#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m1k s ARG 2 N 0.00 3.52 0.52 1.61 0.52 -0.57 -5.04 118.95 119.51 1m1k s ARG 2 Ca 0.00 -0.28 -0.21 0.00 -0.52 0.00 0.00 55.73 54.72 1m1k s ARG 2 Cb 0.00 -2.70 -0.08 0.00 0.52 0.00 0.00 34.95 32.69 1m1k s ARG 2 CO 0.00 0.22 0.97 0.54 0.02 0.00 0.00 175.30 177.05 1m1k n ARG 3 N -1.38 1.12 -2.69 3.54 5.12 -1.26 -4.75 116.66 116.36 1m1k n ARG 3 Ca -0.04 0.42 -0.24 0.00 -1.93 0.00 0.00 57.85 56.05 1m1k n ARG 3 Cb 0.55 -2.10 0.02 0.00 -1.16 0.00 0.00 32.46 29.78 1m1k n ARG 3 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 1m1k s ILE 4 N -1.42 3.67 0.31 0.55 -4.36 -1.26 -4.93 121.20 113.76 1m1k s ILE 4 Ca 0.69 -0.31 0.07 0.00 -0.26 0.00 0.00 60.65 60.85 1m1k s ILE 4 Cb -0.48 -3.40 0.30 0.00 1.25 0.00 0.00 42.46 40.13 1m1k s ILE 4 CO 0.52 -0.34 1.74 -0.61 0.24 0.00 0.00 174.94 176.49 1m1k h GLN 5 N 0.11 0.59 0.00 0.37 4.15 -1.93 0.16 115.11 118.55 1m1k h GLN 5 Ca -0.45 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.93 1m1k h GLN 5 Cb 1.26 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.82 1m1k h GLN 5 CO 0.58 0.39 0.00 0.41 -1.93 0.00 0.00 178.83 178.28 1m1k n GLY 6 N -1.32 -0.97 0.09 2.39 0.00 -1.26 -1.55 105.19 102.57 1m1k n GLY 6 Ca 0.25 0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.52 1m1k n GLY 6 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1m1k n GLN 7 N -2.21 0.62 0.09 1.61 6.02 0.54 -3.74 117.38 120.31 1m1k n GLN 7 Ca -0.00 0.05 -0.12 0.00 -0.01 0.00 0.00 57.00 56.92 1m1k n GLN 7 Cb 0.09 -1.74 -0.09 0.00 1.02 0.00 0.00 30.24 29.52 1m1k n GLN 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1m1k h ARG 8 N 0.00 0.22 -0.02 -1.09 -0.00 -1.21 -3.33 114.38 108.96 1m1k h ARG 8 Ca -0.04 -0.32 0.03 0.00 -0.50 0.00 0.00 59.98 59.16 1m1k h ARG 8 Cb 1.11 0.11 -0.05 0.00 0.00 0.00 0.00 29.97 31.14 1m1k h ARG 8 CO 0.01 1.10 -0.29 0.00 0.00 0.00 0.00 179.97 180.79 1m1k h ARG 9 N 0.09 -0.41 -0.37 0.04 3.08 -1.52 -2.75 114.38 112.54 1m1k h ARG 9 Ca -0.08 0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.10 1m1k h ARG 9 Cb 1.77 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.90 1m1k h ARG 9 CO 0.17 -0.27 0.44 0.78 -1.07 0.00 0.00 179.97 180.01 1m1k h GLY 10 N -0.42 0.00 2.00 0.04 0.00 -1.67 -1.58 103.07 101.44 1m1k h GLY 10 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 1m1k h GLY 10 CO -0.26 0.00 -0.01 3.21 0.00 0.00 0.00 176.54 179.48 1m1k h ARG 11 N 0.00 0.00 -2.98 4.80 3.08 -1.66 -3.46 114.38 114.16 1m1k h ARG 11 Ca 0.18 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.03 1m1k h ARG 11 Cb 1.05 0.00 0.05 0.00 0.08 0.00 0.00 29.97 31.15 1m1k h ARG 11 CO -0.00 0.01 -0.32 0.41 -1.07 0.00 0.00 179.97 179.00 1m1k n GLY 12 N -0.79 0.16 3.91 0.04 0.00 -0.59 -5.03 105.19 102.88 1m1k n GLY 12 Ca -0.02 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 1m1k n GLY 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m1k s THR 13 N -3.02 2.07 0.17 2.61 -4.23 -1.26 -4.74 115.64 107.23 1m1k s THR 13 Ca 0.23 -0.07 -0.29 0.00 -1.18 0.00 0.00 61.69 60.38 1m1k s THR 13 Cb -0.10 -3.00 -0.01 0.00 1.34 0.00 0.00 72.50 70.73 1m1k s THR 13 CO 0.28 0.00 1.55 -1.28 -0.54 0.00 0.00 174.62 174.63 1m1k h SER 14 N -0.97 -1.92 -0.92 3.99 0.87 -1.96 0.56 113.55 113.21 1m1k h SER 14 Ca -0.45 0.30 0.27 0.00 -1.23 0.00 0.00 61.79 60.67 1m1k h SER 14 Cb 1.32 0.86 -0.04 0.00 -0.44 0.00 0.00 62.40 64.11 1m1k h SER 14 CO 0.63 -0.28 0.67 0.74 -0.53 0.00 0.00 176.83 178.06 1m1k h THR 15 N -0.09 0.53 0.00 2.23 2.02 -1.99 -1.45 112.91 114.15 1m1k h THR 15 Ca 0.18 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.36 1m1k h THR 15 Cb 0.49 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1m1k h THR 15 CO -0.86 0.00 -1.55 0.49 0.37 0.00 0.00 175.52 173.97 1m1k n PHE 16 N -4.24 0.14 -1.24 3.16 3.01 0.10 -4.36 117.46 114.04 1m1k n PHE 16 Ca 0.19 0.04 -0.31 0.00 1.01 0.00 0.00 57.45 58.38 1m1k n PHE 16 Cb 0.99 -0.44 0.10 0.00 -0.01 0.00 0.00 39.48 40.12 1m1k n PHE 16 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1m1k s ARG 17 N -3.35 2.14 -0.03 -1.08 0.52 -0.55 -3.81 118.95 112.79 1m1k s ARG 17 Ca -0.02 1.15 -0.15 0.00 -0.52 0.00 0.00 55.73 56.19 1m1k s ARG 17 Cb 0.14 -1.88 -0.05 0.00 0.52 0.00 0.00 34.95 33.67 1m1k s ARG 17 CO 0.87 -1.72 0.40 0.00 0.02 0.00 0.00 175.30 174.88 1m1k s ALA 18 N -2.90 3.66 -0.25 2.13 0.00 -1.26 -4.32 121.76 118.83 1m1k s ALA 18 Ca 0.61 -0.24 -0.02 0.00 0.00 0.00 0.00 51.96 52.32 1m1k s ALA 18 Cb -0.17 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.51 1m1k s ALA 18 CO 0.56 0.38 1.30 -0.35 0.00 0.00 0.00 175.76 177.65 1m1k n PRO 19 N 2.24 0.56 -0.26 0.00 -0.04 -1.26 -4.63 135.00 131.62 1m1k n PRO 19 Ca -0.13 -0.76 0.02 0.00 -0.04 0.00 0.00 63.50 62.59 1m1k n PRO 19 Cb 0.52 -2.13 0.10 0.00 -0.04 0.00 0.00 33.50 31.95 1m1k n PRO 19 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1m1k h SER 20 N 7.56 -0.64 0.00 3.54 0.02 -1.97 0.16 113.55 122.22 1m1k h SER 20 Ca 0.13 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 1m1k h SER 20 Cb 0.05 0.44 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1m1k h SER 20 CO 1.13 -0.24 0.24 1.12 -1.14 0.00 0.00 176.83 177.94 1m1k h HIS 21 N 0.01 0.00 -0.01 3.45 2.07 -2.04 0.80 115.15 119.43 1m1k h HIS 21 Ca 0.36 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.88 1m1k h HIS 21 Cb 0.57 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.55 1m1k h HIS 21 CO -0.56 0.00 -0.55 -2.13 -3.07 0.00 0.00 177.93 171.61 1m1k n ARG 22 N -2.28 0.92 -2.17 5.12 0.63 0.54 -4.96 116.66 114.47 1m1k n ARG 22 Ca -0.01 -0.74 -0.32 0.00 -0.92 0.00 0.00 57.85 55.86 1m1k n ARG 22 Cb 0.27 -1.48 -0.01 0.00 0.45 0.00 0.00 32.46 31.68 1m1k n ARG 22 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1m1k s TYR 23 N -2.59 3.35 -0.07 -0.14 4.12 0.28 -4.92 117.35 117.38 1m1k s TYR 23 Ca 0.17 1.45 -0.04 0.00 0.02 0.00 0.00 57.07 58.66 1m1k s TYR 23 Cb 0.18 -2.84 -0.01 0.00 -1.52 0.00 0.00 41.96 37.77 1m1k s TYR 23 CO 0.63 -0.66 -0.09 1.63 0.02 0.00 0.00 175.55 177.08 1m1k n LYS 24 N -1.99 0.22 -3.97 -0.62 5.02 -1.26 -5.06 118.16 110.49 1m1k n LYS 24 Ca 0.07 0.39 -0.09 0.00 -2.02 0.00 0.00 58.31 56.66 1m1k n LYS 24 Cb 0.54 -1.21 -0.10 0.00 -0.02 0.00 0.00 35.03 34.23 1m1k n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1m1k s ALA 25 N -2.87 0.08 -0.85 7.82 0.00 -1.26 -5.09 121.76 119.59 1m1k s ALA 25 Ca -0.07 -0.61 -0.17 0.00 0.00 0.00 0.00 51.96 51.11 1m1k s ALA 25 Cb 0.01 0.18 0.16 0.00 0.00 0.00 0.00 23.12 23.48 1m1k s ALA 25 CO 0.11 -0.23 0.93 0.34 0.00 0.00 0.00 175.76 176.91 1m1k s ASP 26 N -1.81 6.63 -0.27 0.00 -1.08 -1.26 -4.99 116.67 113.89 1m1k s ASP 26 Ca -0.10 -2.24 -0.32 0.00 -0.52 0.00 0.00 52.55 49.37 1m1k s ASP 26 Cb -0.05 -2.31 -0.08 0.00 -1.46 0.00 0.00 42.92 39.01 1m1k s ASP 26 CO -0.03 -0.87 2.19 0.18 0.52 0.00 0.00 175.17 177.16 1m1k n LEU 27 N 5.48 2.73 -3.82 -1.34 4.77 -1.26 -4.95 117.00 118.61 1m1k n LEU 27 Ca 0.16 0.35 -0.12 0.00 -0.03 0.00 0.00 56.01 56.37 1m1k n LEU 27 Cb 0.47 -1.40 -0.11 0.00 -2.33 0.00 0.00 43.42 40.05 1m1k n LEU 27 CO 0.44 -0.67 -0.15 -1.61 -1.33 0.00 0.00 177.39 174.07 1m1k s GLU 28 N 6.15 0.32 0.57 3.23 2.02 -1.26 -4.92 118.70 124.80 1m1k s GLU 28 Ca 1.05 0.04 -0.21 0.00 0.02 0.00 0.00 54.97 55.87 1m1k s GLU 28 Cb -0.61 0.14 -0.04 0.00 0.10 0.00 0.00 34.13 33.73 1m1k s GLU 28 CO 0.43 -0.06 1.31 -1.01 0.02 0.00 0.00 175.26 175.95 1m1k s HIS 29 N -0.41 2.30 0.64 1.61 3.76 -0.92 -4.97 115.29 117.30 1m1k s HIS 29 Ca -0.05 1.43 -0.15 0.00 -0.15 0.00 0.00 55.06 56.13 1m1k s HIS 29 Cb -0.03 -3.71 -0.01 0.00 1.11 0.00 0.00 32.58 29.94 1m1k s HIS 29 CO 0.01 -2.72 1.10 1.03 -0.85 0.00 0.00 174.74 173.31 1m1k s ARG 30 N -3.03 2.93 -0.19 1.40 0.52 -1.26 -4.76 118.95 114.56 1m1k s ARG 30 Ca 0.74 1.36 -0.13 0.00 -0.52 0.00 0.00 55.73 57.17 1m1k s ARG 30 Cb -0.38 -1.97 -0.05 0.00 0.52 0.00 0.00 34.95 33.08 1m1k s ARG 30 CO 0.43 -1.14 0.28 