#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g2m s VAL 10 N 0.00 3.52 -0.98 0.52 1.01 -1.26 -4.96 120.40 118.25 3g2m s VAL 10 Ca 0.00 1.06 -0.02 0.00 0.00 0.00 0.00 61.98 63.02 3g2m s VAL 10 Cb 0.00 -3.68 0.30 0.00 0.00 0.00 0.00 36.38 33.00 3g2m s VAL 10 CO 0.00 0.06 1.31 -1.14 0.00 0.00 0.00 175.10 175.33 3g2m n ARG 11 N 4.27 4.02 -1.97 2.72 0.63 -1.26 -4.75 116.66 120.33 3g2m n ARG 11 Ca 0.11 -4.59 -0.37 0.00 -0.92 0.00 0.00 57.85 52.09 3g2m n ARG 11 Cb 0.43 -2.45 0.03 0.00 0.45 0.00 0.00 32.46 30.92 3g2m n ARG 11 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3g2m s THR 12 N -2.71 2.50 0.27 5.15 -4.23 -1.26 -4.74 115.64 110.62 3g2m s THR 12 Ca 0.33 0.35 -0.01 0.00 -1.18 0.00 0.00 61.69 61.18 3g2m s THR 12 Cb 0.07 -3.17 0.28 0.00 1.34 0.00 0.00 72.50 71.02 3g2m s THR 12 CO 0.08 -0.03 1.67 -0.65 -0.54 0.00 0.00 174.62 175.15 3g2m h PRO 13 N 1.38 0.25 -0.30 3.99 0.11 -2.00 -0.08 132.00 135.35 3g2m h PRO 13 Ca -0.50 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.44 3g2m h PRO 13 Cb 1.29 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 3g2m h PRO 13 CO 0.57 0.16 -0.43 1.25 -0.21 0.00 0.00 178.00 179.35 3g2m h HIS 14 N 0.26 0.90 -0.50 0.65 2.76 -2.00 -2.91 115.15 114.31 3g2m h HIS 14 Ca 0.49 -0.28 -0.01 0.00 -2.20 0.00 0.00 60.37 58.38 3g2m h HIS 14 Cb 0.92 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.67 3g2m h HIS 14 CO -0.26 1.04 0.28 0.00 -1.30 0.00 0.00 177.93 177.69 3g2m h ALA 15 N 0.91 0.64 -0.39 5.26 0.00 -1.56 -1.48 119.26 122.64 3g2m h ALA 15 Ca 0.04 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.92 3g2m h ALA 15 Cb 0.98 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 3g2m h ALA 15 CO 0.09 0.16 0.10 -0.44 0.00 0.00 0.00 179.25 179.16 3g2m h ASP 16 N 0.66 0.07 -0.61 0.00 5.19 -1.03 0.34 116.42 121.03 3g2m h ASP 16 Ca 0.18 0.06 -0.03 0.00 -0.62 0.00 0.00 57.03 56.61 3g2m h ASP 16 Cb 0.04 0.06 -0.03 0.00 0.18 0.00 0.00 39.33 39.59 3g2m h ASP 16 CO -0.03 0.07 0.25 0.58 -3.12 0.00 0.00 179.24 176.99 3g2m h VAL 17 N 0.24 1.23 0.56 -1.35 2.07 -1.39 -2.07 116.25 115.54 3g2m h VAL 17 Ca 0.18 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 3g2m h VAL 17 Cb 0.20 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3g2m h VAL 17 CO -0.22 0.28 -0.32 -0.07 0.02 0.00 0.00 177.57 177.26 3g2m h LEU 18 N 0.86 -0.80 -2.10 2.57 3.38 -0.84 -2.15 115.31 116.23 3g2m h LEU 18 Ca 0.21 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 3g2m h LEU 18 Cb 0.20 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3g2m h LEU 18 CO -0.02 -0.52 -0.01 -0.07 0.09 0.00 0.00 178.44 177.91 3g2m h LEU 19 N -0.83 0.00 -0.28 1.67 3.38 -0.93 -1.36 115.31 116.96 3g2m h LEU 19 Ca -0.07 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.70 3g2m h LEU 19 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3g2m h LEU 19 CO 0.09 0.01 -0.63 0.00 0.09 0.00 0.00 178.44 178.00 3g2m h ALA 20 N 1.99 0.44 -0.00 1.53 0.00 -1.23 -3.25 119.26 118.73 3g2m h ALA 20 Ca -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3g2m h ALA 20 Cb 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3g2m h ALA 20 CO 0.00 0.69 -0.20 -1.13 0.00 0.00 0.00 179.25 178.60 3g2m n SER 21 N -3.97 0.66 0.00 0.00 3.41 -0.74 -5.11 113.62 107.86 3g2m n SER 21 Ca -0.05 -0.59 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 3g2m n SER 21 Cb 0.67 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 3g2m n SER 21 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 3g2m n VAL 22 N -0.93 0.00 -3.72 -3.33 3.14 -0.59 -5.09 118.33 107.81 3g2m n VAL 22 Ca 0.12 0.00 -0.36 0.00 -2.96 0.00 0.00 64.34 61.14 3g2m n VAL 22 Cb 0.31 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 33.02 3g2m n VAL 22 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 3g2m s VAL 27 N 1.63 5.39 -0.22 1.55 1.01 -0.26 -4.90 120.40 124.61 3g2m s VAL 27 Ca 0.00 0.31 -0.12 0.00 0.00 0.00 0.00 61.98 62.16 3g2m s VAL 27 Cb 0.00 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 3g2m s VAL 27 CO 0.00 0.49 0.24 -0.22 0.00 0.00 0.00 175.10 175.61 3g2m s LEU 28 N -0.07 4.15 0.08 3.92 2.96 -1.26 -0.47 118.68 127.98 3g2m s LEU 28 Ca 0.13 0.29 0.02 0.00 -0.22 0.00 0.00 54.13 54.34 3g2m s LEU 28 Cb -0.12 -2.26 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 3g2m s LEU 28 CO 0.02 0.04 -0.07 0.00 -1.32 0.00 0.00 176.35 175.01 3g2m s ASP 30 N -2.61 7.53 0.38 0.00 2.15 -1.26 -0.96 116.67 121.91 3g2m s ASP 30 Ca 0.05 1.83 0.09 0.00 0.43 0.00 0.00 52.55 54.95 3g2m s ASP 30 Cb 0.01 -2.57 0.84 0.00 -0.30 0.00 0.00 42.92 40.90 3g2m s ASP 30 CO -0.03 0.16 1.94 0.15 -0.17 0.00 0.00 175.17 177.22 3g2m h PHE 31 N 4.14 0.69 -2.96 -5.34 3.57 -1.47 -3.44 116.94 112.12 3g2m h PHE 31 Ca -0.46 0.02 -0.67 0.00 3.53 0.00 0.00 57.97 60.39 3g2m h PHE 31 Cb 1.20 -0.22 -0.10 0.00 2.79 0.00 0.00 35.95 39.62 3g2m h PHE 31 CO 0.62 0.33 -0.54 0.71 -2.23 0.00 0.00 178.31 177.19 3g2m s TYR 32 N -5.60 3.40 -0.16 0.41 1.51 -1.26 -5.05 117.35 110.60 3g2m s TYR 32 Ca -0.09 0.35 -0.04 0.00 -1.01 0.00 0.00 57.07 56.28 3g2m s TYR 32 Cb 0.20 -1.85 0.05 0.00 -0.11 0.00 0.00 41.96 40.26 3g2m s TYR 32 CO 0.77 0.61 0.06 0.00 -1.11 0.00 0.00 175.55 175.88 3g2m s ALA 47 N -1.03 0.62 -0.43 3.71 0.00 -1.26 -5.15 121.76 118.22 3g2m s ALA 47 Ca 0.16 -0.38 0.08 0.00 0.00 0.00 0.00 51.96 51.83 3g2m s ALA 47 Cb -0.12 -1.02 0.32 0.00 0.00 0.00 0.00 23.12 22.30 3g2m s ALA 47 CO 0.06 -1.06 0.94 -3.47 0.00 0.00 0.00 175.76 172.23 3g2m n ASP 48 N 5.19 -1.17 -2.55 0.00 -0.08 -1.26 -4.92 116.55 111.76 3g2m n ASP 48 Ca -0.07 -3.39 -0.37 0.00 -1.51 0.00 0.00 54.79 49.45 3g2m n ASP 48 Cb 0.49 0.93 0.06 0.00 2.34 0.00 0.00 41.12 44.93 3g2m n ASP 48 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3g2m n GLY 49 N 0.47 5.75 0.28 0.27 0.00 -1.26 -4.72 105.19 105.98 3g2m n GLY 49 Ca 0.13 -2.38 -0.07 0.00 0.00 0.00 0.00 46.02 43.70 3g2m n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3g2m h THR 50 N 1.40 1.23 -0.35 2.61 1.35 -1.89 -0.50 112.91 116.76 3g2m h THR 50 Ca 0.59 -0.71 -0.10 0.00 -0.55 0.00 0.00 66.41 65.65 3g2m h THR 50 Cb 0.52 0.52 -0.02 0.00 -1.73 0.00 0.00 68.15 67.45 3g2m h THR 50 CO 1.52 0.28 -0.18 0.28 -0.25 0.00 0.00 175.52 177.17 3g2m h SER 51 N 0.88 0.66 -0.02 5.36 0.02 -1.84 -2.03 113.55 116.57 3g2m h SER 51 Ca 0.21 -0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3g2m h SER 51 Cb 0.19 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 3g2m h SER 51 CO -0.02 0.85 -0.01 -0.08 -1.14 0.00 0.00 176.83 176.43 3g2m h GLU 52 N 0.59 0.04 -0.94 3.45 4.81 -1.70 -2.04 114.58 118.79 3g2m h GLU 52 Ca 0.09 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 3g2m h GLU 52 Cb 0.64 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 3g2m h GLU 52 CO 0.05 0.41 0.62 0.00 -0.73 0.00 0.00 179.01 