86 116.55 117.82 2b0s n ASP 86 Ca 0.06 -0.98 -0.43 0.00 0.71 0.00 0.00 54.79 54.15 2b0s n ASP 86 Cb 0.14 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.18 2b0s n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2b0s s THR 87 N -2.10 3.59 0.01 -3.53 2.01 -0.66 -4.87 115.64 110.10 2b0s s THR 87 Ca 0.42 0.68 -0.29 0.00 0.31 0.00 0.00 61.69 62.81 2b0s s THR 87 Cb 0.21 -3.59 0.11 0.00 0.01 0.00 0.00 72.50 69.24 2b0s s THR 87 CO 0.38 -0.23 1.25 0.00 -0.69 0.00 0.00 174.62 175.33 2b0s s ALA 88 N 5.26 -2.22 -0.12 7.40 0.00 -0.01 -4.45 121.76 127.61 2b0s s ALA 88 Ca 0.75 0.37 -0.20 0.00 0.00 0.00 0.00 51.96 52.88 2b0s s ALA 88 Cb -0.27 0.57 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 2b0s s ALA 88 CO 0.30 -1.08 0.56 -1.17 0.00 0.00 0.00 175.76 174.37 2b0s s LEU 89 N -3.27 4.26 -0.17 0.00 2.96 -0.66 -0.84 118.68 120.96 2b0s s LEU 89 Ca 0.19 0.91 -0.01 0.00 -0.22 0.00 0.00 54.13 55.00 2b0s s LEU 89 Cb 0.02 -2.83 -0.00 0.00 0.50 0.00 0.00 46.19 43.88 2b0s s LEU 89 CO -0.02 -0.08 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.50 2b0s s TYR 90 N 0.94 2.84 -0.00 5.38 1.51 -0.10 -0.31 117.35 127.60 2b0s s TYR 90 Ca 0.29 -0.98 0.02 0.00 -1.01 0.00 0.00 57.07 55.39 2b0s s TYR 90 Cb -0.16 -1.94 -0.04 0.00 -0.11 0.00 0.00 41.96 39.72 2b0s s TYR 90 CO 0.12 -0.46 -0.01 0.71 -1.11 0.00 0.00 175.55 174.80 2b0s s TYR 91 N 0.92 3.05 0.00 2.71 2.02 0.57 -0.71 117.35 125.92 2b0s s TYR 91 Ca -0.03 0.06 0.01 0.00 -0.37 0.00 0.00 57.07 56.75 2b0s s TYR 91 Cb -0.15 -1.66 -0.04 0.00 -0.40 0.00 0.00 41.96 39.71 2b0s s TYR 91 CO -0.01 0.45 0.03 0.00 -1.57 0.00 0.00 175.55 174.45 2b0s s ALA 93 N -1.14 -1.05 0.14 0.00 0.00 -0.34 -0.46 121.76 118.91 2b0s s ALA 93 Ca 0.21 1.10 -0.30 0.00 0.00 0.00 0.00 51.96 52.97 2b0s s ALA 93 Cb -0.12 -0.58 -0.07 0.00 0.00 0.00 0.00 23.12 22.36 2b0s s ALA 93 CO 0.12 -0.21 1.03 0.50 0.00 0.00 0.00 175.76 177.20 2b0s s ARG 94 N -0.02 4.64 -0.40 0.00 3.52 0.01 0.25 118.95 126.95 2b0s s ARG 94 Ca -0.02 1.58 -0.23 0.00 -0.13 0.00 0.00 55.73 56.94 2b0s s ARG 94 Cb -0.03 -3.33 0.02 0.00 -1.56 0.00 0.00 34.95 30.04 2b0s s ARG 94 CO 0.01 0.14 0.75 -1.17 -0.81 0.00 0.00 175.30 174.23 2b0s s LEU 95 N -0.14 4.22 0.00 -0.88 2.96 -0.09 -1.54 118.68 123.20 2b0s s LEU 95 Ca 0.48 0.10 0.00 0.00 -0.22 0.00 0.00 54.13 54.49 2b0s s LEU 95 Cb -0.26 -2.95 0.00 0.00 0.50 0.00 0.00 46.19 43.48 2b0s s LEU 95 CO 0.32 -0.78 0.00 0.61 -1.32 0.00 0.00 176.35 175.18 2b0s n GLY 96 N 4.76 3.48 0.00 7.98 0.00 0.20 -4.22 105.19 117.38 2b0s n GLY 96 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2b0s n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b0s n GLY 97 N 0.00 3.10 3.92 -0.02 0.00 -1.26 -1.64 105.19 109.29 2b0s n GLY 97 Ca 0.00 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.74 2b0s n GLY 97 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b0s n ASP 98 N 0.66 -4.68 0.18 1.61 8.00 -1.26 -4.89 116.55 116.17 2b0s n ASP 98 Ca 0.00 -0.78 0.03 0.00 0.71 0.00 0.00 54.79 54.75 2b0s n ASP 98 Cb 0.00 -3.74 0.31 0.00 -0.02 0.00 0.00 41.12 37.67 2b0s n ASP 98 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2b0s h TYR 99 N -1.98 0.00 -0.70 1.24 0.05 -1.86 -3.45 116.97 110.27 2b0s h TYR 99 Ca -0.57 0.00 -0.66 0.00 0.05 0.00 0.00 58.73 57.54 2b0s h TYR 99 Cb 1.37 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 38.98 2b0s h TYR 99 CO 0.58 0.44 -0.50 -1.21 -1.05 0.00 0.00 178.16 176.41 2b0s s GLU 100 N -3.78 2.18 0.55 4.88 2.02 -1.26 -5.03 118.70 118.25 2b0s s GLU 100 Ca -0.01 -2.40 0.26 0.00 0.02 0.00 0.00 54.97 52.84 2b0s s GLU 100 Cb 0.12 -1.32 1.57 0.00 0.10 0.00 0.00 34.13 34.61 2b0s s GLU 100 CO 0.71 -0.43 2.17 -0.44 0.02 0.00 0.00 175.26 177.29 2b0s h ASP 100 N 1.39 0.00 -3.63 -0.19 3.32 -2.04 -3.44 116.42 111.82 2b0s h ASP 100 Ca -0.42 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.23 2b0s h ASP 100 Cb 1.32 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.72 2b0s h ASP 100 CO 0.69 0.05 -0.67 -0.94 -1.72 0.00 0.00 179.24 176.65 2b0s s SER 100 N -6.36 2.08 0.49 6.45 1.04 -1.26 -5.12 113.70 111.02 2b0s s SER 100 Ca -0.04 -1.17 0.00 0.00 0.48 0.00 0.00 55.95 55.22 2b0s s SER 100 Cb 0.15 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.23 2b0s s SER 100 CO 0.59 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.99 2b0s n GLY 100 N -0.42 -1.53 3.56 7.32 0.00 -1.26 -4.85 105.19 108.01 2b0s n GLY 100 Ca -0.06 -1.21 -0.10 0.00 0.00 0.00 0.00 46.02 44.65 2b0s n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b0s s ALA 100 N -1.52 -1.15 0.00 4.61 0.00 -1.26 -4.58 121.76 