0.15 0.02 0.00 0.00 175.30 175.04 1m1k s LYS 31 N -4.07 4.19 -0.10 3.54 1.02 -1.26 -5.06 119.74 117.99 1m1k s LYS 31 Ca 0.66 0.01 0.02 0.00 0.02 0.00 0.00 55.97 56.69 1m1k s LYS 31 Cb -0.20 -3.48 -0.01 0.00 -0.52 0.00 0.00 37.83 33.62 1m1k s LYS 31 CO 0.40 0.12 -0.17 0.08 -0.92 0.00 0.00 175.35 174.86 1m1k s VAL 32 N 0.84 2.72 0.14 3.17 1.01 -1.26 -5.01 120.40 122.00 1m1k s VAL 32 Ca 0.14 -0.80 -0.22 0.00 0.00 0.00 0.00 61.98 61.10 1m1k s VAL 32 Cb -0.13 -2.10 0.01 0.00 0.00 0.00 0.00 36.38 34.16 1m1k s VAL 32 CO 0.05 0.55 1.65 -0.33 0.00 0.00 0.00 175.10 177.01 1m1k h GLU 33 N 6.45 -0.21 0.00 2.72 3.07 -1.99 -3.48 114.58 121.13 1m1k h GLU 33 Ca -0.28 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 1m1k h GLU 33 Cb 1.21 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 1m1k h GLU 33 CO 0.52 -0.14 0.00 -3.47 -1.40 0.00 0.00 179.01 174.52 1m1k n ASP 34 N -5.34 0.00 0.00 1.42 -0.08 -1.26 -5.04 116.55 106.24 1m1k n ASP 34 Ca -0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 1m1k n ASP 34 Cb 0.26 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.72 1m1k n ASP 34 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1m1k n GLY 35 N -0.88 2.49 2.65 0.27 0.00 -1.26 -4.49 105.19 103.97 1m1k n GLY 35 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1m1k n GLY 35 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1m1k n ASP 36 N 1.16 0.00 -0.23 1.61 2.03 -1.26 -4.48 116.55 115.38 1m1k n ASP 36 Ca 0.00 0.00 0.23 0.00 0.52 0.00 0.00 54.79 55.54 1m1k n ASP 36 Cb 0.00 0.00 0.35 0.00 -0.72 0.00 0.00 41.12 40.75 1m1k n ASP 36 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1m1k n VAL 37 N -1.94 0.00 -1.63 5.18 0.24 -1.26 -4.34 118.33 114.58 1m1k n VAL 37 Ca 0.00 0.86 -0.44 0.00 -2.04 0.00 0.00 64.34 62.72 1m1k n VAL 37 Cb 0.00 -1.51 -0.04 0.00 -1.47 0.00 0.00 33.84 30.82 1m1k n VAL 37 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1m1k n ILE 38 N -2.75 0.56 -4.20 1.34 2.08 -1.26 -4.96 119.36 110.17 1m1k n ILE 38 Ca 0.19 -0.25 -0.12 0.00 0.56 0.00 0.00 62.75 63.13 1m1k n ILE 38 Cb 1.09 -2.29 -0.10 0.00 -0.75 0.00 0.00 39.64 37.60 1m1k n ILE 38 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1m1k s ALA 39 N 5.92 1.12 0.34 -1.39 0.00 -1.26 -1.07 121.76 125.42 1m1k s ALA 39 Ca 0.95 -1.59 -0.18 0.00 0.00 0.00 0.00 51.96 51.14 1m1k s ALA 39 Cb -0.47 0.92 0.04 0.00 0.00 0.00 0.00 23.12 23.61 1m1k s ALA 39 CO 0.42 -0.47 0.76 0.20 0.00 0.00 0.00 175.76 176.68 1m1k s GLY 40 N -3.13 0.16 0.02 0.00 0.00 -0.31 -1.35 107.32 102.72 1m1k s GLY 40 Ca 0.28 -0.55 0.09 0.00 0.00 0.00 0.00 44.72 44.54 1m1k s GLY 40 CO 0.06 -0.19 -0.26 -1.59 0.00 0.00 0.00 173.10 171.12 1m1k s THR 41 N -3.00 2.07 -0.23 0.90 2.01 0.22 -1.67 115.64 115.94 1m1k s THR 41 Ca 0.14 -1.25 -0.29 0.00 0.31 0.00 0.00 61.69 60.59 1m1k s THR 41 Cb -0.05 -1.75 -0.01 0.00 0.01 0.00 0.00 72.50 70.70 1m1k s THR 41 CO 0.09 0.45 1.31 -0.69 -0.69 0.00 0.00 174.62 175.10 1m1k s VAL 42 N -0.71 4.16 -0.13 3.82 1.01 -0.17 -0.79 120.40 127.59 1m1k s VAL 42 Ca 0.11 1.36 0.16 0.00 0.00 0.00 0.00 61.98 63.61 1m1k s VAL 42 Cb -0.10 -4.04 -0.23 0.00 0.00 0.00 0.00 36.38 32.01 1m1k s VAL 42 CO 0.01 -0.30 0.39 0.52 0.00 0.00 0.00 175.10 175.72 1m1k n VAL 43 N 5.83 1.34 -3.56 2.92 0.31 0.65 -0.58 118.33 125.24 1m1k n VAL 43 Ca 0.15 -0.79 -0.07 0.00 -0.01 0.00 0.00 64.34 63.61 1m1k n VAL 43 Cb 0.46 -0.66 -0.03 0.00 -0.91 0.00 0.00 33.84 32.70 1m1k n VAL 43 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1m1k s ASP 44 N -5.66 -0.28 -0.23 4.52 2.15 -1.14 -4.88 116.67 111.16 1m1k s ASP 44 Ca -0.07 0.13 -0.04 0.00 0.43 0.00 0.00 52.55 53.00 1m1k s ASP 44 Cb 0.08 0.27 -0.01 0.00 -0.30 0.00 0.00 42.92 42.95 1m1k s ASP 44 CO 0.83 -0.38 -0.03 -0.63 -0.17 0.00 0.00 175.17 174.79 1m1k s ILE 45 N -2.11 3.43 0.35 4.11 -1.09 -1.26 0.82 121.20 125.43 1m1k s ILE 45 Ca 0.04 -0.51 0.09 0.00 -2.23 0.00 0.00 60.65 58.04 1m1k s ILE 45 Cb -0.01 -2.58 -0.07 0.00 -1.58 0.00 0.00 42.46 38.22 1m1k s ILE 45 CO -0.04 0.39 -0.07 -1.61 -1.23 0.00 0.00 174.94 172.37 1m1k s GLU 46 N 1.48 1.81 -0.05 2.79 2.02 0.22 -4.91 118.70 122.06 1m1k s GLU 46 Ca 0.05 -1.95 -0.24 0.00 0.02 0.00 0.00 54.97 52.86 1m1k s GLU 46 Cb -0.15 -1.63 -0.04 0.00 0.10 0.00 0.00 34.13 32.42 1m1k s GLU 46 CO -0.03 0.10 0.72 -1.58 0.02 0.00 0.00 175.26 174.49 1m1k s HIS 47 N -2.68 3.59 -0.44 1.61 5.65 -1.26 0.14 115.29 121.90 1m1k s HIS 47 Ca 0.33 1.29 -0.16 0.00 0.25 0.00 0.00 55.06 56.77 1m1k s HIS 47 Cb 0.04 -2.82 0.04 0.00 -1.18 0.00 0.00 32.58 28.66 1m1k s HIS 47 CO 0.16 0.10 0.39 0.34 -0.65 0.00 0.00 174.74 175.08 1m1k s ASP 48 N 0.75 6.15 0.54 9.88 2.15 0.27 -4.87 116.67 131.53 1m1k s ASP 48 Ca 0.39 -1.02 0.22 0.00 0.43 0.00 0.00 52.55 52.56 1m1k s ASP 48 Cb -0.18 -2.19 1.39 0.00 -0.30 0.00 0.00 42.92 41.63 1m1k s ASP 48 CO 0.19 -0.59 2.09 -0.65 -0.17 0.00 0.00 175.17 176.04 1m1k h PRO 49 N 8.73 0.00 0.00 4.34 0.11 -1.91 0.21 132.00 143.48 1m1k h PRO 49 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1m1k h PRO 49 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1m1k h PRO 49 CO 0.82 0.00 -0.41 0.00 -0.21 0.00 0.00 178.00 178.20 1m1k h ALA 50 N 1.87 0.75 0.00 -0.75 0.00 -1.93 -3.38 119.26 115.82 1m1k h ALA 50 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1m1k h ALA 50 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1m1k h ALA 50 CO -0.00 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.79 1m1k n ARG 51 N -2.36 0.20 -2.35 0.00 1.74 -0.71 -5.00 116.66 108.17 1m1k n ARG 51 Ca 0.04 -0.54 -0.10 0.00 -0.77 0.00 0.00 57.85 56.48 1m1k n ARG 51 Cb 0.46 -0.78 -0.01 0.00 -1.02 0.00 0.00 32.46 31.12 1m1k n ARG 51 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1m1k n SER 52 N -0.09 -3.20 -4.22 0.55 7.64 0.66 -4.76 113.62 110.19 1m1k n SER 52 Ca 0.00 0.26 -0.13 0.00 1.01 0.00 0.00 58.87 60.01 1m1k n SER 52 Cb 0.20 -2.78 -0.10 0.00 -1.01 0.00 0.00 64.21 60.52 1m1k n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1m1k s ALA 53 N -2.42 1.27 0.79 -0.43 0.00 -1.21 -4.96 121.76 114.80 1m1k s ALA 53 Ca 0.00 -1.52 -0.11 0.00 0.00 0.00 0.00 51.96 50.33 1m1k s ALA 53 Cb 0.00 0.38 0.07 0.00 0.00 0.00 0.00 23.12 23.56 1m1k s ALA 53 CO 0.00 -0.27 1.09 -1.25 0.00 0.00 0.00 175.76 175.33 1m1k s PRO 54 N -3.87 2.13 -0.11 0.00 0.04 -1.26 -0.57 135.00 131.37 1m1k s PRO 54 Ca 0.20 0.84 -0.13 0.00 0.04 0.00 0.00 61.00 61.95 1m1k s PRO 54 Cb 0.05 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.72 1m1k s PRO 54 CO 0.01 -1.64 0.35 0.54 0.04 0.00 0.00 177.00 176.31 1m1k s VAL 55 N -3.04 0.01 -0.11 -0.36 0.11 0.37 -4.33 120.40 113.06 1m1k s VAL 55 Ca 0.61 -0.11 -0.05 0.00 -2.93 0.00 0.00 61.98 59.49 1m1k s VAL 55 Cb -0.16 -0.54 -0.04 0.00 -1.53 0.00 0.00 36.38 34.12 1m1k s VAL 55 CO 0.55 -0.06 0.09 0.00 -3.33 0.00 0.00 175.10 172.36 1m1k s ALA 56 N -0.18 3.68 -0.18 1.54 0.00 -0.70 0.71 121.76 126.62 1m1k s ALA 56 Ca -0.03 -0.70 -0.17 0.00 0.00 0.00 0.00 51.96 51.06 1m1k s ALA 56 Cb -0.03 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 1m1k s ALA 56 CO 0.01 0.60 0.46 0.00 0.00 0.00 0.00 175.76 176.84 1m1k s ALA 57 N -0.95 3.53 0.01 0.00 0.00 0.24 0.20 121.76 124.79 1m1k s ALA 57 Ca 0.14 -0.38 0.05 0.00 0.00 0.00 0.00 51.96 51.77 1m1k s ALA 57 Cb -0.12 -2.69 -0.02 0.00 0.00 0.00 0.00 23.12 20.29 1m1k s ALA 57 CO 0.03 -0.25 -0.17 0.08 0.00 0.00 0.00 175.76 175.46 1m1k s VAL 58 N 1.20 1.32 -0.27 0.00 1.01 -0.50 -0.25 120.40 122.91 1m1k s VAL 58 Ca 0.23 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1m1k s VAL 58 Cb -0.15 -1.13 0.01 0.00 0.00 0.00 0.00 36.38 35.11 1m1k s VAL 58 CO 0.09 0.24 0.01 -1.61 0.00 0.00 0.00 175.10 173.83 1m1k s GLU 59 N -0.73 3.05 0.46 2.72 2.02 0.03 -1.68 118.70 124.57 1m1k s GLU 59 Ca 0.05 -0.86 -0.04 0.00 0.02 0.00 0.00 54.97 54.14 1m1k s GLU 59 Cb -0.07 -3.18 -0.03 0.00 0.10 0.00 0.00 34.13 30.95 1m1k s GLU 59 CO 0.00 -0.39 0.75 -0.06 0.02 0.00 0.00 175.26 