179.35 3g2m h ALA 53 N 0.63 1.38 -0.68 2.92 0.00 -1.08 -1.42 119.26 121.02 3g2m h ALA 53 Ca 0.01 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.91 3g2m h ALA 53 Cb 0.39 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3g2m h ALA 53 CO 0.00 0.53 0.41 -0.09 0.00 0.00 0.00 179.25 180.10 3g2m h ARG 54 N 1.20 0.75 -0.64 0.00 2.43 -1.31 -1.06 114.38 115.75 3g2m h ARG 54 Ca 0.37 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.41 3g2m h ARG 54 Cb -0.02 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 3g2m h ARG 54 CO -0.11 0.50 0.06 0.93 -1.51 0.00 0.00 179.97 179.84 3g2m h GLU 55 N 0.78 1.08 -0.19 0.20 4.39 -0.53 0.40 114.58 120.71 3g2m h GLU 55 Ca 0.29 -0.31 0.01 0.00 0.34 0.00 0.00 59.36 59.69 3g2m h GLU 55 Cb 0.09 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3g2m h GLU 55 CO -0.14 1.02 0.08 0.74 -1.16 0.00 0.00 179.01 179.55 3g2m h PHE 56 N 1.00 0.15 -0.53 4.33 0.04 -1.02 -1.30 116.94 119.61 3g2m h PHE 56 Ca 0.19 0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.98 3g2m h PHE 56 Cb 0.49 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.57 3g2m h PHE 56 CO 0.04 0.09 0.34 0.00 -0.60 0.00 0.00 178.31 178.17 3g2m h ALA 57 N 1.10 0.67 -0.65 2.45 0.00 -0.91 -1.62 119.26 120.30 3g2m h ALA 57 Ca 0.08 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3g2m h ALA 57 Cb 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 3g2m h ALA 57 CO -0.06 0.08 0.42 1.15 0.00 0.00 0.00 179.25 180.84 3g2m h THR 58 N 0.69 1.13 0.00 0.00 2.02 -0.71 -3.07 112.91 112.97 3g2m h THR 58 Ca 0.20 -0.29 -0.05 0.00 0.77 0.00 0.00 66.41 67.04 3g2m h THR 58 Cb -0.05 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.57 3g2m h THR 58 CO -0.06 0.15 -0.33 0.03 0.37 0.00 0.00 175.52 175.68 3g2m h ARG 59 N 0.84 0.00 -0.08 6.66 2.47 -1.04 -3.31 114.38 119.93 3g2m h ARG 59 Ca 0.25 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.93 3g2m h ARG 59 Cb -0.06 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.26 3g2m h ARG 59 CO -0.07 0.23 -0.08 1.79 0.56 0.00 0.00 179.97 182.40 3g2m h THR 60 N 0.00 1.37 0.00 2.04 1.35 -1.21 -3.49 112.91 112.97 3g2m h THR 60 Ca -0.01 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 3g2m h THR 60 Cb 1.19 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 3g2m h THR 60 CO 0.03 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.26 3g2m n GLY 61 N 0.22 1.23 0.00 5.82 0.00 -1.19 -4.94 105.19 106.33 3g2m n GLY 61 Ca -0.07 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.34 3g2m n GLY 61 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3g2m n PRO 62 N 0.00 0.00 -3.76 1.61 -0.02 -1.26 -4.98 135.00 126.59 3g2m n PRO 62 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.12 3g2m n PRO 62 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.39 3g2m n PRO 62 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3g2m s VAL 63 N 0.00 5.20 -0.71 -1.45 1.01 -1.26 -5.14 120.40 118.05 3g2m s VAL 63 Ca 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 3g2m s VAL 63 Cb 0.00 -3.39 0.19 0.00 0.00 0.00 0.00 36.38 33.17 3g2m s VAL 63 CO 0.00 0.40 0.60 -0.55 0.00 0.00 0.00 175.10 175.55 3g2m s SER 64 N 0.72 6.08 0.00 3.32 0.15 -1.26 -5.00 113.70 117.71 3g2m s SER 64 Ca 0.07 -2.67 0.00 0.00 0.70 0.00 0.00 55.95 54.04 3g2m s SER 64 Cb -0.13 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.13 3g2m s SER 64 CO 0.02 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.55 3g2m n GLY 65 N 3.89 2.88 3.67 9.45 0.00 -1.26 -4.87 105.19 118.94 3g2m n GLY 65 Ca 0.09 -2.05 -0.39 0.00 0.00 0.00 0.00 46.02 43.67 3g2m n GLY 65 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3g2m n PRO 66 N -1.09 1.34 -4.85 1.61 -0.02 -1.26 -4.66 135.00 126.07 3g2m n PRO 66 Ca 0.00 0.50 -0.33 0.00 -2.02 0.00 0.00 63.50 61.65 3g2m n PRO 66 Cb 0.00 -2.30 -0.14 0.00 -0.02 0.00 0.00 33.50 31.04 3g2m n PRO 66 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3g2m s VAL 67 N -1.36 3.03 -0.29 -1.45 1.01 0.35 -3.88 120.40 117.80 3g2m s VAL 67 Ca 0.71 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.82 3g2m s VAL 67 Cb -0.45 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 3g2m s VAL 67 CO 0.50 0.56 0.41 -0.22 0.00 0.00 0.00 175.10 176.35 3g2m s LEU 68 N -0.22 4.13 -0.27 3.92 2.96 -0.33 -0.55 118.68 128.32 3g2m s LEU 68 Ca 0.01 0.22 -0.09 0.00 -0.22 0.00 0.00 54.13 54.05 3g2m s LEU 68 Cb -0.13 -2.47 -0.03 0.00 0.50 0.00 0.00 46.19 44.06 3g2m s LEU 68 CO 0.03 -0.25 0.11 -0.70 -1.32 0.00 0.00 176.35 174.22 3g2m s GLU 69 N 2.14 3.61 0.04 1.98 2.12 0.34 -0.79 118.70 128.14 3g2m s GLU 69 Ca 0.16 -0.52 -0.20 0.00 0.36 0.00 0.00 54.97 54.77 3g2m s GLU 69 Cb -0.16 -3.44 -0.06 0.00 0.26 0.00 0.00 34.13 30.73 3g2m s GLU 69 CO 0.10 -0.25 0.59 -0.51 -0.54 0.00 0.00 175.26 174.66 3g2m s LEU 70 N 1.64 4.48 -1.19 2.70 1.43 -0.46 -0.98 118.68 126.31 3g2m s LEU 70 Ca 0.06 1.24 -0.08 0.00 -1.03 0.00 0.00 54.13 54.32 3g2m s LEU 70 Cb -0.16 -2.93 -0.02 0.00 0.03 0.00 0.00 46.19 43.11 3g2m s LEU 70 CO 0.06 0.19 0.79 0.00 0.23 0.00 0.00 176.35 177.62 3g2m n ALA 71 N 2.17 -2.30 0.61 4.21 0.00 0.29 -4.54 120.51 120.94 3g2m n ALA 71 Ca -0.08 -0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.34 3g2m n ALA 71 Cb 0.51 -3.61 0.42 0.00 0.00 0.00 0.00 19.45 16.77 3g2m n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g2m n ALA 72 N -3.98 1.87 0.00 0.00 0.00 -0.47 -4.93 120.51 113.00 3g2m n ALA 72 Ca -0.18 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3g2m n ALA 72 Cb 0.64 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.75 3g2m n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g2m n GLY 73 N 0.45 -0.41 0.70 0.00 0.00 -1.26 -4.16 105.19 100.50 3g2m n GLY 73 Ca 0.04 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.12 3g2m n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g2m n GLY 75 N 0.00 3.66 0.37 -0.02 0.00 -1.26 -4.66 105.19 103.28 3g2m n GLY 75 Ca 0.00 -1.04 0.15 0.00 0.00 0.00 0.00 46.02 45.13 3g2m n GLY 75 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3g2m h ARG 76 N 0.70 0.64 0.00 1.61 2.43 -1.98 -2.31 114.38 115.47 3g2m h ARG 76 Ca -0.05 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 58.88 3g2m h ARG 76 Cb 1.25 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.62 3g2m h ARG 76 CO 0.02 0.42 -2.03 1.28 -1.51 0.00 0.00 179.97 178.15 3g2m n LEU 77 N -4.68 0.00 -0.21 3.80 4.77 -1.26 -4.42 117.00 115.00 3g2m n LEU 77 Ca 0.22 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.14 3g2m n LEU 77 Cb 0.62 0.26 0.03 0.00 -2.33 0.00 0.00 43.42 42.01 3g2m n LEU 77 CO 0.24 0.26 1.08 0.74 -1.33 0.00 0.00 177.39 178.39 3g2m h THR 78 N 0.00 1.18 -0.18 -5.08 2.02 -1.78 -0.41 112.91 108.65 3g2m h THR 78 Ca -0.29 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 66.45 3g2m h THR 78 