117.85 2b0s s ALA 100 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2b0s s ALA 100 Cb 0.00 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.98 2b0s s ALA 100 CO 0.00 -0.84 0.00 -0.40 0.00 0.00 0.00 175.76 174.52 2b0s n ASP 100 N -0.37 0.00 -4.25 0.00 5.75 -0.65 -4.92 116.55 112.11 2b0s n ASP 100 Ca -0.11 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.39 2b0s n ASP 100 Cb 0.62 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.56 2b0s n ASP 100 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b0s s ALA 100 N 0.00 1.86 -0.58 2.12 0.00 -0.91 -4.91 121.76 119.34 2b0s s ALA 100 Ca 0.00 -0.97 -0.27 0.00 0.00 0.00 0.00 51.96 50.71 2b0s s ALA 100 Cb 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.65 2b0s s ALA 100 CO 0.00 0.46 1.55 -0.06 0.00 0.00 0.00 175.76 177.70 2b0s s PHE 100 N -0.54 2.08 -0.25 0.00 0.08 -1.26 0.59 117.98 118.68 2b0s s PHE 100 Ca 0.09 0.50 -0.15 0.00 0.12 0.00 0.00 56.93 57.48 2b0s s PHE 100 Cb -0.09 -4.32 -0.11 0.00 -0.57 0.00 0.00 43.02 37.93 2b0s s PHE 100 CO -0.01 -2.16 -0.31 -0.40 -0.10 0.00 0.00 175.22 172.24 2b0s n ASP 101 N 10.44 1.95 -4.48 1.36 5.75 -0.59 -4.91 116.55 126.07 2b0s n ASP 101 Ca 0.14 0.35 -0.34 0.00 -0.01 0.00 0.00 54.79 54.93 2b0s n ASP 101 Cb 0.50 -0.82 -0.12 0.00 -1.03 0.00 0.00 41.12 39.65 2b0s n ASP 101 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 2b0s s PHE 102 N -2.58 3.04 0.08 2.11 0.40 -1.26 -4.99 117.98 114.78 2b0s s PHE 102 Ca -0.36 -0.35 0.06 0.00 -0.60 0.00 0.00 56.93 55.68 2b0s s PHE 102 Cb 0.12 -2.01 -0.04 0.00 0.51 0.00 0.00 43.02 41.60 2b0s s PHE 102 CO 0.48 -0.11 -0.08 -1.58 0.70 0.00 0.00 175.22 174.63 2b0s s TRP 103 N 0.60 2.80 0.88 0.36 0.52 -1.26 -0.81 118.94 122.04 2b0s s TRP 103 Ca -0.02 -0.12 -0.12 0.00 0.02 0.00 0.00 56.10 55.87 2b0s s TRP 103 Cb -0.14 -1.49 0.12 0.00 -1.15 0.00 0.00 33.47 30.81 2b0s s TRP 103 CO 0.02 0.42 1.10 0.20 0.02 0.00 0.00 176.95 178.71 2b0s s GLY 104 N -2.02 1.61 0.00 0.98 0.00 0.39 -4.31 107.32 103.96 2b0s s GLY 104 Ca 0.21 -0.19 0.30 0.00 0.00 0.00 0.00 44.72 45.04 2b0s s GLY 104 CO 0.13 0.30 1.99 0.61 0.00 0.00 0.00 173.10 176.13 2b0s n GLN 105 N -3.76 0.56 0.00 2.90 0.00 -1.26 -4.76 117.38 111.06 2b0s n GLN 105 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 57.00 56.98 2b0s n GLN 105 Cb 0.56 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.30 2b0s n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2b0s n GLY 106 N 1.26 1.04 2.87 2.61 0.00 -1.26 -5.03 105.19 106.68 2b0s n GLY 106 Ca 0.15 -1.71 -0.24 0.00 0.00 0.00 0.00 46.02 44.22 2b0s n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b0s s THR 107 N -2.74 0.71 0.10 2.61 2.01 0.11 -4.83 115.64 113.61 2b0s s THR 107 Ca 0.00 -0.13 -0.25 0.00 0.31 0.00 0.00 61.69 61.62 2b0s s THR 107 Cb 0.00 -0.76 -0.07 0.00 0.01 0.00 0.00 72.50 71.68 2b0s s THR 107 CO 0.00 0.30 0.76 -0.76 -0.69 0.00 0.00 174.62 174.22 2b0s s LEU 108 N 1.50 4.52 -0.11 4.42 1.43 -1.26 -0.92 118.68 128.26 2b0s s LEU 108 Ca -0.01 1.52 -0.01 0.00 -1.03 0.00 0.00 54.13 54.60 2b0s s LEU 108 Cb -0.13 -3.24 0.03 0.00 0.03 0.00 0.00 46.19 42.88 2b0s s LEU 108 CO -0.04 0.12 -0.04 -0.69 0.23 0.00 0.00 176.35 175.93 2b0s s VAL 109 N -0.60 0.74 -0.16 -1.59 1.01 -0.02 -0.70 120.40 119.09 2b0s s VAL 109 Ca 0.37 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.18 2b0s s VAL 109 Cb -0.22 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.31 2b0s s VAL 109 CO 0.24 0.27 -0.15 -0.89 0.00 0.00 0.00 175.10 174.57 2b0s s THR 110 N 1.82 2.60 -0.08 3.92 2.01 0.52 -0.83 115.64 125.59 2b0s s THR 110 Ca 0.04 -0.78 0.02 0.00 0.31 0.00 0.00 61.69 61.28 2b0s s THR 110 Cb -0.13 -2.10 0.01 0.00 0.01 0.00 0.00 72.50 70.29 2b0s s THR 110 CO -0.07 0.51 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.55 2b0s s VAL 111 N 0.95 1.29 0.04 3.82 1.01 -1.26 0.64 120.40 126.89 2b0s s VAL 111 Ca -0.03 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2b0s s VAL 111 Cb -0.15 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 2b0s s VAL 111 CO -0.02 0.39 -0.08 -0.55 0.00 0.00 0.00 175.10 174.84 2b0s s SER 112 N 0.80 0.85 0.00 3.32 0.15 -0.93 -4.36 113.70 113.53 2b0s s SER 112 Ca -0.11 -0.54 0.05 0.00 0.70 0.00 0.00 55.95 56.04 2b0s s SER 112 Cb -0.16 0.03 -0.01 0.00 -1.71 0.00 0.00 66.02 64.18 2b0s s SER 112 CO 0.02 -0.20 0.42 -0.24 1.20 0.00 0.00 173.24 174.44 2b0s n SER 113 N 1.48 0.80 -4.80 5.45 2.88 -1.26 -1.82 113.62 116.34 2b0s n SER 113 Ca -0.23 -0.90 -0.34 0.00 -1.33 0.00 0.00 58.87 56.07 2b0s n SER 113 Cb 0.55 0.52 -0.05 0.00 -0.75 0.00 0.00 64.21 64.48 