175.59 1m1k s PHE 60 N 1.43 3.54 0.19 1.61 0.40 0.13 -0.61 117.98 124.67 1m1k s PHE 60 Ca 0.02 0.72 -0.16 0.00 -0.60 0.00 0.00 56.93 56.92 1m1k s PHE 60 Cb -0.16 -2.25 0.16 0.00 0.51 0.00 0.00 43.02 41.28 1m1k s PHE 60 CO -0.01 -0.24 1.64 0.93 0.70 0.00 0.00 175.22 178.24 1m1k h GLU 61 N 0.30 -0.03 -1.43 0.44 5.08 -1.52 -1.89 114.58 115.52 1m1k h GLU 61 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1m1k h GLU 61 Cb 1.21 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1m1k h GLU 61 CO 0.61 -0.02 0.00 -0.40 -1.00 0.00 0.00 179.01 178.20 1m1k n ASP 62 N -5.39 3.09 0.00 1.42 5.75 -1.26 -4.82 116.55 115.34 1m1k n ASP 62 Ca 0.05 -1.81 0.00 0.00 -0.01 0.00 0.00 54.79 53.01 1m1k n ASP 62 Cb 0.29 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.80 1m1k n ASP 62 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1m1k n GLY 63 N 0.90 2.77 3.71 6.12 0.00 -0.71 -4.99 105.19 112.98 1m1k n GLY 63 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1m1k n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m1k s ASP 64 N -0.77 6.42 -0.20 1.61 1.01 -1.26 -4.73 116.67 118.74 1m1k s ASP 64 Ca 0.00 2.81 0.01 0.00 0.71 0.00 0.00 52.55 56.07 1m1k s ASP 64 Cb 0.00 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.37 1m1k s ASP 64 CO 0.00 -0.97 -0.16 -0.60 0.21 0.00 0.00 175.17 173.66 1m1k s ARG 65 N 1.62 2.89 0.03 8.23 6.06 -1.26 0.17 118.95 136.69 1m1k s ARG 65 Ca 0.76 -0.91 -0.06 0.00 -2.50 0.00 0.00 55.73 53.02 1m1k s ARG 65 Cb -0.48 -2.70 -0.01 0.00 0.06 0.00 0.00 34.95 31.83 1m1k s ARG 65 CO 0.33 -0.28 0.11 1.03 -2.50 0.00 0.00 175.30 173.99 1m1k s ARG 66 N 1.28 0.58 0.31 5.12 0.52 -0.68 -5.00 118.95 121.09 1m1k s ARG 66 Ca 0.02 -0.68 -0.22 0.00 -0.52 0.00 0.00 55.73 54.33 1m1k s ARG 66 Cb -0.15 0.23 -0.10 0.00 0.52 0.00 0.00 34.95 35.46 1m1k s ARG 66 CO -0.10 -0.15 0.86 -0.51 0.02 0.00 0.00 175.30 175.42 1m1k s LEU 67 N -2.00 4.24 0.00 2.53 1.43 -1.26 -1.41 118.68 122.22 1m1k s LEU 67 Ca -0.07 1.64 0.04 0.00 -1.03 0.00 0.00 54.13 54.71 1m1k s LEU 67 Cb -0.02 -3.99 -0.01 0.00 0.03 0.00 0.00 46.19 42.20 1m1k s LEU 67 CO -0.04 -0.10 -0.13 -0.63 0.23 0.00 0.00 176.35 175.68 1m1k s ILE 68 N -1.72 1.04 -0.55 -0.59 1.01 0.54 -4.72 121.20 116.20 1m1k s ILE 68 Ca 0.51 -0.67 -0.26 0.00 0.00 0.00 0.00 60.65 60.22 1m1k s ILE 68 Cb -0.16 -0.89 -0.09 0.00 0.01 0.00 0.00 42.46 41.34 1m1k s ILE 68 CO 0.20 0.21 2.44 -0.11 0.00 0.00 0.00 174.94 177.68 1m1k n LEU 69 N 2.52 2.13 -4.70 2.97 7.94 -1.26 -1.73 117.00 124.88 1m1k n LEU 69 Ca -0.15 -0.56 -0.41 0.00 -1.11 0.00 0.00 56.01 53.77 1m1k n LEU 69 Cb 0.55 -1.55 -0.03 0.00 0.53 0.00 0.00 43.42 42.92 1m1k n LEU 69 CO 0.24 -1.63 0.63 0.00 -1.11 0.00 0.00 177.39 175.52 1m1k s ALA 70 N 12.26 3.35 0.67 1.96 0.00 -1.26 -4.92 121.76 133.81 1m1k s ALA 70 Ca 1.00 0.29 -0.11 0.00 0.00 0.00 0.00 51.96 53.14 1m1k s ALA 70 Cb -0.24 -3.26 -0.00 0.00 0.00 0.00 0.00 23.12 19.62 1m1k s ALA 70 CO 0.26 -0.40 1.06 -2.14 0.00 0.00 0.00 175.76 174.54 1m1k s PRO 71 N 1.50 3.12 0.63 0.00 0.02 -1.26 -1.82 135.00 137.18 1m1k s PRO 71 Ca 0.45 0.53 -0.18 0.00 0.02 0.00 0.00 61.00 61.82 1m1k s PRO 71 Cb -0.18 -2.06 -0.02 0.00 0.02 0.00 0.00 34.50 32.26 1m1k s PRO 71 CO 0.19 -0.86 1.24 -2.00 -0.33 0.00 0.00 177.00 175.25 1m1k s GLU 72 N -5.28 2.73 0.00 5.54 2.12 0.19 -3.40 118.70 120.60 1m1k s GLU 72 Ca 0.57 1.90 0.00 0.00 0.36 0.00 0.00 54.97 57.80 1m1k s GLU 72 Cb -0.11 -1.89 0.00 0.00 0.26 0.00 0.00 34.13 32.39 1m1k s GLU 72 CO 0.52 -1.42 0.00 0.41 -0.54 0.00 0.00 175.26 174.23 1m1k n GLY 73 N 0.63 0.62 3.85 -1.50 0.00 -1.26 -4.81 105.19 102.72 1m1k n GLY 73 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1m1k n GLY 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m1k s VAL 74 N -2.25 5.03 0.17 1.61 1.01 -1.22 -5.06 120.40 119.69 1m1k s VAL 74 Ca 0.00 0.73 0.00 0.00 0.00 0.00 0.00 61.98 62.71 1m1k s VAL 74 Cb 0.00 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1m1k s VAL 74 CO 0.00 0.46 0.06 -0.83 0.00 0.00 0.00 175.10 174.80 1m1k s GLY 75 N -1.33 1.25 0.24 4.51 0.00 -1.26 -5.06 107.32 105.67 1m1k s GLY 75 Ca 0.28 -1.61 -0.31 0.00 0.00 0.00 0.00 44.72 43.07 1m1k s GLY 75 CO 0.15 -1.45 1.61 -0.62 0.00 0.00 0.00 173.10 172.80 1m1k n VAL 76 N -0.22 0.56 0.00 1.40 0.31 -1.26 -1.65 118.33 117.47 1m1k n VAL 76 Ca -0.03 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1m1k n VAL 76 Cb 0.64 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 1m1k n VAL 76 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1m1k n GLY 77 N 2.90 3.25 3.64 2.92 0.00 0.25 -4.99 105.19 113.16 1m1k n GLY 77 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1m1k n GLY 77 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1m1k n ASP 78 N 0.02 0.56 -4.15 1.61 9.92 -0.66 -4.63 116.55 119.22 1m1k n ASP 78 Ca 0.00 0.61 -0.33 0.00 -0.53 0.00 0.00 54.79 54.53 1m1k n ASP 78 Cb 0.00 -1.44 -0.15 0.00 -0.64 0.00 0.00 41.12 38.89 1m1k n ASP 78 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1m1k s GLU 79 N -3.71 2.95 0.07 -1.24 2.12 -1.26 -1.00 118.70 116.63 1m1k s GLU 79 Ca 0.72 -0.87 0.03 0.00 0.36 0.00 0.00 54.97 55.21 1m1k s GLU 79 Cb -0.31 -2.72 -0.04 0.00 0.26 0.00 0.00 34.13 31.32 1m1k s GLU 79 CO 0.52 -0.27 0.08 -0.51 -0.54 0.00 0.00 175.26 174.54 1m1k s LEU 80 N 1.30 3.81 0.00 2.70 1.43 -0.67 -4.94 118.68 122.31 1m1k s LEU 80 Ca 0.03 0.01 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 1m1k s LEU 80 Cb -0.14 -2.47 -0.01 0.00 0.03 0.00 0.00 46.19 43.60 1m1k s LEU 80 CO -0.10 0.18 -0.12 -1.10 0.23 0.00 0.00 176.35 175.45 1m1k s GLN 81 N -2.32 0.91 -0.12 1.70 -0.21 -1.26 -1.16 119.66 117.20 1m1k s GLN 81 Ca 0.29 -0.48 0.00 0.00 0.02 0.00 0.00 55.36 55.19 1m1k s GLN 81 Cb -0.12 -0.88 0.02 0.00 1.00 0.00 0.00 33.01 33.03 1m1k s GLN 81 CO 0.21 0.24 -0.11 0.08 -2.12 0.00 0.00 175.29 173.59 1m1k s VAL 82 N -0.41 1.23 0.00 1.09 1.01 -0.24 -1.92 120.40 121.16 1m1k s VAL 82 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1m1k s VAL 82 Cb -0.05 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1m1k s VAL 82 CO -0.00 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.11 1m1k n GLY 83 N 4.69 0.47 0.33 4.51 0.00 -0.62 -4.14 105.19 110.43 1m1k n GLY 83 Ca -0.16 -1.48 0.01 0.00 0.00 0.00 0.00 46.02 44.39 1m1k n GLY 83 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1m1k h VAL 84 N 3.91 1.18 -0.54 1.61 2.07 -1.87 -2.76 116.25 119.85 1m1k h VAL 84 Ca 0.00 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 1m1k h VAL 84 Cb 0.00 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1m1k h VAL 84 CO 0.00 0.19 0.00 0.47 0.02 0.00 0.00 177.57 178.25 1m1k n ASP 85 N -4.41 5.56 -4.76 0.57 8.00 -1.26 -4.89 116.55 115.36 1m1k n ASP 85 Ca 0.06 -2.95 -0.37 0.00 0.71 0.00 0.00 54.79 52.24 1m1k n ASP 85 Cb 0.07 -0.67 0.01 0.00 -0.02 0.00 0.00 41.12 40.51 1m1k n ASP 85 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1m1k s ALA 86 N -2.79 2.85 1.15 2.24 0.00 -1.04 -4.97 121.76 119.20 1m1k s ALA 86 Ca 0.53 1.06 -0.13 0.00 0.00 0.00 0.00 51.96 53.43 1m1k s ALA 86 Cb 0.41 -3.45 0.28 0.00 0.00 0.00 0.00 23.12 20.36 1m1k s ALA 86 CO 0.15 -0.96 1.04 -2.00 0.00 0.00 0.00 175.76 173.99 1m1k s GLU 87 N -2.88 -0.84 -0.98 0.00 2.12 -1.26 -4.93 118.70 109.93 1m1k s GLU 87 Ca 0.69 0.92 -0.04 0.00 0.36 0.00 0.00 54.97 56.90 1m1k s GLU 87 Cb -0.32 -1.56 0.25 0.00 0.26 0.00 0.00 34.13 32.77 1m1k s GLU 87 CO 0.38 -3.70 0.99 -0.89 -0.54 0.00 0.00 175.26 171.50 1m1k n ILE 88 N -4.91 3.79 -4.16 -3.70 5.41 -1.26 -4.90 119.36 109.63 1m1k n ILE 88 Ca 0.04 -5.33 -0.15 0.00 1.00 0.00 0.00 62.75 58.31 1m1k n ILE 88 Cb 0.54 -2.38 -0.11 0.00 -0.71 0.00 0.00 39.64 36.97 1m1k n ILE 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1m1k s ALA 89 N -1.64 1.06 0.46 -1.39 0.00 -1.26 -5.11 121.76 113.89 1m1k s ALA 89 Ca 0.30 -1.07 -0.23 0.00 0.00 0.00 0.00 51.96 50.96 1m1k s ALA 89 Cb -0.05 -0.01 -0.09 0.00 0.00 0.00 0.00 23.12 