Cb 1.60 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 3g2m h THR 78 CO 0.02 0.18 -0.05 -0.26 0.37 0.00 0.00 175.52 175.78 3g2m h PHE 79 N 0.80 0.40 -0.92 3.16 0.04 -1.70 0.89 116.94 119.61 3g2m h PHE 79 Ca 0.21 -0.09 0.18 0.00 2.80 0.00 0.00 57.97 61.07 3g2m h PHE 79 Cb -0.01 -0.10 -0.10 0.00 2.20 0.00 0.00 35.95 37.94 3g2m h PHE 79 CO -0.02 0.62 0.50 -1.35 -0.60 0.00 0.00 178.31 177.46 3g2m h PRO 80 N 0.07 0.62 -0.49 1.51 0.11 -1.77 -0.49 132.00 131.56 3g2m h PRO 80 Ca 0.05 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 3g2m h PRO 80 Cb 0.49 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.44 3g2m h PRO 80 CO 0.02 0.41 0.18 0.74 -0.21 0.00 0.00 178.00 179.14 3g2m h PHE 81 N 0.64 0.76 -0.10 0.65 0.04 -0.46 -2.67 116.94 115.81 3g2m h PHE 81 Ca 0.53 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 61.18 3g2m h PHE 81 Cb 0.82 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.74 3g2m h PHE 81 CO -0.06 0.65 -0.18 -0.07 -0.60 0.00 0.00 178.31 178.04 3g2m h LEU 82 N 0.66 0.15 -1.33 1.54 3.38 -0.49 -2.00 115.31 117.21 3g2m h LEU 82 Ca 0.16 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3g2m h LEU 82 Cb 0.22 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3g2m h LEU 82 CO -0.01 0.35 0.00 0.44 0.09 0.00 0.00 178.44 179.31 3g2m h ASP 83 N 0.15 0.00 -0.04 -0.43 3.32 -0.75 -1.91 116.42 116.75 3g2m h ASP 83 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3g2m h ASP 83 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 3g2m h ASP 83 CO 0.03 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.73 3g2m n LEU 84 N -2.61 2.02 0.00 1.55 4.77 -0.76 -4.94 117.00 117.03 3g2m n LEU 84 Ca 0.00 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 3g2m n LEU 84 Cb 0.20 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3g2m n LEU 84 CO 0.20 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3g2m n GLY 85 N 1.23 0.56 3.77 -0.72 0.00 -0.72 -5.06 105.19 104.26 3g2m n GLY 85 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3g2m n GLY 85 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3g2m s TRP 86 N -2.27 2.59 -0.11 1.61 0.52 -1.17 -5.01 118.94 115.11 3g2m s TRP 86 Ca 0.00 1.23 -0.27 0.00 0.02 0.00 0.00 56.10 57.08 3g2m s TRP 86 Cb 0.00 -3.95 -0.02 0.00 -1.15 0.00 0.00 33.47 28.35 3g2m s TRP 86 CO 0.00 -2.85 0.87 -1.21 0.02 0.00 0.00 176.95 173.79 3g2m s GLU 87 N -2.19 4.39 -0.08 4.98 2.02 -1.26 -4.55 118.70 122.02 3g2m s GLU 87 Ca 0.55 1.14 0.02 0.00 0.02 0.00 0.00 54.97 56.70 3g2m s GLU 87 Cb -0.45 -3.53 0.01 0.00 0.10 0.00 0.00 34.13 30.27 3g2m s GLU 87 CO 0.60 -0.22 -0.14 0.08 0.02 0.00 0.00 175.26 175.60 3g2m s VAL 88 N 1.72 1.31 -0.33 2.63 1.01 -0.31 -0.50 120.40 125.92 3g2m s VAL 88 Ca 0.42 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.68 3g2m s VAL 88 Cb -0.18 -1.18 -0.01 0.00 0.00 0.00 0.00 36.38 35.01 3g2m s VAL 88 CO 0.17 0.39 0.39 -0.89 0.00 0.00 0.00 175.10 175.17 3g2m s THR 89 N 0.68 5.14 -0.26 3.92 2.01 0.29 -0.68 115.64 126.74 3g2m s THR 89 Ca -0.14 0.18 -0.08 0.00 0.31 0.00 0.00 61.69 61.96 3g2m s THR 89 Cb -0.16 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 3g2m s THR 89 CO 0.04 -0.08 0.09 0.00 -0.69 0.00 0.00 174.62 173.97 3g2m s ALA 90 N 2.10 3.22 -0.18 7.40 0.00 0.24 -0.51 121.76 134.04 3g2m s ALA 90 Ca 0.14 -1.14 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 3g2m s ALA 90 Cb -0.16 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 3g2m s ALA 90 CO 0.12 -0.52 0.06 -1.17 0.00 0.00 0.00 175.76 174.24 3g2m s LEU 91 N 1.63 3.80 -0.09 0.00 2.96 -0.15 -1.53 118.68 125.30 3g2m s LEU 91 Ca 0.06 0.08 -0.09 0.00 -0.22 0.00 0.00 54.13 53.97 3g2m s LEU 91 Cb -0.15 -1.96 0.02 0.00 0.50 0.00 0.00 46.19 44.60 3g2m s LEU 91 CO 0.05 0.18 0.24 -0.70 -1.32 0.00 0.00 176.35 174.80 3g2m s GLU 92 N 0.32 0.30 0.02 1.98 2.56 -0.61 -0.55 118.70 122.72 3g2m s GLU 92 Ca 0.03 0.30 -0.17 0.00 0.00 0.00 0.00 54.97 55.13 3g2m s GLU 92 Cb -0.12 0.15 -0.33 0.00 2.00 0.00 0.00 34.13 35.82 3g2m s GLU 92 CO 0.00 -0.04 1.01 1.25 -0.56 0.00 0.00 175.26 176.92 3g2m h LEU 93 N 5.66 0.77 -9.41 2.70 5.85 -1.78 -1.41 115.31 117.70 3g2m h LEU 93 Ca -0.26 -0.90 -0.55 0.00 0.84 0.00 0.00 57.88 57.01 3g2m h LEU 93 Cb 1.19 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.93 3g2m h LEU 93 CO 0.36 1.61 0.20 -0.55 -0.34 0.00 0.00 178.44 179.72 3g2m s SER 94 N -7.40 7.16 0.20 1.25 0.15 -1.26 -4.68 113.70 109.12 3g2m s SER 94 Ca -0.10 1.40 -0.06 0.00 0.70 0.00 0.00 55.95 57.89 3g2m s SER 94 Cb 0.04 -2.48 0.14 0.00 -1.71 0.00 0.00 66.02 62.01 3g2m s SER 94 CO 0.92 -0.15 1.61 0.71 1.20 0.00 0.00 173.24 177.53 3g2m h THR 95 N 4.68 1.27 -0.31 6.45 1.35 -1.99 -1.33 112.91 123.03 3g2m h THR 95 Ca -0.41 -1.35 -0.12 0.00 -0.55 0.00 0.00 66.41 63.98 3g2m h THR 95 Cb 1.21 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 68.81 3g2m h THR 95 CO 0.75 0.45 -0.27 0.77 -0.25 0.00 0.00 175.52 176.97 3g2m h SER 96 N 0.72 0.77 -0.55 5.36 4.64 -1.99 0.12 113.55 122.62 3g2m h SER 96 Ca 0.10 -0.46 -0.02 0.00 -0.47 0.00 0.00 61.79 60.94 3g2m h SER 96 Cb 0.75 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.60 3g2m h SER 96 CO 0.06 1.07 0.29 0.58 -0.87 0.00 0.00 176.83 177.95 3g2m h VAL 97 N 0.48 1.19 -0.88 0.95 2.07 -1.93 -1.77 116.25 116.37 3g2m h VAL 97 Ca 0.05 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 67.06 3g2m h VAL 97 Cb 0.83 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 3g2m h VAL 97 CO 0.07 0.21 0.58 -0.07 0.02 0.00 0.00 177.57 178.39 3g2m h LEU 98 N 0.74 1.01 -0.32 2.57 3.38 -1.08 0.80 115.31 122.41 3g2m h LEU 98 Ca 0.19 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.15 3g2m h LEU 98 Cb 0.08 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3g2m h LEU 98 CO -0.03 0.73 0.18 0.00 0.09 0.00 0.00 178.44 179.41 3g2m h ALA 99 N 1.32 0.40 -0.24 1.53 0.00 -0.72 0.45 119.26 122.00 3g2m h ALA 99 Ca 0.32 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 3g2m h ALA 99 Cb -0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3g2m h ALA 99 CO -0.07 -0.19 -0.12 0.00 0.00 0.00 0.00 179.25 178.87 3g2m h ALA 100 N 1.15 1.35 -0.29 0.00 0.00 -0.91 -1.31 119.26 119.26 3g2m h ALA 100 Ca 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3g2m h ALA 100 Cb 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3g2m h ALA 100 CO -0.07 0.44 0.11 0.35 0.00 0.00 0.00 179.25 180.08 3g2m h PHE 101 N 0.37 0.44 -0.84 0.00 -0.00 -0.46 -2.46 116.94 113.99 3g2m h PHE 101 Ca 0.07 -0.03 0.00 0.00 -0.00 0.00 0.00 57.97 58.01 3g2m h PHE 101 Cb 0.44 -0.13 -0.04 0.00 -0.00 0.00 0.00 35.95 36.21 3g2m h PHE 101 CO 0.01 0.43 0.54 0.00 -0.00 0.00 0.00 178.31 179.30 3g2m h ARG 102 N 0.31 1.12 -0.60 1.11 3.08 -0.38 0.72 114.38 119.74 3g2m h ARG 102 Ca 0.10 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 