2b0s n SER 113 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b0s s ALA 114 N -0.96 2.98 0.20 -1.46 0.00 -1.26 -4.99 121.76 116.27 2b0s s ALA 114 Ca 0.04 0.55 0.07 0.00 0.00 0.00 0.00 51.96 52.62 2b0s s ALA 114 Cb 0.04 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 2b0s s ALA 114 CO 0.13 -0.13 0.12 -1.12 0.00 0.00 0.00 175.76 174.76 2b0s s SER 115 N -1.95 5.30 0.21 0.00 0.01 -1.26 -5.06 113.70 110.95 2b0s s SER 115 Ca 0.63 -0.26 -0.31 0.00 1.31 0.00 0.00 55.95 57.31 2b0s s SER 115 Cb -0.15 -1.30 -0.11 0.00 0.21 0.00 0.00 66.02 64.67 2b0s s SER 115 CO 0.19 0.03 1.58 0.28 0.41 0.00 0.00 173.24 175.74 2b0s s THR 116 N -1.93 2.41 -0.14 1.44 -1.32 -1.26 -4.67 115.64 110.18 2b0s s THR 116 Ca 0.31 0.31 -0.10 0.00 -1.21 0.00 0.00 61.69 61.00 2b0s s THR 116 Cb -0.09 -3.20 0.04 0.00 -1.51 0.00 0.00 72.50 67.75 2b0s s THR 116 CO 0.23 0.03 0.34 -0.75 -2.21 0.00 0.00 174.62 172.26 2b0s s LYS 117 N 0.62 0.37 0.51 7.08 2.20 -0.05 -4.95 119.74 125.52 2b0s s LYS 117 Ca 0.68 0.57 -0.09 0.00 -0.36 0.00 0.00 55.97 56.77 2b0s s LYS 117 Cb -0.45 0.08 -0.04 0.00 -1.51 0.00 0.00 37.83 35.91 2b0s s LYS 117 CO 0.36 -0.10 0.87 0.20 -0.36 0.00 0.00 175.35 176.33 2b0s s GLY 118 N 0.68 1.66 0.58 5.54 0.00 -1.26 -1.23 107.32 113.28 2b0s s GLY 118 Ca -0.04 -0.28 -0.15 0.00 0.00 0.00 0.00 44.72 44.24 2b0s s GLY 118 CO -0.04 -0.07 1.03 2.56 0.00 0.00 0.00 173.10 176.57 2b0s s PRO 119 N -4.69 3.53 -0.08 2.90 0.04 -1.26 -4.60 135.00 130.84 2b0s s PRO 119 Ca 0.51 1.06 -0.16 0.00 0.04 0.00 0.00 61.00 62.45 2b0s s PRO 119 Cb -0.10 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 2b0s s PRO 119 CO 0.45 -0.62 0.40 -1.12 0.04 0.00 0.00 177.00 176.15 2b0s s SER 120 N -3.08 6.67 -0.16 6.66 0.01 0.02 -4.89 113.70 118.94 2b0s s SER 120 Ca 0.61 0.80 -0.03 0.00 1.31 0.00 0.00 55.95 58.64 2b0s s SER 120 Cb -0.13 -2.25 -0.02 0.00 0.21 0.00 0.00 66.02 63.83 2b0s s SER 120 CO 0.38 0.15 -0.06 -0.69 0.41 0.00 0.00 173.24 173.43 2b0s s VAL 121 N -0.09 3.60 0.03 3.43 1.01 -1.26 -0.30 120.40 126.82 2b0s s VAL 121 Ca 0.23 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.82 2b0s s VAL 121 Cb -0.15 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.64 2b0s s VAL 121 CO 0.10 0.49 -0.22 -0.36 0.00 0.00 0.00 175.10 175.11 2b0s s PHE 122 N 0.50 1.91 0.17 5.22 0.08 0.71 -4.98 117.98 121.61 2b0s s PHE 122 Ca -0.05 -0.38 -0.30 0.00 0.12 0.00 0.00 56.93 56.33 2b0s s PHE 122 Cb -0.15 -1.17 -0.07 0.00 -0.57 0.00 0.00 43.02 41.06 2b0s s PHE 122 CO 0.03 0.06 1.04 -1.25 -0.10 0.00 0.00 175.22 175.01 2b0s s PRO 123 N -1.00 4.66 -0.58 0.24 0.04 -1.26 0.05 135.00 137.14 2b0s s PRO 123 Ca 0.08 1.62 -0.15 0.00 0.04 0.00 0.00 61.00 62.59 2b0s s PRO 123 Cb -0.09 -3.30 0.14 0.00 0.04 0.00 0.00 34.50 31.30 2b0s s PRO 123 CO 0.01 0.17 0.53 -0.51 0.04 0.00 0.00 177.00 177.25 2b0s s LEU 124 N -0.43 6.26 0.22 -3.56 1.43 0.44 -4.85 118.68 118.19 2b0s s LEU 124 Ca 0.47 -1.93 -0.30 0.00 -1.03 0.00 0.00 54.13 51.34 2b0s s LEU 124 Cb -0.27 -2.20 -0.09 0.00 0.03 0.00 0.00 46.19 43.65 2b0s s LEU 124 CO 0.33 -0.81 1.36 0.00 0.23 0.00 0.00 176.35 177.46 2b0s s ALA 125 N 1.37 3.56 0.31 4.21 0.00 -1.26 -1.59 121.76 128.37 2b0s s ALA 125 Ca 0.05 1.19 -0.29 0.00 0.00 0.00 0.00 51.96 52.91 2b0s s ALA 125 Cb -0.27 -3.51 -0.10 0.00 0.00 0.00 0.00 23.12 19.24 2b0s s ALA 125 CO 0.01 -0.61 1.39 -1.25 0.00 0.00 0.00 175.76 175.30 2b0s s PRO 126 N -0.22 4.27 0.57 0.00 0.04 -1.26 -4.85 135.00 133.55 2b0s s PRO 126 Ca 0.58 2.33 0.16 0.00 0.04 0.00 0.00 61.00 64.11 2b0s s PRO 126 Cb -0.38 -3.06 0.57 0.00 0.04 0.00 0.00 34.50 31.66 2b0s s PRO 126 CO 0.40 -0.34 1.09 0.45 0.04 0.00 0.00 177.00 178.64 2b0s n SER 127 N 1.25 0.00 0.00 6.66 2.88 -1.26 -4.08 113.62 119.07 2b0s n SER 127 Ca 0.03 0.61 0.00 0.00 -1.33 0.00 0.00 58.87 58.18 2b0s n SER 127 Cb 0.41 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 2b0s n SER 127 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2b0s n SER 128 N -2.82 0.00 -4.66 -3.46 2.88 -1.26 -4.98 113.62 99.32 2b0s n SER 128 Ca 0.15 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.29 2b0s n SER 128 Cb 1.24 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.74 2b0s n SER 128 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2b0s n LYS 129 N 0.00 1.34 0.00 -1.46 5.02 -1.26 -4.74 118.16 117.06 2b0s n LYS 129 Ca 0.00 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 2b0s n LYS 129 Cb 0.00 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 32.72 2b0s n LYS 129 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2b0s n SER 130 N -0.46 0.00 -4.21 4.39 7.64 -1.25 -4.94 113.62 114.79 2b0s n SER 130 Ca 0.11 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.78 2b0s n SER 130 Cb 0.44 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.51 2b0s n SER 130 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2b0s s THR 133 N 0.00 1.38 -0.41 0.44 -1.32 -1.26 -5.02 115.64 109.45 2b0s s THR 133 Ca 0.00 -1.31 0.07 0.00 -1.21 0.00 0.00 61.69 59.24 2b0s s THR 133 Cb 0.00 -1.26 0.53 0.00 -1.51 0.00 0.00 72.50 70.25 2b0s s THR 133 CO 0.00 -0.07 1.48 -1.20 -2.21 0.00 0.00 174.62 172.62 2b0s n SER 134 N 1.41 3.98 -0.73 8.08 7.64 -1.26 -1.15 113.62 131.58 2b0s n SER 134 Ca -0.20 -2.84 0.03 0.00 1.01 0.00 0.00 58.87 56.87 2b0s n SER 134 Cb 0.54 -0.67 0.12 0.00 -1.01 0.00 0.00 64.21 63.18 2b0s n SER 134 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b0s n GLY 135 N -0.01 1.20 5.00 0.23 0.00 -1.26 -5.00 105.19 105.35 2b0s n GLY 135 Ca 0.29 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2b0s n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b0s n GLY 136 N 0.47 1.02 3.66 -0.02 0.00 -0.30 -4.82 105.19 105.20 2b0s n GLY 136 Ca 0.08 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2b0s n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b0s s THR 137 N 0.00 2.79 0.02 2.61 -4.23 -1.26 -1.43 115.64 114.14 2b0s s THR 137 Ca 0.00 -1.89 0.04 0.00 -1.18 0.00 0.00 61.69 58.66 2b0s s THR 137 Cb 0.00 -2.85 -0.02 0.00 1.34 0.00 0.00 72.50 70.98 2b0s s THR 137 CO 0.00 -0.21 -0.13 0.00 -0.54 0.00 0.00 174.62 173.74 2b0s s ALA 138 N -2.48 1.07 -0.30 3.99 0.00 0.40 -4.64 121.76 119.81 2b0s s ALA 138 Ca 0.35 -0.69 -0.10 0.00 0.00 0.00 0.00 51.96 51.52 2b0s s ALA 138 Cb -0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 2b0s s ALA 138 CO 0.20 0.22 0.16 0.00 0.00 0.00 0.00 175.76 176.34 2b0s s ALA 139 N -0.63 3.34 0.25 0.00 0.00 -1.26 -1.25 121.76 122.20 2b0s s ALA 139 Ca 0.02 -1.30 0.07 0.00 0.00 0.00 0.00 51.96 50.76 2b0s s ALA 139 Cb -0.07 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.60 2b0s s ALA 139 CO 0.01 -0.79 -0.10 -0.48 0.00 0.00 0.00 175.76 174.39 2b0s s LEU 140 N 1.66 2.52 0.00 0.00 0.05 -0.53 -4.26 118.68 118.11 2b0s s LEU 140 Ca 0.06 -1.11 -0.01 0.00 0.05 0.00 0.00 54.13 53.12 2b0s s LEU 140 Cb -0.17 -0.67 0.00 0.00 -2.05 0.00 0.00 46.19 43.31 2b0s s LEU 140 CO 0.07 -0.25 0.05 0.61 -0.55 0.00 0.00 176.35 176.28 2b0s n GLY 141 N -0.49 1.09 2.89 -3.48 0.00 -0.62 0.06 105.19 104.64 2b0s n GLY 141 Ca -0.07 -0.90 -0.18 0.00 0.00 0.00 0.00 46.02 44.87 2b0s n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b0s s LEU 143 N 0.71 4.12 -0.43 0.00 2.96 0.11 -1.72 118.68 124.41 2b0s s LEU 143 Ca -0.08 0.47 -0.05 0.00 -0.22 0.00 0.00 54.13 54.24 2b0s s LEU 143 Cb -0.12 -2.52 0.11 0.00 0.50 0.00 0.00 46.19 44.17 2b0s s LEU 143 CO -0.00 -0.13 0.26 -0.69 -1.32 0.00 0.00 176.35 174.47 2b0s s VAL 144 N 1.61 3.67 -0.00 1.68 1.01 0.14 -0.20 120.40 128.30 2b0s s VAL 144 Ca 0.19 -1.94 0.05 0.00 0.00 0.00 0.00 61.98 60.28 2b0s s VAL 144 Cb -0.15 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 2b0s s VAL 144 CO 0.09 -0.72 -0.15 -1.59 0.00 0.00 0.00 175.10 172.73 2b0s s LYS 145 N 1.23 2.33 -0.65 2.72 -2.85 0.59 -1.58 119.74 121.53 2b0s s LYS 145 Ca 0.07 -0.82 -0.00 0.00 -1.00 0.00 0.00 55.97 54.21 2b0s s LYS 145 Cb -0.24 -2.31 -0.01 0.00 -2.06 0.00 0.00 37.83 33.21 2b0s s LYS 145 CO -0.03 0.58 0.61 -0.25 0.10 0.00 0.00 175.35 176.37 2b0s n ASP 146 N 1.86 -6.82 -4.35 0.03 8.00 -0.49 -0.80 116.55 113.98 2b0s n ASP 146 Ca -0.16 -0.11 -0.18 0.00 0.71 0.00 0.00 54.79 55.04 2b0s n ASP 146 Cb 0.52 -4.64 -0.10 0.00 -0.02 0.00 0.00 41.12 36.89 2b0s n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2b0s s TYR 147 N -3.03 1.69 -0.27 1.24 -0.85 0.13 -4.27 117.35 111.98 2b0s s TYR 147 Ca 0.04 -0.66 -0.23 0.00 -0.52 0.00 0.00 57.07 55.69 2b0s s TYR 147 Cb -0.00 -0.86 0.09 0.00 0.38 0.00 0.00 41.96 41.56 2b0s s TYR 147 CO 0.63 0.26 0.79 0.12 -1.52 0.00 0.00 175.55 175.84 2b0s s PHE 148 N -3.08 -0.75 0.24 -3.49 5.36 -0.36 -0.18 117.98 115.71 2b0s s PHE 148 Ca 0.24 1.76 -0.02 0.00 -0.96 0.00 0.00 56.93 57.95 2b0s s PHE 148 Cb 0.01 0.34 0.05 0.00 -0.34 0.00 0.00 43.02 43.09 2b0s s PHE 148 CO 0.07 -0.36 0.32 -0.35 -1.46 0.00 0.00 175.22 173.44 2b0s n PRO 149 N 2.84 0.01 -1.14 10.12 -0.04 -1.26 -0.87 135.00 144.66 2b0s n PRO 149 Ca -0.15 -0.65 -0.31 0.00 -0.04 0.00 0.00 63.50 62.35 2b0s n PRO 149 Cb 0.56 -0.29 0.11 0.00 -0.04 0.00 0.00 33.50 33.84 2b0s n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2b0s s GLU 150 N -3.49 2.00 0.44 0.54 0.41 -1.26 -4.74 118.70 112.60 2b0s s GLU 150 Ca 0.20 1.24 0.08 0.00 -0.41 0.00 0.00 54.97 56.08 2b0s s GLU 150 Cb -0.01 -1.86 0.01 0.00 -1.78 0.00 0.00 34.13 30.49 2b0s s GLU 150 CO 0.13 -1.85 0.56 -1.25 -0.49 0.00 0.00 175.26 172.36 2b0s s PRO 151 N -4.85 2.73 -0.08 0.39 0.04 -1.26 -4.98 135.00 126.99 2b0s s PRO 151 Ca 0.62 -1.33 0.05 0.00 0.04 0.00 0.00 61.00 60.38 2b0s s PRO 151 Cb -0.18 -2.68 -0.00 0.00 0.04 0.00 0.00 34.50 31.67 2b0s s PRO 151 CO 0.56 -0.32 -0.23 0.08 0.04 0.00 0.00 177.00 177.13 2b0s s VAL 152 N -2.40 1.96 0.09 -0.36 1.01 -1.26 -4.55 120.40 114.89 2b0s s VAL 152 Ca 0.54 -0.98 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 2b0s s VAL 152 Cb -0.08 -1.69 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 2b0s s VAL 152 CO 0.33 0.54 0.35 0.42 0.00 0.00 0.00 175.10 176.74 2b0s s THR 153 N 0.17 5.19 -0.05 3.92 -4.23 -0.41 -4.96 115.64 115.28 2b0s s THR 153 Ca -0.13 0.15 0.01 0.00 -1.18 0.00 0.00 61.69 60.54 2b0s s THR 153 Cb -0.16 -3.62 0.02 0.00 1.34 0.00 0.00 72.50 70.09 2b0s s THR 153 CO 0.06 0.18 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.60 2b0s s VAL 154 N -1.50 0.50 0.32 2.29 1.01 -1.26 -0.87 120.40 120.89 2b0s s VAL 154 Ca 0.36 -0.07 0.10 0.00 0.00 0.00 0.00 61.98 62.36 2b0s s VAL 154 Cb -0.13 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 2b0s s VAL 154 CO 0.21 0.23 -0.03 -0.55 0.00 0.00 0.00 175.10 174.95 2b0s s SER 156 N 1.10 4.08 -0.07 3.32 0.15 0.30 -4.95 113.70 117.63 2b0s s SER 156 Ca -0.08 -0.99 0.03 0.00 0.70 0.00 0.00 55.95 55.62 2b0s s SER 156 Cb -0.14 -0.51 0.00 0.00 -1.71 0.00 0.00 66.02 63.66 2b0s s SER 156 CO -0.01 -0.17 -0.18 0.26 1.20 0.00 0.00 173.24 174.35 2b0s s TRP 157 N -2.51 1.92 -1.33 3.44 0.52 -1.26 -0.27 118.94 119.45 2b0s s TRP 157 Ca 0.33 -0.70 -0.04 0.00 0.02 0.00 0.00 56.10 55.72 2b0s s TRP 157 Cb -0.01 -1.32 0.02 0.00 -1.15 0.00 0.00 33.47 31.00 2b0s s TRP 157 CO 0.18 -0.30 0.88 0.09 0.02 0.00 0.00 176.95 177.82 2b0s n ASN 162 N 3.54 -2.62 -3.38 2.95 4.13 0.71 -1.78 115.26 118.81 2b0s n ASN 162 Ca -0.20 -0.73 -0.24 0.00 1.68 0.00 0.00 54.58 55.08 2b0s n ASN 162 Cb 0.52 -4.39 0.01 0.00 -1.54 0.00 0.00 39.78 34.39 2b0s n ASN 162 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2b0s n SER 163 N -3.03 -4.58 0.00 6.41 7.64 -1.26 -1.02 113.62 117.78 2b0s n SER 163 Ca -0.20 -0.44 0.00 0.00 1.01 0.00 0.00 58.87 59.24 2b0s n SER 163 Cb 0.64 -3.73 0.00 0.00 -1.01 0.00 0.00 64.21 60.10 2b0s n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b0s n GLY 164 N -1.37 1.59 0.25 0.23 0.00 -0.73 -4.92 105.19 100.23 2b0s n GLY 164 Ca -0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.09 2b0s n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b0s h ALA 165 N 0.00 1.35 -3.29 4.61 0.00 -0.98 -3.40 119.26 117.55 2b0s h ALA 165 Ca 0.00 -0.14 -0.69 0.00 0.00 0.00 0.00 54.91 54.08 2b0s h ALA 165 Cb 0.00 -0.02 -0.32 0.00 0.00 0.00 0.00 17.79 17.44 2b0s h ALA 165 CO 0.00 0.19 -0.63 -1.17 0.00 0.00 0.00 179.25 177.65 2b0s s LEU 166 N -7.57 4.44 -0.04 0.00 2.96 -0.92 -4.89 118.68 112.66 2b0s s LEU 166 Ca -0.03 -1.48 0.06 0.00 -0.22 0.00 0.00 54.13 52.46 2b0s s LEU 166 Cb 0.14 -1.79 -0.08 0.00 0.50 0.00 0.00 46.19 44.95 2b0s s LEU 166 CO 0.62 -0.37 0.07 0.35 -1.32 0.00 0.00 176.35 175.69 2b0s n THR 167 N 4.67 0.24 -1.68 3.68 -2.24 -1.26 -4.30 114.28 113.39 2b0s n THR 167 Ca -0.10 -0.21 -0.47 0.00 -2.27 0.00 0.00 64.05 61.01 2b0s n THR 167 Cb 0.43 -0.38 -0.04 0.00 -2.10 0.00 0.00 70.33 68.23 2b0s n THR 167 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2b0s n SER 168 N -2.02 3.29 -0.21 3.42 7.64 -1.26 -2.81 113.62 121.66 2b0s n SER 168 Ca -0.06 1.02 -0.03 0.00 1.01 0.00 0.00 58.87 60.81 2b0s n SER 168 Cb 0.49 -1.40 -0.01 0.00 -1.01 0.00 0.00 64.21 62.28 2b0s n SER 168 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b0s n GLY 169 N 3.96 0.59 3.75 0.23 0.00 -1.26 -4.72 105.19 107.73 2b0s n GLY 169 Ca 0.20 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 2b0s n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b0s s VAL 171 N -1.97 4.67 -0.23 1.61 1.01 -1.12 -1.73 120.40 122.64 2b0s s VAL 171 Ca 0.00 1.64 -0.04 0.00 0.00 0.00 0.00 61.98 63.59 2b0s s VAL 171 Cb 0.00 -4.12 0.08 0.00 0.00 0.00 0.00 36.38 32.34 2b0s s VAL 171 CO 0.00 0.39 0.09 -2.28 0.00 0.00 0.00 175.10 173.30 2b0s s HIS 172 N -0.26 0.66 -0.23 5.22 2.46 0.33 -5.00 115.29 118.47 2b0s s HIS 172 Ca 0.38 -0.80 -0.13 0.00 0.47 0.00 0.00 55.06 54.98 2b0s s HIS 172 Cb -0.21 -0.97 -0.04 0.00 -0.13 0.00 0.00 32.58 31.23 2b0s s HIS 172 CO 0.24 -0.67 0.29 0.99 -2.47 0.00 0.00 