22.97 1m1k s ALA 89 CO -0.07 0.03 1.02 -2.30 0.00 0.00 0.00 175.76 174.44 1m1k n PRO 90 N 0.91 1.31 0.00 0.00 -0.02 -1.26 -1.98 135.00 133.96 1m1k n PRO 90 Ca -0.19 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1m1k n PRO 90 Cb 0.56 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1m1k n PRO 90 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m1k n GLY 91 N 1.17 1.79 3.88 -1.23 0.00 -0.74 -4.97 105.19 105.10 1m1k n GLY 91 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1m1k n GLY 91 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m1k s ASN 92 N -2.36 6.57 -0.12 1.61 -0.87 -0.84 -4.63 114.94 114.31 1m1k s ASN 92 Ca 0.00 0.73 0.02 0.00 -1.57 0.00 0.00 52.86 52.04 1m1k s ASN 92 Cb 0.00 -2.15 -0.01 0.00 -0.02 0.00 0.00 41.25 39.07 1m1k s ASN 92 CO 0.00 0.06 -0.19 -0.89 -2.57 0.00 0.00 177.10 173.51 1m1k s THR 93 N -1.62 2.47 -0.00 1.60 2.01 -0.81 -1.18 115.64 118.11 1m1k s THR 93 Ca 0.40 -0.87 -0.29 0.00 0.31 0.00 0.00 61.69 61.25 1m1k s THR 93 Cb -0.12 -1.99 0.08 0.00 0.01 0.00 0.00 72.50 70.48 1m1k s THR 93 CO 0.22 0.54 0.71 -1.48 -0.69 0.00 0.00 174.62 173.92 1m1k s LEU 94 N 0.38 -0.58 0.38 4.42 2.34 -0.77 -1.59 118.68 123.26 1m1k s LEU 94 Ca -0.15 0.43 -0.25 0.00 0.06 0.00 0.00 54.13 54.23 1m1k s LEU 94 Cb -0.17 2.44 -0.12 0.00 -0.56 0.00 0.00 46.19 47.78 1m1k s LEU 94 CO 0.07 -0.68 0.89 -0.81 -1.06 0.00 0.00 176.35 174.76 1m1k n PRO 95 N 0.45 1.12 0.01 1.48 -0.04 -1.26 -2.58 135.00 134.18 1m1k n PRO 95 Ca -0.17 0.40 0.23 0.00 -0.04 0.00 0.00 63.50 63.92 1m1k n PRO 95 Cb 0.60 -1.83 0.67 0.00 -0.04 0.00 0.00 33.50 32.90 1m1k n PRO 95 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1m1k h LEU 96 N 1.46 0.00 -0.28 1.53 3.38 -0.71 0.78 115.31 121.46 1m1k h LEU 96 Ca -0.42 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.41 1m1k h LEU 96 Cb 1.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 1m1k h LEU 96 CO 0.57 0.00 -0.39 0.00 0.09 0.00 0.00 178.44 178.70 1m1k h ALA 97 N 1.25 0.43 0.00 1.53 0.00 -1.56 -2.99 119.26 117.92 1m1k h ALA 97 Ca 0.27 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1m1k h ALA 97 Cb 1.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1m1k h ALA 97 CO -0.00 0.53 0.00 0.39 0.00 0.00 0.00 179.25 180.17 1m1k n GLU 98 N -4.16 0.31 -3.36 0.00 -0.58 0.25 -4.78 120.64 108.33 1m1k n GLU 98 Ca -0.04 0.06 -0.38 0.00 -0.42 0.00 0.00 57.16 56.37 1m1k n GLU 98 Cb 0.54 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.85 1m1k n GLU 98 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1m1k s ILE 99 N -2.61 4.98 0.11 -3.67 -1.09 -1.12 -5.02 121.20 112.77 1m1k s ILE 99 Ca 0.22 1.01 -0.30 0.00 -2.23 0.00 0.00 60.65 59.35 1m1k s ILE 99 Cb 0.16 -3.81 -0.07 0.00 -1.58 0.00 0.00 42.46 37.17 1m1k s ILE 99 CO 0.38 0.49 1.18 -2.16 -1.23 0.00 0.00 174.94 173.60 1m1k s PRO 100 N -0.54 4.48 0.58 2.79 0.04 -1.26 -4.98 135.00 136.11 1m1k s PRO 100 Ca 0.26 1.78 -0.19 0.00 0.04 0.00 0.00 61.00 62.89 1m1k s PRO 100 Cb -0.17 -3.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.00 1m1k s PRO 100 CO 0.14 -0.15 0.97 0.39 0.04 0.00 0.00 177.00 178.39 1m1k n GLU 101 N 3.32 0.96 -0.66 4.56 1.02 -1.26 -2.83 120.64 125.74 1m1k n GLU 101 Ca 0.07 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.57 1m1k n GLU 101 Cb 0.46 -2.16 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 1m1k n GLU 101 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1m1k n GLY 102 N 1.27 0.69 3.66 0.62 0.00 0.31 -5.03 105.19 106.72 1m1k n GLY 102 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1m1k n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m1k s VAL 103 N -2.19 4.46 0.19 1.61 1.01 -1.13 -4.96 120.40 119.39 1m1k s VAL 103 Ca 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 1m1k s VAL 103 Cb 0.00 -2.92 -0.09 0.00 0.00 0.00 0.00 36.38 33.37 1m1k s VAL 103 CO 0.00 0.56 1.36 -2.84 0.00 0.00 0.00 175.10 174.18 1m1k s PRO 104 N -0.46 4.35 0.12 2.72 0.02 -1.26 -3.49 135.00 137.00 1m1k s PRO 104 Ca 0.09 2.11 0.01 0.00 0.02 0.00 0.00 61.00 63.23 1m1k s PRO 104 Cb -0.12 -3.19 -0.04 0.00 0.02 0.00 0.00 34.50 31.17 1m1k s PRO 104 CO 0.02 -0.33 -0.03 0.08 -0.33 0.00 0.00 177.00 176.41 1m1k s VAL 105 N 0.32 0.61 0.17 3.83 1.01 -0.49 -0.90 120.40 124.96 1m1k s VAL 105 Ca 0.59 -1.94 -0.07 0.00 0.00 0.00 0.00 61.98 60.57 1m1k s VAL 105 Cb -0.38 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 1m1k s VAL 105 CO 0.37 -0.74 0.23 0.00 0.00 0.00 0.00 175.10 174.97 1m1k n ASN 107 N -0.21 -5.76 -4.77 0.00 5.15 0.54 -0.73 115.26 109.49 1m1k n ASN 107 Ca -0.05 -0.88 -0.39 0.00 -0.60 0.00 0.00 54.58 52.66 1m1k n ASN 107 Cb 0.63 -3.74 -0.06 0.00 -0.53 0.00 0.00 39.78 36.09 1m1k n ASN 107 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1m1k s VAL 108 N -3.38 4.82 0.36 3.44 1.01 0.51 -4.05 120.40 123.12 1m1k s VAL 108 Ca 0.40 1.30 -0.26 0.00 0.00 0.00 0.00 61.98 63.43 1m1k s VAL 108 Cb -0.13 -3.95 -0.09 0.00 0.00 0.00 0.00 36.38 32.21 1m1k s VAL 108 CO 0.83 0.45 1.07 -1.61 0.00 0.00 0.00 175.10 175.84 1m1k s GLU 109 N -0.43 4.32 0.02 2.72 2.02 -0.77 0.94 118.70 127.53 1m1k s GLU 109 Ca 0.32 1.62 -0.13 0.00 0.02 0.00 0.00 54.97 56.80 1m1k s GLU 109 Cb -0.19 -2.77 -0.33 0.00 0.10 0.00 0.00 34.13 30.94 1m1k s GLU 109 CO 0.19 -0.02 0.94 1.03 0.02 0.00 0.00 175.26 177.42 1m1k h SER 110 N 2.96 0.73 -3.67 -0.19 0.87 -1.92 -3.45 113.55 108.87 1m1k h SER 110 Ca -0.48 -0.84 -0.27 0.00 -1.23 0.00 0.00 61.79 58.97 1m1k h SER 110 Cb 1.21 -0.24 -0.30 0.00 -0.44 0.00 0.00 62.40 62.64 1m1k h SER 110 CO 0.64 1.67 -0.73 -0.94 -0.53 0.00 0.00 176.83 176.94 1m1k s SER 111 N -7.44 0.13 -0.09 6.23 1.04 -1.26 -4.76 113.70 107.55 1m1k s SER 111 Ca -0.10 -0.00 -0.39 0.00 0.48 0.00 0.00 55.95 55.94 1m1k s SER 111 Cb 0.05 -0.05 -0.19 0.00 0.10 0.00 0.00 66.02 65.93 1m1k s SER 111 CO 0.92 -0.04 1.10 -0.81 0.98 0.00 0.00 173.24 175.39 1m1k n PRO 112 N 3.45 0.00 0.00 4.02 -0.04 -1.26 -1.97 135.00 139.20 1m1k n PRO 112 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1m1k n PRO 112 Cb 0.56 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 1m1k n PRO 112 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1m1k n GLY 113 N 1.84 1.85 0.00 0.55 0.00 -1.26 -4.90 105.19 103.27 1m1k n GLY 113 Ca 0.21 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.28 1m1k n GLY 113 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1m1k n ASP 114 N 0.00 0.00 0.00 1.61 5.68 -0.83 -4.84 116.55 118.17 1m1k n ASP 114 Ca 0.00 0.10 0.00 0.00 -0.50 0.00 0.00 54.79 54.39 1m1k n ASP 114 Cb 0.00 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1m1k n ASP 114 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1m1k n GLY 115 N -0.45 0.50 0.00 6.12 0.00 -1.26 -4.89 105.19 105.22 1m1k n GLY 115 Ca 0.05 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1m1k n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1k n GLY 116 N -2.88 1.08 1.46 -0.02 0.00 -1.26 -2.17 105.19 101.40 1m1k n GLY 116 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1m1k n GLY 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1m1k n LYS 117 N 2.54 0.00 -3.23 1.61 4.76 0.27 -4.85 118.16 119.25 1m1k n LYS 117 Ca 0.00 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.14 1m1k n LYS 117 Cb 0.00 -0.21 -0.04 0.00 -1.84 0.00 0.00 35.03 32.94 1m1k n LYS 117 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1m1k s PHE 118 N -1.88 3.45 -0.32 2.13 0.40 -0.35 -4.68 117.98 116.73 1m1k s PHE 118 Ca 0.00 0.85 -0.15 0.00 -0.60 0.00 0.00 56.93 57.03 1m1k s PHE 118 Cb 0.00 -2.27 0.02 0.00 0.51 0.00 0.00 43.02 41.29 1m1k s PHE 118 CO 0.00 0.13 0.36 0.00 0.70 0.00 0.00 175.22 176.41 1m1k n ALA 119 N -0.72 -2.73 0.00 5.36 0.00 -1.26 -0.36 120.51 120.79 1m1k n ALA 119 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1m1k n ALA 119 Cb 0.53 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.90 1m1k n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1m1k