3g2m h ARG 102 Cb 0.18 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 3g2m h ARG 102 CO -0.01 0.75 0.32 -0.22 -1.07 0.00 0.00 179.97 179.74 3g2m h LYS 103 N 1.15 0.83 -0.50 0.04 3.64 -1.18 -0.12 116.57 120.43 3g2m h LYS 103 Ca 0.31 -0.10 -0.11 0.00 -1.27 0.00 0.00 60.65 59.48 3g2m h LYS 103 Cb -0.11 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.53 3g2m h LYS 103 CO -0.06 0.64 -0.12 0.00 -2.27 0.00 0.00 179.45 177.64 3g2m h ARG 104 N 0.81 0.93 0.00 1.90 3.08 -0.93 -3.03 114.38 117.14 3g2m h ARG 104 Ca 0.21 -0.34 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 3g2m h ARG 104 Cb 0.06 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3g2m h ARG 104 CO -0.03 0.99 -0.34 1.25 -1.07 0.00 0.00 179.97 180.77 3g2m h LEU 105 N 0.83 0.00 -0.64 3.04 5.85 -0.50 -2.71 115.31 121.18 3g2m h LEU 105 Ca 0.13 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3g2m h LEU 105 Cb 0.66 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 3g2m h LEU 105 CO 0.05 0.34 -0.05 0.00 -0.34 0.00 0.00 178.44 178.44 3g2m h ALA 106 N 1.66 0.98 -0.02 1.25 0.00 -0.91 -3.05 119.26 119.17 3g2m h ALA 106 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3g2m h ALA 106 Cb 0.74 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3g2m h ALA 106 CO 0.04 0.07 -0.05 0.39 0.00 0.00 0.00 179.25 179.70 3g2m n GLU 107 N -3.13 1.94 -3.14 0.00 1.02 -1.03 -4.92 120.64 111.38 3g2m n GLU 107 Ca 0.02 -1.46 -0.29 0.00 -0.02 0.00 0.00 57.16 55.42 3g2m n GLU 107 Cb 0.45 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 3g2m n GLU 107 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3g2m s ALA 108 N -2.06 3.51 0.64 0.62 0.00 -1.15 -5.07 121.76 118.26 3g2m s ALA 108 Ca 0.30 -0.43 -0.17 0.00 0.00 0.00 0.00 51.96 51.66 3g2m s ALA 108 Cb 0.20 -2.46 -0.01 0.00 0.00 0.00 0.00 23.12 20.86 3g2m s ALA 108 CO 0.34 0.12 1.18 -2.14 0.00 0.00 0.00 175.76 175.27 3g2m s PRO 109 N -3.71 2.72 0.33 0.00 0.02 -1.26 -4.72 135.00 128.37 3g2m s PRO 109 Ca 0.47 1.71 0.11 0.00 0.02 0.00 0.00 61.00 63.30 3g2m s PRO 109 Cb -0.10 -1.91 0.91 0.00 0.02 0.00 0.00 34.50 33.42 3g2m s PRO 109 CO 0.31 -1.38 1.73 0.00 -0.33 0.00 0.00 177.00 177.33 3g2m h ALA 110 N 0.39 1.85 -0.73 -1.55 0.00 -1.97 -0.71 119.26 116.54 3g2m h ALA 110 Ca -0.49 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 3g2m h ALA 110 Cb 1.29 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 3g2m h ALA 110 CO 0.53 -0.31 0.27 0.38 0.00 0.00 0.00 179.25 180.12 3g2m h ASP 111 N 0.56 1.02 0.19 0.00 2.03 -1.99 -0.29 116.42 117.94 3g2m h ASP 111 Ca 0.64 -0.16 -0.01 0.00 -0.73 0.00 0.00 57.03 56.77 3g2m h ASP 111 Cb 1.27 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 39.50 3g2m h ASP 111 CO -0.46 0.92 -0.09 0.58 -1.03 0.00 0.00 179.24 179.16 3g2m h VAL 112 N 1.07 0.89 -0.84 4.15 2.07 -1.51 -3.24 116.25 118.84 3g2m h VAL 112 Ca 0.24 -0.87 0.09 0.00 0.82 0.00 0.00 66.70 66.98 3g2m h VAL 112 Cb 0.24 1.37 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 3g2m h VAL 112 CO -0.02 0.18 0.50 -0.09 0.02 0.00 0.00 177.57 178.16 3g2m h ARG 113 N -0.72 0.83 0.00 1.57 2.43 -1.30 -2.08 114.38 115.10 3g2m h ARG 113 Ca -0.03 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3g2m h ARG 113 Cb 0.50 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3g2m h ARG 113 CO 0.04 0.55 0.00 -0.44 -1.51 0.00 0.00 179.97 178.61 3g2m h ASP 114 N 0.85 0.00 0.14 -3.80 3.32 -1.13 -2.72 116.42 113.09 3g2m h ASP 114 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 3g2m h ASP 114 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 3g2m h ASP 114 CO -0.23 0.00 -0.52 0.54 -1.72 0.00 0.00 179.24 177.31 3g2m n ARG 115 N -2.99 0.67 -4.10 3.56 1.74 -0.79 -4.88 116.66 109.87 3g2m n ARG 115 Ca -0.01 -0.49 -0.35 0.00 -0.77 0.00 0.00 57.85 56.24 3g2m n ARG 115 Cb 0.21 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.05 3g2m n ARG 115 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g2m s THR 117 N 0.64 2.55 -0.05 0.00 2.01 0.15 -4.97 115.64 115.97 3g2m s THR 117 Ca 0.01 -1.03 -0.17 0.00 0.31 0.00 0.00 61.69 60.81 3g2m s THR 117 Cb -0.14 -2.24 -0.05 0.00 0.01 0.00 0.00 72.50 70.08 3g2m s THR 117 CO 0.02 0.30 0.45 -0.76 -0.69 0.00 0.00 174.62 173.95 3g2m s LEU 118 N 1.30 4.38 -0.02 4.42 1.43 -1.26 -0.59 118.68 128.34 3g2m s LEU 118 Ca 0.01 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 54.03 3g2m s LEU 118 Cb -0.16 -2.66 0.02 0.00 0.03 0.00 0.00 46.19 43.42 3g2m s LEU 118 CO -0.07 0.17 0.01 -0.69 0.23 0.00 0.00 176.35 175.99 3g2m s VAL 119 N -0.26 0.10 -0.02 -1.59 1.01 -0.58 -4.96 120.40 114.09 3g2m s VAL 119 Ca 0.25 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 3g2m s VAL 119 Cb -0.16 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 3g2m s VAL 119 CO 0.12 0.10 1.01 -1.58 0.00 0.00 0.00 175.10 174.76 3g2m s GLN 120 N 0.80 4.51 -0.10 2.72 -0.44 -1.26 -1.57 119.66 124.32 3g2m s GLN 120 Ca -0.07 1.45 -0.33 0.00 -2.50 0.00 0.00 55.36 53.90 3g2m s GLN 120 Cb -0.11 -3.47 0.14 0.00 -1.64 0.00 0.00 33.01 27.93 3g2m s GLN 120 CO -0.02 -0.14 1.33 0.20 0.50 0.00 0.00 175.29 177.17 3g2m s GLY 121 N 1.05 -0.39 0.00 2.59 0.00 -0.53 -4.87 107.32 105.17 3g2m s GLY 121 Ca 0.52 1.08 0.00 0.00 0.00 0.00 0.00 44.72 46.31 3g2m s GLY 121 CO 0.26 0.27 0.00 1.34 0.00 0.00 0.00 173.10 174.96 3g2m n ASP 122 N -0.37 0.48 0.00 1.64 -0.08 -1.26 -2.39 116.55 114.57 3g2m n ASP 122 Ca -0.06 -0.15 0.00 0.00 -1.51 0.00 0.00 54.79 53.07 3g2m n ASP 122 Cb 0.62 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.08 3g2m n ASP 122 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3g2m n SER 124 N -0.38 0.00 -2.91 1.67 3.41 -1.26 -2.34 113.62 111.81 3g2m n SER 124 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 3g2m n SER 124 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 3g2m n SER 124 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g2m s ALA 125 N 0.00 -2.75 0.24 7.33 0.00 -1.26 -3.06 121.76 122.25 3g2m s ALA 125 Ca 0.00 0.12 0.09 0.00 0.00 0.00 0.00 51.96 52.17 3g2m s ALA 125 Cb 0.00 -2.79 -0.05 0.00 0.00 0.00 0.00 23.12 20.28 3g2m s ALA 125 CO 0.00 -2.30 -0.14 -0.59 0.00 0.00 0.00 175.76 172.73 3g2m s PHE 126 N 1.36 1.91 -0.24 0.00 -0.12 -0.99 -5.08 117.98 114.83 3g2m s PHE 126 Ca 0.22 -0.53 -0.07 0.00 -0.05 0.00 0.00 56.93 56.51 3g2m s PHE 126 Cb 0.00 -0.91 0.11 0.00 -0.63 0.00 0.00 43.02 41.59 3g2m s PHE 126 CO -0.07 0.44 0.49 0.00 -0.05 0.00 0.00 175.22 176.03 3g2m s ALA 127 N -2.85 -1.46 0.27 1.99 0.00 -1.26 -4.88 121.76 113.57 3g2m s ALA 127 Ca 0.26 1.69 0.12 0.00 0.00 0.00 0.00 51.96 54.03 3g2m s ALA 127 Cb -0.01 -1.53 -0.05 0.00 0.00 0.00 0.00 23.12 21.53 3g2m s ALA 127 CO 0.10 -0.89 -0.20 -0.51 0.00 0.00 0.00 175.76 174.26 3g2m s LEU 128 N 2.70 2.59 -0.35 0.00 1.43 -1.26 -5.03 118.68 