174.74 173.12 2b0s s THR 173 N 1.98 5.26 0.30 0.89 2.01 -1.26 -1.04 115.64 123.78 2b0s s THR 173 Ca 0.04 0.45 -0.17 0.00 0.31 0.00 0.00 61.69 62.33 2b0s s THR 173 Cb -0.16 -3.62 -0.09 0.00 0.01 0.00 0.00 72.50 68.63 2b0s s THR 173 CO -0.18 0.27 0.74 -0.36 -0.69 0.00 0.00 174.62 174.40 2b0s s PHE 174 N 1.34 3.45 0.56 4.92 0.40 0.12 -4.97 117.98 123.80 2b0s s PHE 174 Ca 0.13 1.28 -0.20 0.00 -0.60 0.00 0.00 56.93 57.54 2b0s s PHE 174 Cb -0.14 -2.57 -0.06 0.00 0.51 0.00 0.00 43.02 40.76 2b0s s PHE 174 CO 0.07 0.16 1.07 -2.30 0.70 0.00 0.00 175.22 174.92 2b0s n PRO 175 N -0.05 1.17 -2.04 0.24 -0.02 -1.26 -4.45 135.00 128.58 2b0s n PRO 175 Ca 0.02 0.44 -0.32 0.00 -2.02 0.00 0.00 63.50 61.61 2b0s n PRO 175 Cb 0.53 -2.25 0.01 0.00 -0.02 0.00 0.00 33.50 31.76 2b0s n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b0s s ALA 176 N -1.42 2.77 -0.09 3.55 0.00 -1.26 -4.78 121.76 120.53 2b0s s ALA 176 Ca 0.73 0.34 -0.12 0.00 0.00 0.00 0.00 51.96 52.91 2b0s s ALA 176 Cb -0.44 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.42 2b0s s ALA 176 CO 0.49 -0.78 0.28 0.54 0.00 0.00 0.00 175.76 176.29 2b0s s VAL 177 N -2.52 5.28 -0.37 0.00 0.11 0.99 -4.93 120.40 118.95 2b0s s VAL 177 Ca 0.63 0.54 -0.17 0.00 -2.93 0.00 0.00 61.98 60.04 2b0s s VAL 177 Cb -0.15 -3.58 0.00 0.00 -1.53 0.00 0.00 36.38 31.12 2b0s s VAL 177 CO 0.38 0.53 0.47 -0.22 -3.33 0.00 0.00 175.10 172.93 2b0s s LEU 178 N -0.55 4.48 0.63 2.54 2.96 -1.26 -1.54 118.68 125.94 2b0s s LEU 178 Ca 0.18 -0.23 -0.09 0.00 -0.22 0.00 0.00 54.13 53.77 2b0s s LEU 178 Cb -0.14 -2.50 -0.00 0.00 0.50 0.00 0.00 46.19 44.05 2b0s s LEU 178 CO 0.07 -0.49 1.00 -1.10 -1.32 0.00 0.00 176.35 174.51 2b0s s GLN 179 N 2.29 3.10 0.61 1.98 -0.21 0.14 -4.94 119.66 122.63 2b0s s GLN 179 Ca 0.16 0.37 0.33 0.00 0.02 0.00 0.00 55.36 56.23 2b0s s GLN 179 Cb -0.16 -2.14 1.90 0.00 1.00 0.00 0.00 33.01 33.61 2b0s s GLN 179 CO 0.13 -0.76 2.22 0.66 -2.12 0.00 0.00 175.29 175.42 2b0s h SER 180 N -0.36 0.00 0.50 5.90 4.64 -1.98 0.12 113.55 122.38 2b0s h SER 180 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2b0s h SER 180 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2b0s h SER 180 CO 0.62 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.04 2b0s n SER 182 N -3.60 0.00 0.00 4.97 3.41 -1.26 -4.86 113.62 112.28 2b0s n SER 182 Ca -0.02 0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 2b0s n SER 182 Cb 0.17 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2b0s n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b0s n GLY 183 N 0.27 1.19 3.94 5.00 0.00 0.03 -4.72 105.19 110.90 2b0s n GLY 183 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2b0s n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b0s s LEU 184 N 0.00 4.02 0.12 0.99 1.43 -1.26 -4.74 118.68 119.25 2b0s s LEU 184 Ca 0.00 0.48 0.05 0.00 -1.03 0.00 0.00 54.13 53.63 2b0s s LEU 184 Cb 0.00 -3.34 -0.04 0.00 0.03 0.00 0.00 46.19 42.84 2b0s s LEU 184 CO 0.00 -0.27 0.05 -0.31 0.23 0.00 0.00 176.35 176.04 2b0s s TYR 185 N -2.27 3.04 0.01 0.29 1.51 0.74 -0.68 117.35 119.99 2b0s s TYR 185 Ca 0.40 -0.02 0.01 0.00 -1.01 0.00 0.00 57.07 56.45 2b0s s TYR 185 Cb -0.10 -1.52 -0.01 0.00 -0.11 0.00 0.00 41.96 40.22 2b0s s TYR 185 CO 0.35 0.50 -0.04 -1.12 -1.11 0.00 0.00 175.55 174.14 2b0s s SER 186 N -2.62 0.36 0.21 2.29 0.01 -0.59 -0.70 113.70 112.66 2b0s s SER 186 Ca 0.28 -0.28 -0.01 0.00 1.31 0.00 0.00 55.95 57.25 2b0s s SER 186 Cb -0.11 0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.10 2b0s s SER 186 CO 0.20 -0.12 0.13 -1.48 0.41 0.00 0.00 173.24 172.38 2b0s s LEU 187 N -0.79 1.22 0.02 2.44 0.05 -0.61 -0.01 118.68 120.99 2b0s s LEU 187 Ca -0.07 -1.40 0.04 0.00 0.05 0.00 0.00 54.13 52.76 2b0s s LEU 187 Cb -0.05 0.34 -0.02 0.00 -2.05 0.00 0.00 46.19 44.41 2b0s s LEU 187 CO -0.00 -0.83 -0.12 -0.44 -0.55 0.00 0.00 176.35 174.41 2b0s s SER 188 N -3.18 1.37 -0.07 1.48 0.01 -1.26 -0.69 113.70 111.35 2b0s s SER 188 Ca 0.39 -0.34 0.04 0.00 1.31 0.00 0.00 55.95 57.35 2b0s s SER 188 Cb 0.07 -0.11 -0.02 0.00 0.21 0.00 0.00 66.02 66.18 2b0s s SER 188 CO 0.12 0.05 -0.18 -0.55 0.41 0.00 0.00 173.24 173.10 2b0s s SER 189 N -0.76 3.65 0.04 2.44 0.15 -0.70 0.12 113.70 118.63 2b0s s SER 189 Ca 0.02 -0.35 0.05 0.00 0.70 0.00 0.00 55.95 56.36 2b0s s SER 189 Cb -0.06 -1.04 -0.02 0.00 -1.71 0.00 0.00 66.02 63.18 2b0s s SER 189 CO 0.00 0.26 -0.13 0.54 1.20 0.00 0.00 173.24 175.11 2b0s s VAL 190 N -0.22 1.04 -0.01 4.45 0.11 -0.20 -0.78 120.40 124.79 2b0s s VAL 190 Ca -0.00 -0.97 0.06 0.00 -2.93 0.00 0.00 61.98 58.14 2b0s s VAL 190 Cb -0.13 -0.95 -0.02 0.00 -1.53 0.00 0.00 36.38 33.75 2b0s s VAL 190 CO 0.03 -0.01 -0.20 0.54 -3.33 0.00 0.00 175.10 172.13 2b0s s VAL 191 N -0.85 1.58 -0.19 2.04 0.11 0.11 -0.51 120.40 122.69 2b0s s VAL 191 Ca 0.01 -0.90 -0.06 0.00 -2.93 0.00 0.00 61.98 58.10 2b0s s VAL 191 Cb -0.08 -1.32 -0.03 0.00 -1.53 0.00 0.00 36.38 33.42 2b0s s VAL 191 CO 0.01 0.41 0.02 -0.89 -3.33 0.00 0.00 175.10 171.31 2b0s s THR 192 N -0.52 4.21 0.18 5.04 2.01 -0.70 -1.45 115.64 124.41 2b0s s THR 192 Ca 0.08 -0.23 0.02 0.00 0.31 0.00 0.00 61.69 61.87 2b0s s THR 192 Cb -0.08 -2.90 -0.05 0.00 0.01 0.00 0.00 72.50 69.49 2b0s s THR 192 CO -0.00 0.44 -0.01 0.68 -0.69 0.00 0.00 174.62 175.03 2b0s s VAL 193 N 0.76 0.81 0.26 3.82 -7.23 -0.38 -4.67 120.40 113.77 2b0s s VAL 193 Ca 0.01 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.89 2b0s s VAL 193 Cb -0.14 -2.12 -0.10 0.00 0.56 0.00 0.00 36.38 34.58 2b0s s VAL 193 CO 0.02 -0.49 1.37 -2.84 -0.31 0.00 0.00 175.10 172.85 2b0s s PRO 194 N -3.88 4.32 0.39 4.82 0.02 -1.26 -0.46 135.00 138.96 2b0s s PRO 194 Ca 0.24 2.22 0.09 0.00 0.02 0.00 0.00 61.00 63.56 2b0s s PRO 194 Cb 0.06 -3.12 0.86 0.00 0.02 0.00 0.00 34.50 32.31 2b0s s PRO 194 CO 0.04 -0.31 1.98 0.77 -0.33 0.00 0.00 177.00 179.15 2b0s h SER 195 N 4.64 0.53 0.07 2.53 0.02 -1.50 -1.51 113.55 118.33 2b0s h SER 195 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2b0s h SER 195 Cb 1.22 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2b0s h SER 195 CO 0.74 0.34 0.00 -1.54 -1.14 0.00 0.00 176.83 175.23 2b0s n SER 196 N -4.48 0.43 0.00 3.07 3.41 -1.26 -1.72 113.62 113.08 2b0s n SER 196 Ca 0.09 0.69 0.12 0.00 -0.26 0.00 0.00 58.87 59.51 2b0s n SER 196 Cb 0.25 -0.75 0.22 0.00 -0.26 0.00 0.00 64.21 63.67 2b0s n SER 196 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2b0s n SER 197 N -2.07 0.54 -0.33 4.04 3.41 -0.57 -4.47 113.62 114.17 2b0s n SER 197 Ca -0.01 -0.27 -0.02 0.00 -0.26 0.00 0.00 58.87 58.31 2b0s n SER 197 Cb 0.04 0.30 0.13 0.00 -0.26 0.00 0.00 64.21 64.42 2b0s n SER 197 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2b0s h LEU 198 N 0.00 1.08 -0.28 1.04 4.07 -1.46 0.24 115.31 120.00 2b0s h LEU 198 Ca 0.00 -0.06 -0.14 0.00 0.08 0.00 0.00 57.88 57.77 2b0s h LEU 198 Cb 0.52 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 41.96 2b0s h LEU 198 CO 0.00 0.82 -0.65 1.23 -1.08 0.00 0.00 178.44 178.76 2b0s h GLY 199 N 1.26 0.00 0.09 0.83 0.00 -1.80 -3.39 103.07 100.06 2b0s h GLY 199 Ca 0.33 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.28 2b0s h GLY 199 CO -0.06 0.00 -2.39 2.41 0.00 0.00 0.00 176.54 176.49 2b0s n THR 200 N -3.39 1.51 -3.93 4.70 -1.04 -0.87 -4.97 114.28 106.28 2b0s n THR 200 Ca 0.01 -0.63 -0.36 0.00 -2.04 0.00 0.00 64.05 61.02 2b0s n THR 200 Cb 0.74 -1.29 -0.07 0.00 -1.82 0.00 0.00 70.33 67.89 2b0s n THR 200 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2b0s s GLN 203 N -2.52 3.56 -0.16 -2.82 2.00 0.77 -5.08 119.66 115.41 2b0s s GLN 203 Ca -0.29 -0.20 -0.14 0.00 -2.00 0.00 0.00 55.36 52.72 2b0s s GLN 203 Cb 0.08 -3.18 -0.05 0.00 0.80 0.00 0.00 33.01 30.67 2b0s s GLN 203 CO 0.66 0.64 0.31 0.99 -0.50 0.00 0.00 175.29 177.39 2b0s s THR 205 N -0.64 5.29 -0.17 -0.34 2.01 -1.26 -4.74 115.64 115.80 2b0s s THR 205 Ca 0.12 0.59 -0.01 0.00 0.31 0.00 0.00 61.69 62.70 2b0s s THR 205 Cb -0.12 -3.65 -0.01 0.00 0.01 0.00 0.00 72.50 68.73 2b0s s THR 205 CO 0.02 0.38 -0.11 -0.31 -0.69 0.00 0.00 174.62 173.92 2b0s s TYR 206 N 0.51 2.86 -0.05 4.92 2.02 -1.26 -4.95 117.35 121.39 2b0s s TYR 206 Ca 0.17 -0.88 0.00 0.00 -0.37 0.00 0.00 57.07 56.00 2b0s s TYR 206 Cb -0.13 -1.95 0.02 0.00 -0.40 0.00 0.00 41.96 39.50 2b0s s TYR 206 CO 0.04 -0.41 -0.03 0.42 -1.57 0.00 0.00 175.55 174.00 2b0s s ILE 207 N 0.90 0.52 -0.08 2.71 1.01 -1.26 -0.97 121.20 124.03 2b0s s ILE 207 Ca -0.03 -0.07 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 2b0s s ILE 207 Cb -0.15 -0.58 -0.05 0.00 0.01 0.00 0.00 42.46 41.70 2b0s s ILE 207 CO -0.00 0.24 0.26 0.00 0.00 0.00 0.00 174.94 175.44 2b0s s ASN 209 N -0.89 4.52 -0.12 0.00 -0.87 0.63 -1.27 114.94 116.93 2b0s s ASN 209 Ca 0.19 -1.10 -0.02 0.00 -1.57 0.00 0.00 52.86 50.36 2b0s s ASN 209 Cb -0.14 -1.66 -0.03 0.00 -0.02 0.00 0.00 41.25 39.40 2b0s s ASN 209 CO 0.08 -0.18 -0.06 -0.69 -2.57 0.00 0.00 177.10 173.68 2b0s s VAL 210 N 1.26 3.75 -0.12 1.60 1.01 0.66 -0.54 120.40 128.03 2b0s s VAL 210 Ca -0.03 -0.42 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 2b0s s VAL 210 Cb -0.18 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.62 2b0s s VAL 210 CO -0.03 0.53 -0.09 0.21 0.00 0.00 0.00 175.10 175.72 2b0s s ASN 211 N -0.02 2.23 -0.47 3.32 3.84 -0.05 -0.87 114.94 122.92 2b0s s ASN 211 Ca 0.00 -0.33 -0.00 0.00 0.21 0.00 0.00 52.86 52.74 2b0s s ASN 211 Cb -0.13 -0.89 0.12 0.00 -0.55 0.00 0.00 41.25 39.80 2b0s s ASN 211 CO 0.03 -0.10 0.24 -2.28 -2.79 0.00 0.00 177.10 172.20 2b0s s HIS 212 N 1.59 3.52 0.16 0.43 5.65 0.72 -1.28 115.29 126.08 2b0s s HIS 212 Ca 0.03 -2.72 -0.11 0.00 0.25 0.00 0.00 55.06 52.51 2b0s s HIS 212 Cb -0.13 -3.10 0.04 0.00 -1.18 0.00 0.00 32.58 28.21 2b0s s HIS 212 CO -0.08 -0.90 1.62 0.87 -0.65 0.00 0.00 174.74 175.60 2b0s h LYS 213 N 7.47 0.95 -1.12 2.88 1.57 -1.80 -0.40 116.57 126.12 2b0s h LYS 213 Ca -0.08 -0.30 0.31 0.00 -1.87 0.00 0.00 60.65 58.72 2b0s h LYS 213 Cb 0.99 -0.09 -0.10 0.00 0.08 0.00 0.00 32.23 33.12 2b0s h LYS 213 CO 0.67 0.96 0.72 -1.35 -0.57 0.00 0.00 179.45 179.88 2b0s h PRO 214 N 0.83 0.28 -0.21 3.15 0.11 -1.92 -0.17 132.00 134.06 2b0s h PRO 214 Ca 0.15 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2b0s h PRO 214 Cb 0.52 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.57 2b0s h PRO 214 CO 0.03 0.19 0.00 -1.13 -0.21 0.00 0.00 178.00 176.87 2b0s n SER 215 N -4.62 3.04 -4.07 -2.05 3.41 -1.14 -4.99 113.62 103.21 2b0s n SER 215 Ca 0.28 -1.91 -0.30 0.00 -0.26 0.00 0.00 58.87 56.68 2b0s n SER 215 Cb 1.04 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 64.84 2b0s n SER 215 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2b0s n ASN 216 N 1.25 -1.87 -4.48 4.04 4.05 -0.08 -4.89 115.26 113.28 2b0s n ASN 216 Ca 0.15 -1.00 -0.36 0.00 0.45 0.00 0.00 54.58 53.82 2b0s n ASN 216 Cb 0.54 -2.97 -0.12 0.00 1.23 0.00 0.00 39.78 38.46 2b0s n ASN 216 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 2b0s s THR 217 N -3.64 4.49 -0.13 -0.44 2.01 -0.21 -5.01 115.64 112.72 2b0s s THR 217 Ca 0.36 -0.11 -0.00 0.00 0.31 0.00 0.00 61.69 62.24 2b0s s THR 217 Cb -0.19 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.24 2b0s s THR 217 CO 0.90 0.34 -0.10 -0.54 -0.69 0.00 0.00 174.62 174.53 2b0s s LYS 218 N 1.52 1.77 -0.06 4.92 1.02 -1.26 -0.20 119.74 127.45 2b0s s LYS 218 Ca 0.06 -0.37 0.02 0.00 0.02 0.00 0.00 55.97 55.70 2b0s s LYS 218 Cb -0.15 -1.78 0.02 0.00 -0.52 0.00 0.00 37.83 35.39 2b0s s LYS 218 CO 0.05 -0.27 -0.10 0.08 -0.92 0.00 0.00 175.35 174.19 2b0s s VAL 219 N 1.63 0.97 -0.23 3.17 1.01 -0.05 -4.99 120.40 121.90 2b0s s VAL 219 Ca 0.05 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 2b0s s VAL 219 Cb -0.13 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 2b0s s VAL 219 CO -0.09 0.32 0.04 -1.81 0.00 0.00 0.00 175.10 173.56 2b0s s ASP 220 N 0.78 4.95 -0.19 3.32 1.01 -1.26 -0.25 116.67 125.03 2b0s s ASP 220 Ca -0.13 -0.23 0.01 0.00 0.71 0.00 0.00 52.55 52.91 2b0s s ASP 220 Cb -0.15 -1.87 0.03 0.00 1.01 0.00 0.00 42.92 41.93 2b0s s ASP 220 CO 0.02 -0.01 -0.17 -0.75 0.21 0.00 0.00 175.17 174.47 2b0s s LYS 221 N 1.44 2.71 0.10 8.23 2.47 -0.40 -4.97 119.74 129.32 2b0s s LYS 221 Ca 0.05 -0.86 -0.30 0.00 -1.56 0.00 0.00 55.97 53.30 2b0s s LYS 221 Cb -0.15 -2.53 -0.07 0.00 -1.46 0.00 0.00 37.83 33.63 2b0s s LYS 221 CO 0.02 -0.28 1.22 0.21 0.16 0.00 0.00 175.35 176.68 2b0s s LYS 222 N 1.30 4.44 -0.60 4.03 2.20 -1.26 -1.10 119.74 128.75 2b0s s LYS 222 Ca 0.03 1.83 -0.04 0.00 -0.36 0.00 0.00 55.97 57.42 2b0s s LYS 222 Cb -0.14 -3.31 0.16 0.00 -1.51 0.00 0.00 37.83 33.03 2b0s s LYS 222 CO -0.11 -0.22 0.43 0.08 -0.36 0.00 0.00 175.35 175.16 2b0s s VAL 225 N 0.75 3.84 0.58 4.02 1.01 -0.14 -4.83 120.40 125.62 2b0s s VAL 225 Ca 0.58 -2.73 -0.11 0.00 0.00 0.00 0.00 61.98 59.72 2b0s s VAL 225 Cb -0.31 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2b0s s VAL 225 CO 0.31 -0.86 0.98 -1.61 0.00 0.00 0.00 175.10 173.92 2b0s s GLU 226 N 0.20 3.63 0.67 2.72 2.02 -1.26 -4.53 118.70 122.16 2b0s s GLU 226 Ca 0.15 0.67 -0.16 0.00 0.02 0.00 0.00 54.97 55.66 2b0s s GLU 226 Cb -0.20 -2.14 0.01 0.00 0.10 0.00 0.00 34.13 31.90 2b0s s GLU 226 CO -0.04 -0.47 1.17 -2.14 0.02 0.00 0.00 175.26 173.80 2b0s s PRO 227 N -4.96 2.56 0.81 0.39 0.02 -1.26 -4.44 135.00 128.12 2b0s s PRO 227 Ca 0.54 1.63 -0.13 0.00 0.02 0.00 0.00 61.00 63.06 2b0s s PRO 227 Cb -0.11 -1.90 0.09 0.00 0.02 0.00 0.00 34.50 32.60 2b0s s PRO 227 CO 0.50 -1.48 1.21 0.15 -0.33 0.00 0.00 177.00 177.04 2b0s s LYS 228 N -3.85 1.58 0.00 5.54 1.02 -1.26 -4.99 119.74 117.78 2b0s s LYS 228 Ca 0.72 1.76 0.00 0.00 0.02 0.00 0.00 55.97 58.47 2b0s s LYS 228 Cb -0.26 -1.77 0.00 0.00 -0.52 0.00 0.00 37.83 35.28 2b0s s LYS 228 CO 0.41 -2.26 0.00 0.45 -0.92 0.00 0.00 175.35 173.03