n ARG 120 N 0.28 3.45 -1.59 0.00 1.74 -1.26 0.20 116.66 119.49 1m1k n ARG 120 Ca 0.01 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.78 1m1k n ARG 120 Cb 0.42 -0.45 0.05 0.00 -1.02 0.00 0.00 32.46 31.46 1m1k n ARG 120 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1m1k s ALA 121 N -0.44 2.66 -0.47 7.54 0.00 -1.26 -4.90 121.76 124.89 1m1k s ALA 121 Ca 0.00 0.03 -0.46 0.00 0.00 0.00 0.00 51.96 51.53 1m1k s ALA 121 Cb 0.00 -3.16 -0.19 0.00 0.00 0.00 0.00 23.12 19.77 1m1k s ALA 121 CO 0.00 -1.24 1.68 0.43 0.00 0.00 0.00 175.76 176.63 1m1k n SER 122 N -3.14 1.31 0.00 0.00 7.64 -1.26 -1.98 113.62 116.19 1m1k n SER 122 Ca 0.07 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1m1k n SER 122 Cb 0.54 -0.92 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1m1k n SER 122 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m1k n GLY 123 N 4.44 0.72 3.85 0.23 0.00 -0.23 -4.56 105.19 109.64 1m1k n GLY 123 Ca 0.33 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 1m1k n GLY 123 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1m1k s VAL 124 N -2.29 1.91 -0.19 1.61 -7.23 -0.84 -4.48 120.40 108.90 1m1k s VAL 124 Ca 0.00 0.00 -0.31 0.00 -1.81 0.00 0.00 61.98 59.86 1m1k s VAL 124 Cb 0.00 -2.88 0.15 0.00 0.56 0.00 0.00 36.38 34.20 1m1k s VAL 124 CO 0.00 0.00 1.13 0.54 -0.31 0.00 0.00 175.10 176.46 1m1k s ASN 125 N -4.64 -0.22 0.36 4.85 2.20 -1.26 -1.31 114.94 114.91 1m1k s ASN 125 Ca 0.72 0.17 0.07 0.00 -0.94 0.00 0.00 52.86 52.89 1m1k s ASN 125 Cb -0.06 0.20 -0.01 0.00 -2.00 0.00 0.00 41.25 39.38 1m1k s ASN 125 CO 0.53 -0.26 0.46 0.00 -2.94 0.00 0.00 177.10 174.90 1m1k s ALA 126 N -1.58 4.24 -0.24 3.54 0.00 0.31 -3.93 121.76 124.11 1m1k s ALA 126 Ca 0.04 -1.56 -0.01 0.00 0.00 0.00 0.00 51.96 50.44 1m1k s ALA 126 Cb -0.01 -1.56 0.07 0.00 0.00 0.00 0.00 23.12 21.62 1m1k s ALA 126 CO -0.03 -0.09 0.01 -1.14 0.00 0.00 0.00 175.76 174.50 1m1k s GLN 127 N -4.19 1.11 -0.29 0.00 2.00 -0.62 -1.39 119.66 116.28 1m1k s GLN 127 Ca 0.47 -0.82 -0.29 0.00 -2.00 0.00 0.00 55.36 52.72 1m1k s GLN 127 Cb -0.09 -2.34 -0.01 0.00 0.80 0.00 0.00 33.01 31.37 1m1k s GLN 127 CO 0.31 -0.69 1.47 -1.17 -0.50 0.00 0.00 175.29 174.71 1m1k s LEU 128 N 1.59 3.81 -0.10 3.68 2.96 -1.23 -1.16 118.68 128.24 1m1k s LEU 128 Ca -0.01 1.32 -0.11 0.00 -0.22 0.00 0.00 54.13 55.11 1m1k s LEU 128 Cb -0.18 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 1m1k s LEU 128 CO -0.10 -1.25 -0.20 0.18 -1.32 0.00 0.00 176.35 173.66 1m1k n LEU 129 N 8.31 1.18 -4.68 -0.68 4.77 -0.37 -0.53 117.00 125.00 1m1k n LEU 129 Ca 0.17 0.20 -0.31 0.00 -0.03 0.00 0.00 56.01 56.04 1m1k n LEU 129 Cb 0.46 -0.62 -0.09 0.00 -2.33 0.00 0.00 43.42 40.85 1m1k n LEU 129 CO 0.65 -0.38 -0.33 -0.89 -1.33 0.00 0.00 177.39 175.11 1m1k s THR 130 N -2.16 4.06 0.26 -5.08 2.01 -1.14 -4.55 115.64 109.04 1m1k s THR 130 Ca -0.17 -0.78 0.02 0.00 0.31 0.00 0.00 61.69 61.07 1m1k s THR 130 Cb 0.02 -2.86 0.02 0.00 0.01 0.00 0.00 72.50 69.69 1m1k s THR 130 CO 0.25 0.26 0.19 1.41 -0.69 0.00 0.00 174.62 176.04 1m1k n HIS 131 N 1.04 -1.02 0.00 4.92 8.25 -1.26 -1.43 115.22 125.72 1m1k n HIS 131 Ca -0.13 -1.09 0.00 0.00 -0.26 0.00 0.00 57.72 56.24 1m1k n HIS 131 Cb 0.52 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1m1k n HIS 131 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1m1k n ASP 132 N -1.90 0.00 0.09 0.41 -0.08 -1.21 -4.79 116.55 109.06 1m1k n ASP 132 Ca -0.01 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.36 1m1k n ASP 132 Cb 0.29 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.73 1m1k n ASP 132 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1m1k n ARG 133 N -0.89 0.61 -0.06 -0.67 1.74 -1.26 -4.48 116.66 111.65 1m1k n ARG 133 Ca 0.00 0.12 -0.10 0.00 -0.77 0.00 0.00 57.85 57.11 1m1k n ARG 133 Cb 0.00 -1.81 -0.06 0.00 -1.02 0.00 0.00 32.46 29.58 1m1k n ARG 133 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1m1k n ASN 134 N -2.69 2.69 -4.09 0.55 3.02 -1.26 -4.89 115.26 108.59 1m1k n ASN 134 Ca -0.02 -0.03 -0.24 0.00 -0.03 0.00 0.00 54.58 54.26 1m1k n ASN 134 Cb 0.60 -0.23 -0.16 0.00 -0.61 0.00 0.00 39.78 39.39 1m1k n ASN 134 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1m1k s VAL 135 N -2.25 1.18 -0.31 2.41 0.11 -1.26 -4.34 120.40 115.95 1m1k s VAL 135 Ca -0.17 -0.58 -0.04 0.00 -2.93 0.00 0.00 61.98 58.25 1m1k s VAL 135 Cb 0.05 -1.02 0.04 0.00 -1.53 0.00 0.00 36.38 33.91 1m1k s VAL 135 CO 0.28 0.35 0.04 0.00 -3.33 0.00 0.00 175.10 172.43 1m1k s ALA 136 N 0.06 2.92 -0.29 1.54 0.00 1.00 -3.30 121.76 123.68 1m1k s ALA 136 Ca -0.03 -1.67 -0.23 0.00 0.00 0.00 0.00 51.96 50.03 1m1k s ALA 136 Cb -0.10 -2.05 -0.00 0.00 0.00 0.00 0.00 23.12 20.96 1m1k s ALA 136 CO 0.01 -1.19 0.74 0.08 0.00 0.00 0.00 175.76 175.41 1m1k s VAL 137 N 1.35 4.85 -0.05 0.00 1.01 -0.51 -0.57 120.40 126.48 1m1k s VAL 137 Ca -0.02 1.17 0.07 0.00 0.00 0.00 0.00 61.98 63.20 1m1k s VAL 137 Cb -0.19 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 1m1k s VAL 137 CO 0.00 -0.17 -0.25 -0.69 0.00 0.00 0.00 175.10 174.00 1m1k s VAL 138 N 2.81 2.06 -0.46 2.92 1.01 0.56 -1.24 120.40 128.06 1m1k s VAL 138 Ca 0.31 -1.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.05 1m1k s VAL 138 Cb -0.15 -1.73 0.06 0.00 0.00 0.00 0.00 36.38 34.56 1m1k s VAL 138 CO 0.11 0.57 0.40 -0.75 0.00 0.00 0.00 175.10 175.43 1m1k s LYS 139 N -0.28 3.00 0.67 2.72 2.20 -0.31 0.15 119.74 127.89 1m1k s LYS 139 Ca -0.00 -1.21 -0.14 0.00 -0.36 0.00 0.00 55.97 54.26 1m1k s LYS 139 Cb -0.13 -4.09 0.00 0.00 -1.51 0.00 0.00 37.83 32.10 1m1k s LYS 139 CO 0.02 -0.98 1.08 -0.51 -0.36 0.00 0.00 175.35 174.60 1m1k s LEU 140 N 1.76 3.31 0.64 5.43 1.43 -0.46 -1.59 118.68 129.20 1m1k s LEU 140 Ca 0.06 1.84 0.24 0.00 -1.03 0.00 0.00 54.13 55.24 1m1k s LEU 140 Cb -0.22 -4.53 1.25 0.00 0.03 0.00 0.00 46.19 42.72 1m1k s LEU 140 CO 0.08 -1.53 1.70 1.55 0.23 0.00 0.00 176.35 178.39 1m1k h PRO 141 N -0.19 0.00 0.00 1.29 0.13 -1.90 1.45 132.00 132.79 1m1k h PRO 141 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1m1k h PRO 141 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1m1k h PRO 141 CO 0.55 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.98 1m1k h SER 142 N 0.00 0.00 0.00 1.44 4.64 -1.93 -3.46 113.55 114.24 1m1k h SER 142 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1m1k h SER 142 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1m1k h SER 142 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1m1k n GLY 143 N 0.86 0.33 3.76 -0.77 0.00 0.50 -5.08 105.19 104.79 1m1k n GLY 143 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1m1k n GLY 143 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1m1k s GLU 144 N -0.87 2.86 -0.40 1.61 2.12 -1.23 -4.74 118.70 118.05 1m1k s GLU 144 Ca 0.00 1.57 -0.14 0.00 0.36 0.00 0.00 54.97 56.76 1m1k s GLU 144 Cb 0.00 -1.94 0.02 0.00 0.26 0.00 0.00 34.13 32.47 1m1k s GLU 144 CO 0.00 -1.24 0.27 -1.64 -0.54 0.00 0.00 175.26 172.12 1m1k s MET 145 N -3.75 2.97 -0.24 4.30 -1.94 -1.26 -1.35 119.30 118.02 1m1k s MET 145 Ca 0.71 -1.01 -0.07 0.00 -1.71 0.00 0.00 55.69 53.61 1m1k s MET 145 Cb -0.24 -3.91 -0.03 0.00 2.01 0.00 0.00 34.83 32.66 1m1k s MET 145 CO 0.37 -0.72 0.07 0.21 -0.01 0.00 0.00 175.02 174.94 1m1k s LYS 146 N 1.65 3.71 -0.16 2.03 2.47 0.40 -4.92 119.74 124.93 1m1k s LYS 146 Ca 0.04 -0.45 -0.26 0.00 -1.56 0.00 0.00 55.97 53.74 1m1k s LYS 146 Cb -0.19 -3.31 -0.02 0.00 -1.46 0.00 0.00 37.83 32.86 1m1k s LYS 146 CO 0.09 -0.11 0.84 1.03 0.16 0.00 0.00 175.35 177.37 1m1k s ARG 147 N 1.40 4.32 0.13 4.03 0.52 -1.26 -0.33 118.95 127.76 1m1k s ARG 147 Ca 0.05 1.05 0.04 0.00 -0.52 0.00 0.00 55.73 56.35 1m1k s ARG 147 Cb -0.15 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.72 1m1k s ARG 147 CO 0.04 -0.30 -0.10 -0.51 0.02 0.00 0.00 175.30 174.44 1m1k s LEU 148 N 2.06 2.48 0.07 2.53 1.43 0.26 -4.94 118.68 122.57 1m1k s LEU 148 Ca 0.39 -0.94 -0.31 0.00 -1.03 0.00 0.00 54.13 52.25 1m1k s LEU 148 Cb -0.17 -0.34 -0.08 0.00 0.03 0.00 0.00 46.19 45.63 1m1k s LEU 148 CO 0.13 -0.30 1.61 -0.62 0.23 0.00 0.00 176.35 177.40 1m1k s ASP 149 N -2.89 6.63 0.00 2.29 -1.08 -1.26 -0.00 116.67 120.36 1m1k s ASP 149 Ca 0.13 2.45 0.00 0.00 -0.52 0.00 0.00 52.55 54.60 1m1k s ASP 149 Cb 0.00 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.90 1m1k s ASP 149 CO 0.00 -0.86 0.94 -0.81 0.52 0.00 0.00 175.17 174.96 1m1k n PRO 150 N 5.44 0.00 0.20 4.34 -0.04 -1.26 -0.67 135.00 143.01 1m1k n PRO 150 Ca 0.15 0.44 0.13 0.00 -0.04 0.00 0.00 63.50 64.18 1m1k n PRO 150 Cb 0.41 -1.53 0.27 0.00 -0.04 0.00 0.00 33.50 32.61 1m1k n PRO 150 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1m1k h GLN 151 N 0.00 0.00 -6.44 0.54 5.75 -1.94 -1.45 115.11 111.57 1m1k h GLN 151 Ca 0.00 0.00 -0.53 0.00 -0.15 0.00 0.00 58.65 57.97 1m1k h GLN 151 Cb 0.06 0.00 0.03 0.00 1.07 0.00 0.00 27.48 28.63 1m1k h GLN 151 CO 0.00 0.00 1.16 0.00 -2.65 0.00 0.00 178.83 177.34 1m1k s ARG 153 N 3.52 3.89 0.17 0.00 0.52 -1.26 -0.88 118.95 124.92 1m1k s ARG 153 Ca 0.84 1.12 -0.12 0.00 -0.52 0.00 0.00 55.73 57.06 1m1k s ARG 153 Cb -0.44 -2.12 0.00 0.00 0.52 0.00 0.00 34.95 32.91 1m1k s ARG 153 CO 0.38 -0.33 0.36 0.00 0.02 0.00 0.00 175.30 175.74 1m1k s ALA 154 N -2.34 -0.32 -0.14 2.13 0.00 -1.07 -1.84 121.76 118.19 1m1k s ALA 154 Ca 0.62 -0.66 -0.02 0.00 0.00 0.00 0.00 51.96 51.90 1m1k s ALA 154 Cb -0.12 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.83 1m1k s ALA 154 CO 0.25 -0.70 -0.08 0.99 0.00 0.00 0.00 175.76 176.22 1m1k s THR 155 N -3.93 3.49 0.32 0.00 2.01 0.10 -1.85 115.64 115.78 1m1k s THR 155 Ca 0.14 -0.50 -0.29 0.00 0.31 0.00 0.00 61.69 61.35 1m1k s THR 155 Cb 0.02 -2.50 -0.10 0.00 0.01 0.00 0.00 72.50 69.93 1m1k s THR 155 CO -0.01 0.51 1.27 -0.63 -0.69 0.00 0.00 174.62 175.07 1m1k s ILE 156 N 0.30 2.85 0.00 1.82 1.01 -0.32 -0.09 121.20 126.77 1m1k s ILE 156 Ca -0.07 0.86 0.00 0.00 0.00 0.00 0.00 60.65 61.45 1m1k s ILE 156 Cb -0.15 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.77 1m1k s ILE 156 CO 0.04 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.80 1m1k n GLY 157 N 0.87 1.03 3.87 6.18 0.00 -0.08 -1.79 105.19 115.26 1m1k n GLY 157 Ca -0.00 -2.11 -0.31 0.00 0.00 0.00 0.00 46.02 43.59 1m1k n GLY 157 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1m1k s VAL 158 N -1.44 5.10 0.29 1.61 -7.23 -1.26 -3.21 120.40 114.25 1m1k s VAL 158 Ca 0.00 -0.49 -0.30 0.00 -1.81 0.00 0.00 61.98 59.38 1m1k s VAL 158 Cb 0.00 -3.46 -0.12 0.00 0.56 0.00 0.00 36.38 33.36 1m1k s VAL 158 CO 0.00 0.16 1.57 0.52 -0.31 0.00 0.00 175.10 177.04 1m1k n VAL 159 N 0.43 1.03 -0.45 1.32 0.31 -0.43 0.53 118.33 121.07 1m1k n VAL 159 Ca -0.07 -0.26 -0.30 0.00 -0.01 0.00 0.00 64.34 63.71 1m1k n VAL 159 Cb 0.51 -1.90 0.28 0.00 -0.91 0.00 0.00 33.84 31.82 1m1k n VAL 159 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1m1k s GLY 160 N 0.46 1.46 -0.01 2.92 0.00 -0.76 -1.07 107.32 110.31 1m1k s GLY 160 Ca 0.64 -0.60 0.00 0.00 0.00 0.00 0.00 44.72 44.77 1m1k s GLY 160 CO 0.49 0.32 0.00 0.61 0.00 0.00 0.00 173.10 174.52 1m1k n GLY 161 N 1.13 0.47 3.48 0.20 0.00 -1.26 -1.52 105.19 107.69 1m1k n GLY 161 Ca 0.09 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 1m1k n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1k n GLY 162 N -2.83 -1.37 2.14 -0.02 0.00 -1.26 -3.03 105.19 98.84 1m1k n GLY 162 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1m1k n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1k n GLY 163 N 1.71 0.79 0.25 -0.02 0.00 -1.26 -4.89 105.19 101.77 1m1k n GLY 163 Ca 0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.15 1m1k n GLY 163 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1m1k h ARG 164 N 2.72 0.47 0.00 1.61 2.43 -1.88 -0.44 114.38 119.29 1m1k h ARG 164 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1m1k h ARG 164 Cb 0.00 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1m1k h ARG 164 CO 0.00 0.31 0.00 2.41 -1.51 0.00 0.00 179.97 181.18 1m1k n THR 165 N -4.94 1.05 0.23 0.20 -1.04 -1.26 -3.28 114.28 105.23 1m1k n THR 165 Ca 0.10 0.61 0.08 0.00 -2.04 0.00 0.00 64.05 62.80 1m1k n THR 165 Cb 0.29 -1.59 0.54 0.00 -1.82 0.00 0.00 70.33 67.75 1m1k n THR 165 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1m1k h ASP 166 N 0.00 0.00 -3.78 8.00 3.32 -1.48 -3.42 116.42 119.06 1m1k h ASP 166 Ca 0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 1m1k h ASP 166 Cb 0.08 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.47 1m1k h ASP 166 CO 0.00 0.22 -0.51 -0.75 -1.72 0.00 0.00 179.24 176.48 1m1k s LYS 167 N -4.22 3.99 0.62 3.56 2.20 -1.21 -5.07 119.74 119.62 1m1k s LYS 167 Ca -0.03 -0.30 -0.18 0.00 -0.36 0.00 0.00 55.97 55.10 1m1k s LYS 167 Cb 0.14 -3.61 -0.02 0.00 -1.51 0.00 0.00 37.83 32.82 1m1k s LYS 167 CO 0.65 -0.09 1.24 -1.25 -0.36 0.00 0.00 175.35 175.55 1m1k s PRO 168 N 1.49 2.78 0.41 4.03 0.04 -1.26 -4.89 135.00 137.60 1m1k s PRO 168 Ca 0.07 1.92 0.18 0.00 0.04 0.00 0.00 61.00 63.21 1m1k s PRO 168 Cb -0.15 -1.89 0.91 0.00 0.04 0.00 0.00 34.50 33.40 1m1k s PRO 168 CO 0.08 -1.38 1.87 0.74 0.04 0.00 0.00 177.00 178.36 1m1k h PHE 169 N 0.72 0.00 0.00 0.56 -1.00 -1.97 -3.46 116.94 111.79 1m1k h PHE 169 Ca -0.51 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.27 1m1k h PHE 169 Cb 1.31 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.87 1m1k h PHE 169 CO 0.44 0.30 0.00 0.28 -1.61 0.00 0.00 178.31 177.72 1m1k n VAL 170 N -3.86 0.00 -4.11 -0.55 0.31 -1.26 -4.68 118.33 104.17 1m1k n VAL 170 Ca -0.02 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.16 1m1k n VAL 170 Cb 0.38 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.19 1m1k n VAL 170 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 1m1k s LYS 171 N 0.00 0.64 0.23 5.55 -2.85 -1.26 -5.04 119.74 117.01 1m1k s LYS 171 Ca 0.00 -0.82 -0.09 0.00 -1.00 0.00 0.00 55.97 54.07 1m1k s LYS 171 Cb 0.00 -0.50 0.37 0.00 -2.06 0.00 0.00 37.83 35.65 1m1k s LYS 171 CO 0.00 0.10 1.65 0.00 0.10 0.00 0.00 175.35 177.20 1m1k h ALA 172 N 4.46 0.71 -0.79 0.59 0.00 -2.01 -0.87 119.26 121.35 1m1k h ALA 172 Ca -0.37 0.22 0.15 0.00 0.00 0.00 0.00 54.91 54.91 1m1k h ALA 172 Cb 1.20 0.37 -0.15 0.00 0.00 0.00 0.00 17.79 19.21 1m1k h ALA 172 CO 0.41 -0.41 -0.22 0.78 0.00 0.00 0.00 179.25 179.81 1m1k h GLY 173 N 0.11 0.49 0.71 0.00 0.00 -1.96 -0.03 103.07 102.39 1m1k h GLY 173 Ca 0.37 0.29 0.04 0.00 0.00 0.00 0.00 47.33 48.03 1m1k h GLY 173 CO -0.60 -0.29 0.10 3.43 0.00 0.00 0.00 176.54 179.18 1m1k h ASN 174 N -0.02 0.11 -0.65 0.19 2.35 -1.43 -1.89 115.58 114.24 1m1k h ASN 174 Ca 0.37 0.04 0.09 0.00 -0.55 0.00 0.00 56.30 56.24 1m1k h ASN 174 Cb 0.58 0.03 -0.07 0.00 0.05 0.00 0.00 38.32 38.91 1m1k h ASN 174 CO -0.82 0.10 0.30 0.50 -1.65 0.00 0.00 177.43 175.85 1m1k h LYS 175 N 0.24 0.50 -0.32 0.81 3.11 -1.04 -2.54 116.57 117.33 1m1k h LYS 175 Ca 0.14 -0.03 0.04 0.00 -2.81 0.00 0.00 60.65 57.99 1m1k h LYS 175 Cb 0.12 -0.11 -0.07 0.00 -1.00 0.00 0.00 32.23 31.17 1m1k h LYS 175 CO -0.16 0.33 -0.48 1.25 -2.81 0.00 0.00 179.45 177.59 1m1k h HIS 176 N 0.52 -1.47 -0.79 1.91 2.76 -0.30 0.19 115.15 117.97 1m1k h HIS 176 Ca 0.32 0.07 0.09 0.00 -2.20 0.00 0.00 60.37 58.65 1m1k h HIS 176 Cb 0.35 0.68 -0.07 0.00 1.55 0.00 0.00 27.41 29.92 1m1k h HIS 176 CO -0.13 -0.43 0.45 0.45 -1.30 0.00 0.00 177.93 176.97 1m1k h HIS 177 N -0.37 0.81 0.21 5.26 3.86 -1.02 -0.36 115.15 123.54 1m1k h HIS 177 Ca 0.06 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1m1k h HIS 177 Cb 0.52 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.75 1m1k h HIS 177 CO -0.69 0.35 -0.10 -0.22 0.86 0.00 0.00 177.93 178.13 1m1k h LYS 178 N 0.77 -0.27 -0.98 2.45 3.64 -1.11 -2.96 116.57 118.11 1m1k h LYS 178 Ca 0.37 0.02 0.24 0.00 -1.27 0.00 0.00 60.65 60.01 1m1k h LYS 178 Cb 0.31 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.12 1m1k h LYS 178 CO -0.23 -0.01 0.64 0.52 -2.27 0.00 0.00 179.45 178.10 1m1k h MET 179 N -0.51 0.39 0.00 1.90 2.86 0.02 0.19 114.93 119.78 1m1k h MET 179 Ca -0.03 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1m1k h MET 179 Cb 0.38 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.95 1m1k h MET 179 CO 0.05 0.26 0.00 -0.22 1.06 0.00 0.00 176.91 178.05 1m1k h LYS 180 N 0.40 0.00 -0.61 1.72 3.64 -0.91 -1.92 116.57 118.89 1m1k h LYS 180 Ca 0.54 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.92 1m1k h LYS 180 Cb 1.