118.76 3g2m s LEU 128 Ca 0.00 -1.00 -0.03 0.00 -1.03 0.00 0.00 54.13 52.07 3g2m s LEU 128 Cb -0.13 -1.12 0.08 0.00 0.03 0.00 0.00 46.19 45.05 3g2m s LEU 128 CO -0.15 0.05 2.57 -0.67 0.23 0.00 0.00 176.35 178.37 3g2m n ASP 129 N -0.53 6.32 -3.58 2.29 2.03 -1.26 -4.84 116.55 116.98 3g2m n ASP 129 Ca -0.06 -3.06 -0.16 0.00 0.52 0.00 0.00 54.79 52.03 3g2m n ASP 129 Cb 0.60 -1.19 -0.07 0.00 -0.72 0.00 0.00 41.12 39.74 3g2m n ASP 129 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3g2m s LYS 130 N -1.43 0.93 0.30 -0.67 2.20 -1.26 -5.17 119.74 114.63 3g2m s LYS 130 Ca 0.48 0.57 0.10 0.00 -0.36 0.00 0.00 55.97 56.76 3g2m s LYS 130 Cb 0.32 0.44 -0.05 0.00 -1.51 0.00 0.00 37.83 37.03 3g2m s LYS 130 CO -0.12 -0.21 -0.04 1.03 -0.36 0.00 0.00 175.35 175.65 3g2m s ARG 131 N -0.46 2.07 0.03 4.03 0.52 -1.26 -4.84 118.95 119.04 3g2m s ARG 131 Ca -0.06 -1.63 0.02 0.00 -0.52 0.00 0.00 55.73 53.54 3g2m s ARG 131 Cb -0.02 -1.98 -0.02 0.00 0.52 0.00 0.00 34.95 33.44 3g2m s ARG 131 CO 0.06 0.26 -0.07 -0.06 0.02 0.00 0.00 175.30 175.51 3g2m s PHE 132 N -2.44 0.59 -0.24 -0.53 0.08 0.16 -4.81 117.98 110.78 3g2m s PHE 132 Ca 0.33 -0.46 0.23 0.00 0.12 0.00 0.00 56.93 57.15 3g2m s PHE 132 Cb -0.04 -0.36 0.51 0.00 -0.57 0.00 0.00 43.02 42.56 3g2m s PHE 132 CO 0.19 -0.09 1.66 0.78 -0.10 0.00 0.00 175.22 177.66 3g2m h GLY 133 N 4.67 0.00 -6.44 4.36 0.00 -1.86 -0.05 103.07 103.75 3g2m h GLY 133 Ca -0.34 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 46.70 3g2m h GLY 133 CO 0.42 0.00 -0.69 -1.59 0.00 0.00 0.00 176.54 174.67 3g2m s THR 134 N -3.28 -0.06 -0.07 4.70 2.01 -1.26 -0.63 115.64 117.06 3g2m s THR 134 Ca 0.05 0.21 0.03 0.00 0.31 0.00 0.00 61.69 62.29 3g2m s THR 134 Cb 0.07 -0.13 0.01 0.00 0.01 0.00 0.00 72.50 72.46 3g2m s THR 134 CO 0.66 0.08 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.83 3g2m s VAL 135 N 1.10 1.37 0.07 3.82 1.01 0.02 -1.19 120.40 126.60 3g2m s VAL 135 Ca -0.09 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.33 3g2m s VAL 135 Cb -0.13 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 3g2m s VAL 135 CO -0.04 0.41 -0.20 0.68 0.00 0.00 0.00 175.10 175.95 3g2m s VAL 136 N 0.47 1.61 -0.06 2.92 -7.23 0.03 -0.21 120.40 117.93 3g2m s VAL 136 Ca -0.13 -1.34 -0.05 0.00 -1.81 0.00 0.00 61.98 58.65 3g2m s VAL 136 Cb -0.15 -1.44 0.02 0.00 0.56 0.00 0.00 36.38 35.37 3g2m s VAL 136 CO 0.04 0.05 0.16 -0.51 -0.31 0.00 0.00 175.10 174.53 3g2m s ILE 137 N -0.99 -0.00 0.27 -0.62 2.07 -0.59 -1.35 121.20 119.99 3g2m s ILE 137 Ca 0.06 0.01 -0.09 0.00 -1.41 0.00 0.00 60.65 59.22 3g2m s ILE 137 Cb -0.09 -0.23 -0.07 0.00 0.13 0.00 0.00 42.46 42.21 3g2m s ILE 137 CO 0.03 0.00 0.58 -0.55 -1.91 0.00 0.00 174.94 173.09 3g2m s SER 138 N 0.15 6.57 0.24 4.50 0.15 -1.26 -2.10 113.70 121.95 3g2m s SER 138 Ca -0.01 0.90 -0.08 0.00 0.70 0.00 0.00 55.95 57.46 3g2m s SER 138 Cb -0.02 -2.22 0.41 0.00 -1.71 0.00 0.00 66.02 62.48 3g2m s SER 138 CO -0.00 -0.14 1.63 -1.28 1.20 0.00 0.00 173.24 174.65 3g2m h SER 139 N 2.17 -0.39 -0.79 5.45 0.87 -1.64 -1.69 113.55 117.54 3g2m h SER 139 Ca -0.47 0.20 0.07 0.00 -1.23 0.00 0.00 61.79 60.36 3g2m h SER 139 Cb 1.18 0.36 -0.05 0.00 -0.44 0.00 0.00 62.40 63.44 3g2m h SER 139 CO 0.68 -0.19 0.52 1.23 -0.53 0.00 0.00 176.83 178.54 3g2m h GLY 140 N 0.09 1.08 0.23 5.77 0.00 -1.95 -2.41 103.07 105.89 3g2m h GLY 140 Ca 0.40 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 3g2m h GLY 140 CO -0.67 0.23 -0.02 1.76 0.00 0.00 0.00 176.54 177.85 3g2m h SER 141 N 0.83 -0.04 -0.52 0.19 0.02 -1.68 -3.16 113.55 109.19 3g2m h SER 141 Ca 0.35 -0.66 -0.03 0.00 -0.84 0.00 0.00 61.79 60.61 3g2m h SER 141 Cb 0.28 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 3g2m h SER 141 CO -0.12 0.69 0.23 -0.29 -1.14 0.00 0.00 176.83 176.19 3g2m h ILE 142 N -0.81 1.20 0.00 3.27 2.10 -1.47 -2.01 117.51 119.79 3g2m h ILE 142 Ca -0.00 -0.61 0.00 0.00 1.08 0.00 0.00 64.86 65.32 3g2m h ILE 142 Cb 0.69 0.52 0.00 0.00 -1.09 0.00 0.00 36.82 36.95 3g2m h ILE 142 CO 0.01 0.24 0.00 0.59 -1.08 0.00 0.00 178.15 177.91 3g2m n ASN 143 N -4.34 0.53 0.01 2.19 3.02 -0.91 -1.58 115.26 114.19 3g2m n ASN 143 Ca 0.05 0.66 0.12 0.00 -0.03 0.00 0.00 54.58 55.39 3g2m n ASN 143 Cb 0.16 -0.76 0.53 0.00 -0.61 0.00 0.00 39.78 39.09 3g2m n ASN 143 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3g2m n GLU 144 N -2.12 0.03 -3.86 3.52 1.02 -0.75 -4.48 120.64 114.00 3g2m n GLU 144 Ca 0.01 0.08 -0.36 0.00 -0.02 0.00 0.00 57.16 56.88 3g2m n GLU 144 Cb 0.16 -1.54 -0.07 0.00 -0.02 0.00 0.00 31.44 29.96 3g2m n GLU 144 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3g2m s LEU 145 N -3.19 4.22 1.15 -4.62 1.43 -0.61 -5.10 118.68 111.96 3g2m s LEU 145 Ca 0.12 0.32 -0.19 0.00 -1.03 0.00 0.00 54.13 53.35 3g2m s LEU 145 Cb 0.16 -2.05 0.28 0.00 0.03 0.00 0.00 46.19 44.60 3g2m s LEU 145 CO 0.48 0.29 1.21 1.51 0.23 0.00 0.00 176.35 180.07 3g2m s ASP 146 N -0.34 1.45 0.15 2.29 1.47 -1.26 -4.68 116.67 115.75 3g2m s ASP 146 Ca 0.11 0.37 -0.16 0.00 1.18 0.00 0.00 52.55 54.04 3g2m s ASP 146 Cb -0.12 -0.43 0.03 0.00 -0.34 0.00 0.00 42.92 42.06 3g2m s ASP 146 CO 0.01 -3.77 1.79 -0.08 0.68 0.00 0.00 175.17 173.80 3g2m h GLU 147 N -2.35 0.42 -0.65 2.11 4.81 -1.99 -0.55 114.58 116.38 3g2m h GLU 147 Ca -0.43 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 58.69 3g2m h GLU 147 Cb 1.26 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 3g2m h GLU 147 CO 0.30 0.27 0.06 0.00 -0.73 0.00 0.00 179.01 178.91 3g2m h ALA 148 N 1.17 0.87 -0.16 2.92 0.00 -2.00 -2.33 119.26 119.74 3g2m h ALA 148 Ca 0.15 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 3g2m h ALA 148 Cb 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3g2m h ALA 148 CO -0.08 0.67 -0.49 -0.44 0.00 0.00 0.00 179.25 178.91 3g2m h ASP 149 N 1.02 0.46 -0.89 0.00 3.32 -1.85 -2.36 116.42 116.12 3g2m h ASP 149 Ca 0.19 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 3g2m h ASP 149 Cb 0.50 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 3g2m h ASP 149 CO 0.02 0.88 0.55 0.03 -1.72 0.00 0.00 179.24 179.00 3g2m h ARG 150 N 0.34 1.21 -0.65 3.56 3.08 -0.92 -0.22 114.38 120.77 3g2m h ARG 150 Ca 0.02 -0.11 0.08 0.00 0.07 0.00 0.00 59.98 60.04 3g2m h ARG 150 Cb 0.99 -0.26 -0.07 0.00 0.08 0.00 0.00 29.97 30.72 3g2m h ARG 150 CO 0.09 0.84 0.32 0.00 -1.07 0.00 0.00 179.97 180.14 3g2m h ARG 151 N 1.23 0.54 -0.77 0.04 3.08 -1.09 -0.14 114.38 117.27 3g2m h ARG 151 Ca 0.32 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.29 3g2m h ARG 151 Cb -0.06 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.83 3g2m h ARG 151 CO -0.06 0.36 0.29 0.78 -1.07 0.00 0.00 179.97 180.27 3g2m h GLY 152 N 0.56 1.25 0.74 0.04 0.00 -0.93 -2.25 103.07 102.47 3g2m h GLY 152 Ca 0.32 -0.69 0.01 0.00 0.00 0.00 0.00 47.33 