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 1m1k h LYS 180 CO -0.23 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 176.95 1m1k n ALA 181 N -2.06 2.78 -2.37 5.00 0.00 0.67 -4.74 120.51 119.79 1m1k n ALA 181 Ca -0.01 -1.17 -0.19 0.00 0.00 0.00 0.00 53.44 52.08 1m1k n ALA 181 Cb 0.16 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.51 1m1k n ALA 181 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1m1k s ARG 182 N -1.59 1.48 -1.25 0.00 1.81 -0.72 -4.68 118.95 113.99 1m1k s ARG 182 Ca 0.40 -1.79 -0.11 0.00 -1.72 0.00 0.00 55.73 52.51 1m1k s ARG 182 Cb 0.24 -0.60 0.17 0.00 -0.45 0.00 0.00 34.95 34.31 1m1k s ARG 182 CO 0.22 -0.19 1.70 0.41 -0.68 0.00 0.00 175.30 176.76 1m1k n GLY 183 N -0.53 4.22 3.25 -3.53 0.00 -1.26 -4.46 105.19 102.87 1m1k n GLY 183 Ca -0.02 -2.07 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 1m1k n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m1k s THR 184 N 0.83 0.03 -0.21 2.61 2.01 -1.25 -4.78 115.64 114.87 1m1k s THR 184 Ca 0.41 -0.21 -0.18 0.00 0.31 0.00 0.00 61.69 62.02 1m1k s THR 184 Cb 0.05 -0.56 -0.03 0.00 0.01 0.00 0.00 72.50 71.97 1m1k s THR 184 CO 0.00 -0.12 0.50 -0.75 -0.69 0.00 0.00 174.62 173.57 1m1k s LYS 185 N -0.51 4.16 -0.03 4.92 2.47 -1.26 -4.90 119.74 124.58 1m1k s LYS 185 Ca -0.06 0.36 -0.13 0.00 -1.56 0.00 0.00 55.97 54.58 1m1k s LYS 185 Cb -0.04 -3.58 0.02 0.00 -1.46 0.00 0.00 37.83 32.77 1m1k s LYS 185 CO 0.02 -0.18 0.28 -0.46 0.16 0.00 0.00 175.35 175.17 1m1k s TRP 186 N 1.75 -0.17 0.49 4.03 -0.00 -1.26 -4.72 118.94 119.07 1m1k s TRP 186 Ca 0.23 0.30 -0.08 0.00 -0.00 0.00 0.00 56.10 56.54 1m1k s TRP 186 Cb -0.15 0.08 0.12 0.00 -0.00 0.00 0.00 33.47 33.51 1m1k s TRP 186 CO 0.09 -0.33 0.48 -0.35 -0.00 0.00 0.00 176.95 176.84 1m1k n PRO 187 N 1.60 -1.60 -4.39 5.86 -0.04 -1.26 -5.10 135.00 130.08 1m1k n PRO 187 Ca -0.20 -0.77 -0.34 0.00 -0.04 0.00 0.00 63.50 62.15 1m1k n PRO 187 Cb 0.56 -0.66 -0.13 0.00 -0.04 0.00 0.00 33.50 33.23 1m1k n PRO 187 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1m1k s ASN 188 N -2.82 4.44 -0.12 3.54 0.01 -1.26 -5.11 114.94 113.63 1m1k s ASN 188 Ca 0.30 -0.26 -0.11 0.00 -0.71 0.00 0.00 52.86 52.09 1m1k s ASN 188 Cb -0.02 -1.72 -0.05 0.00 0.41 0.00 0.00 41.25 39.87 1m1k s ASN 188 CO 0.23 0.12 0.24 -0.69 -1.51 0.00 0.00 177.10 175.48 1m1k s VAL 189 N 0.65 5.34 0.10 1.60 1.01 -1.26 -5.05 120.40 122.79 1m1k s VAL 189 Ca -0.04 0.44 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 1m1k s VAL 189 Cb -0.15 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.63 1m1k s VAL 189 CO 0.02 0.52 1.11 -0.13 0.00 0.00 0.00 175.10 176.62 1m1k s ARG 190 N -0.42 4.54 0.31 2.72 0.52 -1.26 -4.92 118.95 120.43 1m1k s ARG 190 Ca 0.16 1.67 0.07 0.00 -0.52 0.00 0.00 55.73 57.11 1m1k s ARG 190 Cb -0.13 -3.34 0.82 0.00 0.52 0.00 0.00 34.95 32.82 1m1k s ARG 190 CO 0.05 -0.05 1.70 0.78 0.02 0.00 0.00 175.30 177.79 1m1k h GLY 191 N 6.00 1.70 0.89 -3.53 0.00 -1.97 0.63 103.07 106.81 1m1k h GLY 191 Ca -0.43 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.69 1m1k h GLY 191 CO 0.76 -0.30 0.00 -0.62 0.00 0.00 0.00 176.54 176.38 1m1k n VAL 192 N -5.01 0.00 0.75 4.60 0.31 -1.26 -1.67 118.33 116.05 1m1k n VAL 192 Ca 0.25 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.67 1m1k n VAL 192 Cb 0.73 -0.66 0.07 0.00 -0.91 0.00 0.00 33.84 33.07 1m1k n VAL 192 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1m1k n ALA 193 N -0.95 2.51 -2.97 3.52 0.00 0.22 -4.57 120.51 118.28 1m1k n ALA 193 Ca 0.12 -0.64 -0.11 0.00 0.00 0.00 0.00 53.44 52.82 1m1k n ALA 193 Cb 0.06 -0.61 0.03 0.00 0.00 0.00 0.00 19.45 18.93 1m1k n ALA 193 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1m1k n MET 194 N 0.95 0.78 -3.72 0.00 2.81 -0.67 -4.98 117.12 112.29 1m1k n MET 194 Ca 0.10 -1.43 -0.29 0.00 -1.81 0.00 0.00 57.70 54.27 1m1k n MET 194 Cb 0.45 -0.13 -0.04 0.00 -0.71 0.00 0.00 33.22 32.79 1m1k n MET 194 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1m1k s ASN 195 N -2.68 6.42 0.20 7.83 0.01 -1.26 -2.20 114.94 123.26 1m1k s ASN 195 Ca 0.28 0.45 -0.22 0.00 -0.71 0.00 0.00 52.86 52.66 1m1k s ASN 195 Cb -0.02 -2.03 0.13 0.00 0.41 0.00 0.00 41.25 39.73 1m1k s ASN 195 CO 0.18 0.02 1.55 0.00 -1.51 0.00 0.00 177.10 177.35 1m1k h ALA 196 N 2.46 -0.10 -1.24 0.60 0.00 -1.81 0.72 119.26 119.89 1m1k h ALA 196 Ca -0.47 0.21 0.36 0.00 0.00 0.00 0.00 54.91 55.01 1m1k h ALA 196 Cb 1.18 1.09 -0.06 0.00 0.00 0.00 0.00 17.79 20.00 1m1k h ALA 196 CO 0.71 -0.74 0.88 -0.24 0.00 0.00 0.00 179.25 179.86 1m1k h VAL 197 N -0.04 0.38 0.00 0.00 3.04 -1.94 -2.23 116.25 115.46 1m1k h VAL 197 Ca 0.27 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.95 1m1k h VAL 197 Cb 0.54 0.34 0.00 0.00 -2.01 0.00 0.00 31.29 30.16 1m1k h VAL 197 CO -0.92 0.01 -0.91 0.47 -1.01 0.00 0.00 177.57 175.21 1m1k n ASP 198 N -4.21 0.63 -3.64 3.17 8.00 0.25 -1.50 116.55 119.24 1m1k n ASP 198 Ca 0.27 -0.21 -0.07 0.00 0.71 0.00 0.00 54.79 55.49 1m1k n ASP 198 Cb 1.28 0.65 -0.07 0.00 -0.02 0.00 0.00 41.12 42.96 1m1k n ASP 198 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1m1k s HIS 199 N -3.16 -0.47 0.63 1.24 2.46 -0.84 -4.51 115.29 110.64 1m1k s HIS 199 Ca 0.05 1.09 0.25 0.00 0.47 0.00 0.00 55.06 56.92 1m1k s HIS 199 Cb 0.15 0.37 1.25 0.00 -0.13 0.00 0.00 32.58 34.22 1m1k s HIS 199 CO 0.78 -0.23 1.70 -1.00 -2.47 0.00 0.00 174.74 173.52 1m1k h PRO 200 N 4.53 0.00 -0.02 2.88 0.13 -1.85 0.96 132.00 138.63 1m1k h PRO 200 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1m1k h PRO 200 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1m1k h PRO 200 CO 0.13 0.00 -0.09 1.19 -0.23 0.00 0.00 178.00 179.00 1m1k n PHE 201 N -3.18 0.00 -1.40 1.56 0.99 -1.26 -4.45 117.46 109.73 1m1k n PHE 201 Ca 0.05 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.20 1m1k n PHE 201 Cb 0.72 -0.02 0.10 0.00 -1.00 0.00 0.00 39.48 39.29 1m1k n PHE 201 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1m1k s GLY 202 N -2.13 1.63 0.00 1.37 0.00 0.33 -4.17 107.32 104.35 1m1k s GLY 202 Ca 0.30 -0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.94 1m1k s GLY 202 CO 0.38 0.35 0.00 0.61 0.00 0.00 0.00 173.10 174.44 1m1k n GLY 203 N -1.64 -3.07 0.00 0.20 0.00 -0.94 -3.89 105.19 95.86 1m1k n GLY 203 Ca 0.07 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1m1k n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1k n GLY 204 N -0.53 2.19 0.24 -0.02 0.00 -1.26 -4.73 105.19 101.09 1m1k n GLY 204 Ca 0.00 -1.81 0.14 0.00 0.00 0.00 0.00 46.02 44.35 1m1k n GLY 204 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1m1k h GLY 205 N 0.00 0.00 -1.94 -0.02 0.00 -2.00 -3.45 103.07 95.67 1m1k h GLY 205 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.89 1m1k h GLY 205 CO 0.00 0.00 -0.54 1.09 0.00 0.00 0.00 176.54 177.09 1m1k s ARG 206 N -3.40 1.66 -0.31 4.80 1.70 -1.26 -5.12 118.95 117.01 1m1k s ARG 206 Ca 0.05 -1.96 -0.17 0.00 -0.47 0.00 0.00 55.73 53.18 1m1k s ARG 206 Cb 0.07 -0.03 -0.02 0.00 -0.57 0.00 0.00 34.95 34.40 1m1k s ARG 206 CO 0.61 -0.50 0.44 -0.65 -1.08 0.00 0.00 175.30 174.12 1m1k s GLN 207 N -3.73 3.78 -0.29 3.89 -0.21 -1.26 -4.95 119.66 116.89 1m1k s GLN 207 Ca 0.35 -0.09 -0.25 0.00 0.02 0.00 0.00 55.36 55.39 1m1k s GLN 207 Cb 0.04 -3.74 0.16 0.00 1.00 0.00 0.00 33.01 30.47 1m1k s GLN 207 CO 0.19 -0.48 1.27 -3.38 -2.12 0.00 0.00 175.29 170.77 1m1k s HIS 208 N 2.22 -0.23 0.65 0.91 -3.43 -1.26 -5.11 115.29 109.03 1m1k s HIS 208 Ca 0.17 0.57 -0.18 0.00 -0.80 0.00 0.00 55.06 54.82 1m1k s HIS 208 Cb -0.16 0.43 -0.01 0.00 -1.43 0.00 0.00 32.58 31.41 1m1k s HIS 208 CO 0.11 -0.11 1.19 -0.35 -2.00 0.00 0.00 174.74 173.58 1m1k n PRO 209 N 1.84 0.98 0.11 -0.38 -0.04 -1.26 -4.91 135.00 131.33 1m1k n PRO 209 Ca -0.11 0.39 -0.12 0.00 -0.04 0.00 0.00 63.50 63.62 1m1k n PRO 209 Cb 0.56 -2.42 -0.08 0.00 -0.04 0.00 0.00 33.50 31.53 1m1k n PRO 209 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1m1k h GLY 210 N 0.40 -0.35 0.00 0.55 0.00 -1.80 -3.47 103.07 98.41 1m1k h GLY 210 Ca -0.50 0.13 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1m1k h GLY 210 CO 0.52 -0.13 0.00 0.28 0.00 0.00 0.00 176.54 177.21 1m1k n LYS 211 N -5.03 2.11 -2.61 4.80 5.02 -1.26 -5.10 118.16 116.09 1m1k n LYS 211 Ca -0.08 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.86 1m1k n LYS 211 Cb 0.26 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.23 1m1k n LYS 211 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1m1k s PRO 212 N -0.96 4.02 0.46 1.97 0.04 -1.26 -4.97 135.00 134.30 1m1k s PRO 212 Ca 0.00 1.36 0.24 0.00 0.04 0.00 0.00 61.00 62.64 1m1k s PRO 212 Cb 0.00 -2.27 1.10 0.00 0.04 0.00 0.00 34.50 33.37 1m1k s PRO 212 CO 0.00 -0.24 1.91 0.87 0.04 0.00 0.00 177.00 179.58 1m1k h LYS 213 N 1.96 0.00 -6.26 4.56 1.57 -1.95 -3.44 116.57 113.02 1m1k h LYS 213 Ca -0.49 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.73 1m1k h LYS 213 Cb 1.21 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.48 1m1k h LYS 213 CO 0.61 0.21 0.58 -1.12 -0.57 0.00 0.00 179.45 179.16 1m1k s SER 214 N -6.24 7.22 0.03 0.86 0.01 -1.26 -0.21 113.70 114.11 1m1k s SER 214 Ca -0.01 1.56 0.08 0.00 1.31 0.00 0.00 55.95 58.89 1m1k s SER 214 Cb 0.12 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.76 1m1k s SER 214 CO 0.63 -0.47 -0.22 -0.51 0.41 0.00 0.00 173.24 173.08 1m1k s ILE 215 N 2.05 2.50 0.47 1.44 1.10 0.15 -4.94 121.20 123.97 1m1k s ILE 215 Ca 0.49 -1.20 -0.24 0.00 -0.51 0.00 0.00 60.65 59.19 1m1k s ILE 215 Cb -0.19 -2.00 -0.07 0.00 0.15 0.00 0.00 42.46 40.35 1m1k s ILE 215 CO 0.18 0.41 1.40 -0.55 -2.11 0.00 0.00 174.94 174.27 1m1k s SER 216 N -1.19 5.78 0.29 4.50 0.15 -1.26 -1.04 113.70 120.93 1m1k s SER 216 Ca 0.13 2.86 0.01 0.00 0.70 0.00 0.00 55.95 59.65 1m1k s SER 216 Cb -0.10 -2.65 0.55 0.00 -1.71 0.00 0.00 66.02 62.11 1m1k s SER 216 CO 0.03 -1.24 1.86 0.03 1.20 0.00 0.00 173.24 175.12 1m1k h ARG 217 N 2.15 0.98 0.00 5.44 2.47 -1.95 -1.37 114.38 122.09 1m1k h ARG 217 Ca -0.51 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.15 1m1k h ARG 217 Cb 1.27 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 1m1k h ARG 217 CO 0.60 0.65 0.00 0.09 0.56 0.00 0.00 179.97 181.87 1m1k n ASN 218 N -4.57 0.20 -4.58 7.04 3.02 -1.26 -4.86 115.26 110.26 1m1k n ASN 218 Ca 0.17 0.55 -0.42 0.00 -0.03 0.00 0.00 54.58 54.85 1m1k n ASN 218 Cb 0.31 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 1m1k n ASN 218 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1m1k n ALA 219 N -1.58 -0.24 -1.85 5.41 0.00 -0.52 -4.95 120.51 116.78 1m1k n ALA 219 Ca 0.03 0.26 -0.31 0.00 0.00 0.00 0.00 53.44 53.42 1m1k n ALA 219 Cb 0.20 -2.01 -0.01 0.00 0.00 0.00 0.00 19.45 17.64 1m1k n ALA 219 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1m1k s PRO 220 N -1.82 3.74 0.54 0.00 0.04 -1.26 -4.70 135.00 131.54 1m1k s PRO 220 Ca 0.62 0.85 -0.21 0.00 0.04 0.00 0.00 61.00 62.30 1m1k s PRO 220 Cb -0.60 -2.10 -0.05 0.00 0.04 0.00 0.00 34.50 31.79 1m1k s PRO 220 CO 0.58 -0.45 1.26 -1.25 0.04 0.00 0.00 177.00 177.18 1m1k s PRO 221 N -4.68 3.21 0.00 0.56 0.04 -1.26 -1.39 135.00 131.48 1m1k s PRO 221 Ca 0.57 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.58 1m1k s PRO 221 Cb -0.11 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1m1k s PRO 221 CO 0.44 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.84 1m1k n GLY 222 N 0.59 2.21 0.01 0.56 0.00 -1.26 -4.74 105.19 102.57 1m1k n GLY 222 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1m1k n GLY 222 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1m1k n ARG 223 N -0.07 1.48 -2.46 1.61 0.63 -0.49 -4.73 116.66 112.62 1m1k n ARG 223 Ca 0.00 -0.03 -0.42 0.00 -0.92 0.00 0.00 57.85 56.48 1m1k n ARG 223 Cb 0.00 -1.12 -0.02 0.00 0.45 0.00 0.00 32.46 31.76 1m1k n ARG 223 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 1m1k s LYS 224 N -2.25 3.43 0.27 -0.14 2.20 -0.84 -4.90 119.74 117.50 1m1k s LYS 224 Ca -0.02 0.44 -0.19 0.00 -0.36 0.00 0.00 55.97 55.84 1m1k s LYS 224 Cb 0.02 -4.06 0.02 0.00 -1.51 0.00 0.00 37.83 32.30 1m1k s LYS 224 CO 0.21 -1.78 0.66 0.14 -0.36 0.00 0.00 175.35 174.22 1m1k s VAL 225 N 5.53 0.00 0.00 4.02 -7.23 -1.26 -4.98 120.40 116.48 1m1k s VAL 225 Ca 0.50 -1.06 0.00 0.00 -1.81 0.00 0.00 61.98 59.60 1m1k s VAL 225 Cb -0.10 -2.02 0.00 0.00 0.56 0.00 0.00 36.38 34.83 1m1k s VAL 225 CO 0.26 -0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.66 1m1k n GLY 226 N -0.44 0.50 3.44 2.32 0.00 -1.26 -4.55 105.19 105.20 1m1k n GLY 226 Ca -0.04 -0.99 -0.44 0.00 0.00 0.00 0.00 46.02 44.55 1m1k n GLY 226 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m1k s ASP 227 N -4.00 6.21 -0.17 1.61 1.01 0.71 -4.99 116.67 117.04 1m1k s ASP 227 Ca 0.00 -0.98 -0.29 0.00 0.71 0.00 0.00 52.55 51.99 1m1k s ASP 227 Cb 0.00 -2.26 -0.01 0.00 1.01 0.00 0.00 42.92 41.66 1m1k s ASP 227 CO 0.00 -0.81 1.15 -0.63 0.21 0.00 0.00 175.17 175.10 1m1k s ILE 228 N 2.36 4.47 -1.62 0.77 1.01 -1.26 -0.67 121.20 126.25 1m1k s ILE 228 Ca 0.12 1.77 -0.13 0.00 0.00 0.00 0.00 60.65 62.41 1m1k s ILE 228 Cb -0.20 -4.14 0.13 0.00 0.01 0.00 0.00 42.46 38.26 1m1k s ILE 228 CO 0.11 -0.12 0.33 0.00 0.00 0.00 0.00 174.94 175.25 1m1k n ALA 229 N 6.20 -1.45 -1.72 9.38 0.00 -0.21 -4.80 120.51 127.92 1m1k n ALA 229 Ca 0.12 -0.27 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 1m1k n ALA 229 Cb 0.46 -1.68 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 1m1k n ALA 229 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1m1k n SER 230 N -2.38 3.95 0.11 0.00 3.41 -1.26 -4.86 113.62 112.59 1m1k n SER 230 Ca -0.06 1.08 0.13 0.00 -0.26 0.00 0.00 58.87 59.76 1m1k n SER 230 Cb 0.51 -1.57 0.32 0.00 -0.26 0.00 0.00 64.21 63.21 1m1k n SER 230 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1m1k h LYS 231 N 6.41 0.00 -2.10 4.33 1.57 -1.97 -3.47 116.57 121.33 1m1k h LYS 231 Ca -0.44 0.00 0.33 0.00 -1.87 0.00 0.00 60.65 58.67 1m1k h LYS 231 Cb 1.21 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.45 1m1k h LYS 231 CO 0.93 0.00 0.88 -0.98 -0.57 0.00 0.00 179.45 179.71 1m1k s ARG 232 N -3.13 0.44 0.34 3.15 1.70 -1.26 -5.19 118.95 114.99 1m1k s ARG 232 Ca 0.09 -0.28 -0.09 0.00 -0.47 0.00 0.00 55.73 54.98 1m1k s ARG 232 Cb 0.11 0.12 0.02 0.00 -0.57 0.00 0.00 34.95 34.63 1m1k s ARG 232 CO 0.63 -0.20 0.58 0.95 -1.08 0.00 0.00 175.30 176.17 1m1k s THR 233 N -2.06 0.00 0.00 4.99 -4.23 -1.26 -5.12 115.64 107.96 1m1k s THR 233 Ca 0.28 -1.37 0.00 0.00 -1.18 0.00 0.00 61.69 59.42 1m1k s THR 233 Cb -0.00 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1m1k s THR 233 CO -0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1m1k n GLY 234 N -0.52 -1.08 0.00 3.99 0.00 -1.26 -4.72 105.19 101.60 1m1k n GLY 234 Ca -0.02 -1.17 -0.00 0.00 0.00 0.00 0.00 46.02 44.82 1m1k n GLY 234 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m1k n ARG 235 N -0.57 3.46 -1.55 1.61 1.74 -1.26 -5.07 116.66 115.01 1m1k n ARG 235 Ca 0.00 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 1m1k n ARG 235 Cb 0.00 -1.02 0.03 0.00 -1.02 0.00 0.00 32.46 30.45 1m1k n ARG 235 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1m1k n GLY 236 N 3.01 -0.76 3.05 -0.13 0.00 -1.26 -5.29 105.19 103.81 1m1k n GLY 236 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1m1k n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93