46.97 3g2m h GLY 152 CO -0.25 0.65 -0.13 -2.00 0.00 0.00 0.00 176.54 174.81 3g2m h LEU 153 N 1.13 -0.37 -0.61 3.11 5.85 -0.47 -1.10 115.31 122.86 3g2m h LEU 153 Ca 0.25 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 3g2m h LEU 153 Cb 0.24 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 3g2m h LEU 153 CO -0.02 -0.19 0.37 1.88 -0.34 0.00 0.00 178.44 180.14 3g2m h TYR 154 N -0.25 0.79 -0.35 1.25 0.05 -0.86 -0.33 116.97 117.27 3g2m h TYR 154 Ca 0.03 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.74 3g2m h TYR 154 Cb 0.28 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.75 3g2m h TYR 154 CO -0.16 0.53 -0.04 0.00 -1.05 0.00 0.00 178.16 177.44 3g2m h ALA 155 N 1.19 0.47 -0.23 3.88 0.00 -1.41 -2.29 119.26 120.88 3g2m h ALA 155 Ca 0.22 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3g2m h ALA 155 Cb -0.04 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3g2m h ALA 155 CO -0.04 0.28 0.05 0.77 0.00 0.00 0.00 179.25 180.30 3g2m h SER 156 N 0.44 0.02 -0.25 0.00 0.02 -0.90 -2.42 113.55 110.46 3g2m h SER 156 Ca 0.09 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.12 3g2m h SER 156 Cb 0.52 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.07 3g2m h SER 156 CO 0.03 0.04 0.02 0.58 -1.14 0.00 0.00 176.83 176.36 3g2m h VAL 157 N 0.14 0.84 -0.73 2.27 2.07 -1.02 -2.06 116.25 117.77 3g2m h VAL 157 Ca 0.10 -0.03 0.16 0.00 0.82 0.00 0.00 66.70 67.75 3g2m h VAL 157 Cb 0.10 0.73 -0.12 0.00 -1.52 0.00 0.00 31.29 30.48 3g2m h VAL 157 CO -0.13 0.02 0.03 -0.09 0.02 0.00 0.00 177.57 177.41 3g2m h ARG 158 N 0.10 0.12 0.00 1.57 2.43 -1.17 0.09 114.38 117.52 3g2m h ARG 158 Ca 0.12 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3g2m h ARG 158 Cb 0.14 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3g2m h ARG 158 CO -0.19 0.08 0.00 0.39 -1.51 0.00 0.00 179.97 178.74 3g2m n GLU 159 N -5.31 0.13 -0.01 0.20 -0.58 -0.80 -2.77 120.64 111.50 3g2m n GLU 159 Ca 0.13 0.42 0.05 0.00 -0.42 0.00 0.00 57.16 57.33 3g2m n GLU 159 Cb 0.45 -1.77 0.05 0.00 -0.57 0.00 0.00 31.44 29.59 3g2m n GLU 159 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 3g2m n HIS 160 N -2.02 0.03 -3.18 -0.32 8.25 -0.03 -4.92 115.22 113.03 3g2m n HIS 160 Ca 0.02 -0.04 -0.39 0.00 -0.26 0.00 0.00 57.72 57.05 3g2m n HIS 160 Cb 0.17 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.23 3g2m n HIS 160 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3g2m s LEU 161 N -0.78 4.36 0.72 2.41 1.43 -0.89 0.35 118.68 126.28 3g2m s LEU 161 Ca 0.11 1.10 -0.12 0.00 -1.03 0.00 0.00 54.13 54.19 3g2m s LEU 161 Cb 0.08 -2.93 0.03 0.00 0.03 0.00 0.00 46.19 43.40 3g2m s LEU 161 CO 0.12 0.01 1.09 -1.61 0.23 0.00 0.00 176.35 176.19 3g2m s GLU 162 N 0.28 2.55 -0.00 1.70 2.02 -0.03 -4.75 118.70 120.47 3g2m s GLU 162 Ca 0.32 1.20 -0.38 0.00 0.02 0.00 0.00 54.97 56.14 3g2m s GLU 162 Cb -0.17 -1.93 -0.17 0.00 0.10 0.00 0.00 34.13 31.96 3g2m s GLU 162 CO 0.16 -1.42 1.43 -0.35 0.02 0.00 0.00 175.26 175.10 3g2m n PRO 163 N -3.08 1.13 -0.94 0.39 -0.04 -1.26 -0.37 135.00 130.83 3g2m n PRO 163 Ca 0.09 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 3g2m n PRO 163 Cb 0.53 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 3g2m n PRO 163 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g2m n GLY 164 N 2.90 1.09 3.76 0.55 0.00 -1.26 -5.02 105.19 107.20 3g2m n GLY 164 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 3g2m n GLY 164 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g2m s GLY 165 N -2.00 2.29 0.04 -0.02 0.00 0.50 -5.04 107.32 103.08 3g2m s GLY 165 Ca 0.00 0.68 0.08 0.00 0.00 0.00 0.00 44.72 45.48 3g2m s GLY 165 CO 0.00 1.05 -0.21 -1.59 0.00 0.00 0.00 173.10 172.34 3g2m s LYS 166 N -3.91 1.96 -0.30 2.90 -2.85 0.20 -4.71 119.74 113.04 3g2m s LYS 166 Ca 0.70 -1.03 -0.09 0.00 -1.00 0.00 0.00 55.97 54.55 3g2m s LYS 166 Cb -0.23 -2.10 -0.01 0.00 -2.06 0.00 0.00 37.83 33.42 3g2m s LYS 166 CO 0.40 0.53 0.12 0.12 0.10 0.00 0.00 175.35 176.62 3g2m s PHE 167 N -0.88 3.15 -0.12 1.78 5.36 0.01 -0.80 117.98 126.48 3g2m s PHE 167 Ca 0.13 -0.63 -0.01 0.00 -0.96 0.00 0.00 56.93 55.46 3g2m s PHE 167 Cb -0.10 -2.31 -0.03 0.00 -0.34 0.00 0.00 43.02 40.24 3g2m s PHE 167 CO 0.04 -0.46 -0.07 -0.51 -1.46 0.00 0.00 175.22 172.76 3g2m s LEU 168 N 1.59 3.10 -0.01 6.12 2.01 0.71 -1.03 118.68 131.16 3g2m s LEU 168 Ca 0.04 -0.14 0.04 0.00 0.01 0.00 0.00 54.13 54.08 3g2m s LEU 168 Cb -0.17 -1.71 -0.01 0.00 0.01 0.00 0.00 46.19 44.31 3g2m s LEU 168 CO 0.05 0.23 -0.13 -0.76 1.01 0.00 0.00 176.35 176.74 3g2m s LEU 169 N 0.00 2.01 -0.02 1.79 1.02 -0.50 -1.54 118.68 121.44 3g2m s LEU 169 Ca -0.01 -0.24 -0.03 0.00 0.02 0.00 0.00 54.13 53.87 3g2m s LEU 169 Cb -0.14 -0.69 -0.04 0.00 0.02 0.00 0.00 46.19 45.34 3g2m s LEU 169 CO 0.03 0.16 0.18 -0.94 0.02 0.00 0.00 176.35 175.80 3g2m s SER 170 N -0.28 6.36 -0.08 2.29 1.04 -0.89 -0.33 113.70 121.82 3g2m s SER 170 Ca 0.04 0.36 -0.03 0.00 0.48 0.00 0.00 55.95 56.80 3g2m s SER 170 Cb -0.06 -2.01 0.05 0.00 0.10 0.00 0.00 66.02 64.10 3g2m s SER 170 CO -0.00 0.28 0.16 -0.76 0.98 0.00 0.00 173.24 173.90 3g2m s LEU 171 N -1.81 0.10 0.00 2.42 1.43 -0.24 -1.44 118.68 119.14 3g2m s LEU 171 Ca 0.26 0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 3g2m s LEU 171 Cb -0.13 0.29 0.00 0.00 0.03 0.00 0.00 46.19 46.39 3g2m s LEU 171 CO 0.17 -0.22 0.00 0.00 0.23 0.00 0.00 176.35 176.52 3g2m n ALA 172 N 5.07 0.00 -2.80 4.21 0.00 -1.26 -0.42 120.51 125.31 3g2m n ALA 172 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.24 3g2m n ALA 172 Cb 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 3g2m n ALA 172 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3g2m s SER 174 N -1.89 0.01 0.19 0.00 1.04 -1.26 -4.42 113.70 107.37 3g2m s SER 174 Ca 0.00 -1.06 -0.12 0.00 0.48 0.00 0.00 55.95 55.26 3g2m s SER 174 Cb 0.00 0.50 0.16 0.00 0.10 0.00 0.00 66.02 66.77 3g2m s SER 174 CO 0.00 -1.01 1.82 -0.08 0.98 0.00 0.00 173.24 174.95 3g2m h GLU 175 N 2.42 0.66 -0.49 4.02 4.81 -1.98 0.31 114.58 124.32 3g2m h GLU 175 Ca -0.30 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 58.83 3g2m h GLU 175 Cb 1.25 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.45 3g2m h GLU 175 CO 0.43 0.44 0.07 0.00 -0.73 0.00 0.00 179.01 179.22 3g2m h ALA 176 N 1.28 1.21 -0.07 2.92 0.00 -2.04 -1.32 119.26 121.24 3g2m h ALA 176 Ca 0.25 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 3g2m h ALA 176 Cb 0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3g2m h ALA 176 CO -0.12 0.53 -0.59 0.00 0.00 0.00 0.00 179.25 179.07 3g2m h ALA 177 N 1.34 0.87 -0.03 0.00 0.00 -1.88 -3.25 119.26 116.31 3g2m h ALA 177 Ca 0.16 -0.53 -0.23 0.00 0.00 0.00 0.00 54.91 54.30 3g2m h ALA 177 Cb 0.35 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.06 3g2m h ALA 177 CO 0.01 0.72 -0.92 1.49 0.00 0.00 0.00 179.25 180.54 3g2m h GLU 178 N 0.18 0.53 -6.98 0.00 4.81 -0.56 -3.47 114.58 109.10 3g2m h GLU 178 Ca -0.00 -0.53 -0.52 0.00 -0.13 0.00 0.00 59.36 58.17 3g2m h GLU 178 Cb 1.09 0.14 0.07 0.00 0.63 0.00 0.00 28.75 30.68 3g2m h GLU 178 CO 0.09 1.16 0.53 -1.12 -0.73 0.00 0.00 179.01 178.95 3g2m s SER 179 N -7.13 6.15 0.02 1.04 0.01 -0.53 -4.99 113.70 108.28 3g2m s SER 179 Ca -0.07 2.45 -0.30 0.00 1.31 0.00 0.00 55.95 59.33 3g2m s SER 179 Cb 0.08 -2.62 -0.06 0.00 0.21 0.00 0.00 66.02 63.63 3g2m s SER 179 CO 0.88 -0.94 1.49 -1.61 0.41 0.00 0.00 173.24 173.47 3g2m s GLU 180 N -2.54 4.25 0.38 12.44 0.41 -1.26 -4.98 118.70 127.40 3g2m s GLU 180 Ca 0.62 2.09 -0.27 0.00 -0.41 0.00 0.00 54.97 56.99 3g2m s GLU 180 Cb -0.33 -3.58 -0.11 0.00 -1.78 0.00 0.00 34.13 28.33 3g2m s GLU 180 CO 0.40 -0.63 1.39 -0.35 -0.49 0.00 0.00 175.26 175.59 3g2m n PRO 181 N 5.46 2.37 -2.41 0.39 -0.04 -1.26 -4.93 135.00 134.58 3g2m n PRO 181 Ca 0.14 0.83 -0.43 0.00 -0.04 0.00 0.00 63.50 64.00 3g2m n PRO 181 Cb 0.43 -2.53 -0.02 0.00 -0.04 0.00 0.00 33.50 31.34 3g2m n PRO 181 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3g2m s LEU 182 N -1.78 3.80 -0.14 1.53 2.01 -1.26 -4.95 118.68 117.89 3g2m s LEU 182 Ca 0.56 1.09 -0.25 0.00 0.01 0.00 0.00 54.13 55.54 3g2m s LEU 182 Cb -0.50 -3.54 -0.02 0.00 0.01 0.00 0.00 46.19 42.13 3g2m s LEU 182 CO 0.62 -1.17 0.79 -0.70 1.01 0.00 0.00 176.35 176.90 3g2m s GLU 183 N 4.35 4.33 0.00 1.70 2.12 -1.26 -4.54 118.70 125.41 3g2m s GLU 183 Ca 0.57 0.96 0.08 0.00 0.36 0.00 0.00 54.97 56.94 3g2m s GLU 183 Cb -0.16 -3.54 0.22 0.00 0.26 0.00 0.00 34.13 30.91 3g2m s GLU 183 CO 0.26 -0.22 1.18 2.89 -0.54 0.00 0.00 175.26 178.82 3g2m n ARG 184 N 4.84 2.90 -0.36 4.30 -4.01 -0.83 -4.98 116.66 118.52 3g2m n ARG 184 Ca 0.03 -1.89 0.00 0.00 -1.04 0.00 0.00 57.85 54.95 3g2m n ARG 184 Cb 0.50 -1.19 0.00 0.00 -3.04 0.00 0.00 32.46 28.72 3g2m n ARG 184 CO 0.00 0.00 0.00 1.28 -3.04 0.00 0.00 177.63 175.87 3g2m n LEU 198 N 0.22 0.00 -4.30 2.89 4.32 -1.26 -2.41 117.00 116.46 3g2m n LEU 198 Ca 0.08 0.20 -0.31 0.00 -0.02 0.00 0.00 56.01 55.96 3g2m n LEU 198 Cb 0.37 -0.39 -0.16 0.00 -1.62 0.00 0.00 43.42 41.62 3g2m n LEU 198 CO 0.06 0.00 -0.56 -1.00 -1.22 0.00 0.00 177.39 174.66 3g2m s HIS 199 N -0.38 2.37 -0.08 -1.77 3.76 -1.26 -5.13 115.29 112.80 3g2m s HIS 199 Ca 0.00 -0.51 0.03 0.00 -0.15 0.00 0.00 55.06 54.43 3g2m s HIS 199 Cb 0.00 -1.53 0.01 0.00 1.11 0.00 0.00 32.58 32.16 3g2m s HIS 199 CO 0.00 -0.08 -0.18 0.08 -0.85 0.00 0.00 174.74 173.71 3g2m s VAL 200 N -0.49 1.57 0.09 -0.90 1.01 -1.01 -5.13 120.40 115.53 3g2m s VAL 200 Ca 0.06 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.37 3g2m s VAL 200 Cb -0.11 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 3g2m s VAL 200 CO 0.00 0.45 -0.18 -0.13 0.00 0.00 0.00 175.10 175.25 3g2m s ARG 201 N 0.51 0.98 -0.27 2.72 0.52 -1.26 -1.96 118.95 120.18 3g2m s ARG 201 Ca -0.17 -1.05 -0.02 0.00 -0.52 0.00 0.00 55.73 53.97 3g2m s ARG 201 Cb -0.17 -1.11 0.03 0.00 0.52 0.00 0.00 34.95 34.22 3g2m s ARG 201 CO 0.06 0.25 -0.03 -1.01 0.02 0.00 0.00 175.30 174.60 3g2m s HIS 202 N -1.20 3.15 -0.05 -0.53 3.76 -1.26 -5.09 115.29 114.06 3g2m s HIS 202 Ca 0.02 -1.63 -0.12 0.00 -0.15 0.00 0.00 55.06 53.18 3g2m s HIS 202 Cb -0.10 -2.09 -0.05 0.00 1.11 0.00 0.00 32.58 31.45 3g2m s HIS 202 CO 0.03 -0.75 0.32 -0.51 -0.85 0.00 0.00 174.74 172.98 3g2m s LEU 203 N 1.31 4.43 0.36 0.89 1.43 -1.26 -4.74 118.68 121.10 3g2m s LEU 203 Ca -0.02 0.77 -0.27 0.00 -1.03 0.00 0.00 54.13 53.58 3g2m s LEU 203 Cb -0.18 -2.41 -0.09 0.00 0.03 0.00 0.00 46.19 43.54 3g2m s LEU 203 CO -0.03 0.33 1.26 -2.84 0.23 0.00 0.00 176.35 175.30 3g2m s PRO 204 N -0.93 4.21 0.07 1.29 0.02 -1.26 -4.92 135.00 133.48 3g2m s PRO 204 Ca 0.20 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.31 3g2m s PRO 204 Cb -0.15 -2.91 0.00 0.00 0.02 0.00 0.00 34.50 31.46 3g2m s PRO 204 CO 0.10 -0.27 0.00 0.00 -0.33 0.00 0.00 177.00 176.50 3g2m n ALA 205 N 0.49 3.00 -3.22 -1.55 0.00 -1.26 -4.58 120.51 113.39 3g2m n ALA 205 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.33 3g2m n ALA 205 Cb 0.44 0.25 -0.13 0.00 0.00 0.00 0.00 19.45 20.01 3g2m n ALA 205 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3g2m s GLU 206 N -2.00 0.19 0.42 0.00 2.12 -1.26 -1.55 118.70 116.62 3g2m s GLU 206 Ca 0.00 0.30 0.04 0.00 0.36 0.00 0.00 54.97 55.67 3g2m s GLU 206 Cb 0.00 0.04 -0.05 0.00 0.26 0.00 0.00 34.13 34.38 3g2m s GLU 206 CO 0.00 -0.06 0.04 -1.21 -0.54 0.00 0.00 175.26 173.49 3g2m s GLU 207 N 0.36 1.95 -0.16 4.30 2.02 0.83 -4.98 118.70 123.02 3g2m s GLU 207 Ca -0.02 -2.16 -0.01 0.00 0.02 0.00 0.00 54.97 52.79 3g2m s GLU 207 Cb -0.04 -1.26 -0.01 0.00 0.10 0.00 0.00 34.13 32.92 3g2m s GLU 207 CO -0.02 -0.24 -0.11 0.42 0.02 0.00 0.00 175.26 175.33 3g2m s ILE 208 N -2.97 3.05 -0.25 -1.63 1.01 -1.26 -0.67 121.20 118.46 3g2m s ILE 208 Ca 0.25 -0.64 -0.23 0.00 0.00 0.00 0.00 60.65 60.03 3g2m s ILE 208 Cb 0.06 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 40.21 3g2m s ILE 208 CO 0.13 0.49 0.76 -1.58 0.00 0.00 0.00 174.94 174.74 3g2m s GLN 209 N 0.80 4.13 -0.16 2.79 0.74 0.75 -4.91 119.66 123.81 3g2m s GLN 209 Ca -0.04 0.78 -0.01 0.00 0.05 0.00 0.00 55.36 56.14 3g2m s GLN 209 Cb -0.15 -3.66 -0.01 0.00 1.10 0.00 0.00 33.01 30.30 3g2m s GLN 209 CO 0.01 -0.51 -0.13 -2.00 -0.55 0.00 0.00 175.29 172.12 3g2m s GLU 210 N 2.75 3.30 0.02 1.67 2.12 -1.26 -1.41 118.70 125.89 3g2m s GLU 210 Ca 0.32 -0.71 0.08 0.00 0.36 0.00 0.00 54.97 55.02 3g2m s GLU 210 Cb -0.15 -2.70 -0.03 0.00 0.26 0.00 0.00 34.13 31.51 3g2m s GLU 210 CO 0.08 0.03 -0.23 0.96 -0.54 0.00 0.00 175.26 175.56 3g2m s ILE 211 N 0.81 2.34 -0.15 -3.70 -4.36 -0.73 -5.00 121.20 110.42 3g2m s ILE 211 Ca -0.04 -1.23 -0.00 0.00 -0.26 0.00 0.00 60.65 59.11 3g2m s ILE 211 Cb -0.15 -1.91 0.03 0.00 1.25 0.00 0.00 42.46 41.68 3g2m s ILE 211 CO 0.00 0.42 -0.06 -0.89 0.24 0.00 0.00 174.94 174.66 3g2m s THR 212 N -0.78 1.09 -0.07 8.37 2.01 -1.26 -2.13 115.64 122.86 3g2m s THR 212 Ca 0.12 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 61.66 3g2m s THR 212 Cb -0.10 -1.20 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 3g2m s THR 212 CO 0.02 0.22 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.35 3g2m s ILE 213 N 1.66 2.51 0.07 1.82 1.01 0.10 -4.97 121.20 123.41 3g2m s ILE 213 Ca 0.02 -0.89 -0.13 0.00 0.00 0.00 0.00 60.65 59.65 3g2m s ILE 213 Cb -0.14 -1.97 0.02 0.00 0.01 0.00 0.00 42.46 40.38 3g2m s ILE 213 CO -0.08 0.56 0.29 -1.38 0.00 0.00 0.00 174.94 174.33 3g2m s HIS 214 N -0.16 -0.05 0.48 3.97 -3.43 -1.26 -0.06 115.29 114.78 3g2m s HIS 214 Ca -0.02 -0.20 -0.23 0.00 -0.80 0.00 0.00 55.06 53.81 3g2m s HIS 214 Cb -0.14 0.08 -0.07 0.00 -1.43 0.00 0.00 32.58 31.03 3g2m s HIS 214 CO 0.04 -0.55 1.23 -1.25 -2.00 0.00 0.00 174.74 172.21 3g2m s PRO 215 N -3.14 3.59 0.50 -0.38 0.04 -1.26 -4.93 135.00 129.42 3g2m s PRO 215 Ca -0.01 1.94 0.29 0.00 0.04 0.00 0.00 61.00 63.25 3g2m s PRO 215 Cb 0.01 -2.39 1.15 0.00 0.04 0.00 0.00 34.50 33.31 3g2m s PRO 215 CO -0.07 -0.73 1.91 0.00 0.04 0.00 0.00 177.00 178.15 3g2m h ALA 216 N 1.93 1.03 -0.18 8.56 0.00 -2.01 -3.35 119.26 125.23 3g2m h ALA 216 Ca -0.50 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.31 3g2m h ALA 216 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3g2m h ALA 216 CO 0.59 0.14 0.00 -3.47 0.00 0.00 0.00 179.25 176.52 3g2m n ASP 217 N -3.27 0.00 -1.25 0.00 4.64 -1.26 -5.29 116.55 110.12 3g2m n ASP 217 Ca 0.00 0.89 0.00 0.00 -1.38 0.00 0.00 54.79 54.30 3g2m n ASP 217 Cb 0.36 -0.47 0.00 0.00 -1.04 0.00 0.00 41.12 39.97 3g2m n ASP 217 CO 0.00 0.00 0.00 -1.84 -0.82 0.00 0.00 177.20 174.54 3g2m n GLU 218 N -1.91 0.00 -3.15 -0.67 -0.00 -1.26 -5.28 120.64 108.37 3g2m n GLU 218 Ca 0.00 0.42 0.06 0.00 -0.00 0.00 0.00 57.16 57.64 3g2m n GLU 218 Cb 0.00 -1.25 -0.01 0.00 -0.00 0.00 0.00 31.44 30.17 3g2m n GLU 218 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3g2m s ASP 221 N -1.28 -0.14 0.45 -1.84 -1.08 -1.26 -5.03 116.67 106.49 3g2m s ASP 221 Ca 0.00 0.05 -0.23 0.00 -0.52 0.00 0.00 52.55 51.85 3g2m s ASP 221 Cb 0.00 1.10 -0.08 0.00 -1.46 0.00 0.00 42.92 42.49 3g2m s ASP 221 CO 0.00 -0.03 1.14 -2.16 0.52 0.00 0.00 175.17 174.65 3g2m s PRO 222 N 2.99 3.83 -0.60 4.34 0.04 -1.26 -5.12 135.00 139.21 3g2m s PRO 222 Ca 0.10 1.73 -0.16 0.00 0.04 0.00 0.00 61.00 62.70 3g2m s PRO 222 Cb -0.05 -2.42 0.15 0.00 0.04 0.00 0.00 34.50 32.22 3g2m s PRO 222 CO -0.14 -0.48 0.57 0.12 0.04 0.00 0.00 177.00 177.10 3g2m s PHE 223 N -1.57 3.34 -0.24 0.56 5.36 -1.26 -5.02 117.98 119.15 3g2m s PHE 223 Ca 0.63 -1.41 -0.17 0.00 -0.96 0.00 0.00 56.93 55.01 3g2m s PHE 223 Cb -0.27 -3.82 -0.03 0.00 -0.34 0.00 0.00 43.02 38.56 3g2m s PHE 223 CO 0.33 -1.03 0.48 0.14 -1.46 0.00 0.00 175.22 173.68 3g2m s VAL 224 N 1.38 5.11 -0.30 3.12 -7.23 -1.26 -1.10 120.40 120.13 3g2m s VAL 224 Ca 0.07 0.84 -0.09 0.00 -1.81 0.00 0.00 61.98 60.98 3g2m s VAL 224 Cb -0.26 -3.80 -0.01 0.00 0.56 0.00 0.00 36.38 32.87 3g2m s VAL 224 CO 0.01 0.14 0.13 -0.69 -0.31 0.00 0.00 175.10 174.38 3g2m s VAL 225 N 1.97 4.51 -0.21 1.32 1.01 0.38 -4.37 120.40 125.01 3g2m s VAL 225 Ca 0.21 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.73 3g2m s VAL 225 Cb -0.15 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 3g2m s VAL 225 CO 0.09 0.13 0.11 0.00 0.00 0.00 0.00 175.10 175.43 3g2m s THR 227 N 0.73 1.88 -0.13 0.00 -4.23 -0.13 0.03 115.64 113.80 3g2m s THR 227 Ca 0.06 -2.11 -0.30 0.00 -1.18 0.00 0.00 61.69 58.16 3g2m s THR 227 Cb -0.13 -2.00 0.09 0.00 1.34 0.00 0.00 72.50 71.81 3g2m s THR 227 CO 0.02 -0.45 0.80 -2.28 -0.54 0.00 0.00 174.62 172.17 3g2m s HIS 228 N -2.50 -0.58 -0.07 3.99 2.46 -0.91 -1.26 115.29 116.41 3g2m s HIS 228 Ca 0.21 1.09 0.03 0.00 0.47 0.00 0.00 55.06 56.86 3g2m s HIS 228 Cb -0.04 0.40 0.00 0.00 -0.13 0.00 0.00 32.58 32.82 3g2m s HIS 228 CO 0.08 -0.48 -0.18 1.03 -2.47 0.00 0.00 174.74 172.72 3g2m s ARG 229 N -0.86 2.23 0.05 2.88 0.52 -1.26 -1.77 118.95 120.73 3g2m s ARG 229 Ca -0.06 -0.64 -0.05 0.00 -0.52 0.00 0.00 55.73 54.47 3g2m s ARG 229 Cb -0.01 -1.78 -0.02 0.00 0.52 0.00 0.00 34.95 33.66 3g2m s ARG 229 CO 0.05 0.14 0.07 -0.98 0.02 0.00 0.00 175.30 174.61 3g2m s ARG 230 N 0.39 0.61 0.29 3.54 1.70 -0.50 -4.98 118.95 120.01 3g2m s ARG 230 Ca -0.14 -0.88 -0.29 0.00 -0.47 0.00 0.00 55.73 53.95 3g2m s ARG 230 Cb -0.16 0.23 -0.11 0.00 -0.57 0.00 0.00 34.95 34.35 3g2m s ARG 230 CO 0.05 -0.15 1.47 0.50 -1.08 0.00 0.00 175.30 176.09 3g2m s ARG 231 N -3.01 4.22 -0.25 3.89 3.52 -1.26 -0.18 118.95 125.88 3g2m s ARG 231 Ca -0.02 2.40 -0.02 0.00 -0.13 0.00 0.00 55.73 57.97 3g2m s ARG 231 Cb 0.01 -3.06 0.08 0.00 -1.56 0.00 0.00 34.95 30.42 3g2m s ARG 231 CO -0.06 -0.46 0.06 -1.17 -0.81 0.00 0.00 175.30 172.86 3g2m s LEU 232 N -0.92 1.68 0.21 -0.88 2.96 0.15 -4.73 118.68 117.15 3g2m s LEU 232 Ca 0.58 -1.22 -0.23 0.00 -0.22 0.00 0.00 54.13 53.03 3g2m s LEU 232 Cb -0.44 -0.73 -0.08 0.00 0.50 0.00 0.00 46.19 45.43 3g2m s LEU 232 CO 0.49 -0.35 0.79 -0.76 -1.32 0.00 0.00 176.35 175.20 3g2m s LEU 233 N 1.74 4.46 0.20 -0.68 1.43 -1.26 -0.12 118.68 124.46 3g2m s LEU 233 Ca 0.04 1.60 -0.30 0.00 -1.03 0.00 0.00 54.13 54.44 3g2m s LEU 233 Cb -0.17 -3.52 -0.09 0.00 0.03 0.00 0.00 46.19 42.43 3g2m s LEU 233 CO -0.17 0.10 1.38 0.00 0.23 0.00 0.00 176.35 177.89 3g2m s ALA 234 N -1.36 3.58 0.32 4.21 0.00 -0.60 -4.78 121.76 123.14 3g2m s ALA 234 Ca 0.41 1.20 0.09 0.00 0.00 0.00 0.00 51.96 53.66 3g2m s ALA 234 Cb -0.20 -3.52 0.84 0.00 0.00 0.00 0.00 23.12 20.24 3g2m s ALA 234 CO 0.24 -0.63 1.77 -1.35 0.00 0.00 0.00 175.76 175.78 3g2m h PRO 235 N 5.52 0.63 0.00 0.00 0.11 -1.90 -1.08 132.00 135.29 3g2m h PRO 235 Ca -0.45 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 3g2m h PRO 235 Cb 1.21 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3g2m h PRO 235 CO 0.79 0.42 -0.28 -0.44 -0.21 0.00 0.00 178.00 178.29 3g2m h ASP 236 N 0.65 0.00 -0.21 -2.05 3.32 -1.91 -1.20 116.42 115.03 3g2m h ASP 236 Ca 0.60 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.61 3g2m h ASP 236 Cb 1.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 3g2m h ASP 236 CO -0.39 0.28 -0.01 -0.61 -1.72 0.00 0.00 179.24 176.79 3g2m h GLN 237 N 0.00 0.37 -0.80 3.56 5.75 -1.45 -1.22 115.11 121.33 3g2m h GLN 237 Ca -0.00 -0.12 -0.02 0.00 -0.15 0.00 0.00 58.65 58.35 3g2m h GLN 237 Cb 0.49 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.97 3g2m h GLN 237 CO 0.04 0.57 0.40 0.28 -2.65 0.00 0.00 178.83 177.47 3g2m h VAL 238 N 0.12 1.25 -0.26 2.39 2.07 -1.25 -1.42 116.25 119.15 3g2m h VAL 238 Ca 0.06 -0.66 0.05 0.00 0.82 0.00 0.00 66.70 66.96 3g2m h VAL 238 Cb 0.41 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 3g2m h VAL 238 CO 0.01 0.29 -0.01 0.58 0.02 0.00 0.00 177.57 178.45 3g2m h VAL 239 N 1.12 0.80 -0.95 2.57 2.07 -1.15 0.75 116.25 121.46 3g2m h VAL 239 Ca 0.28 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.84 3g2m h VAL 239 Cb 0.09 0.73 -0.07 0.00 -1.52 0.00 0.00 31.29 30.52 3g2m h VAL 239 CO -0.04 0.01 0.60 0.03 0.02 0.00 0.00 177.57 178.20 3g2m h ARG 240 N 0.06 1.06 -0.41 1.57 3.08 -0.82 -1.49 114.38 117.43 3g2m h ARG 240 Ca 0.12 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.01 3g2m h ARG 240 Cb 0.17 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 3g2m h ARG 240 CO -0.22 0.70 -0.12 0.93 -1.07 0.00 0.00 179.97 180.19 3g2m h GLU 241 N 1.09 0.80 -0.32 0.04 5.08 -0.84 -1.36 114.58 119.07 3g2m h GLU 241 Ca 0.42 -0.32 0.03 0.00 -1.00 0.00 0.00 59.36 58.49 3g2m h GLU 241 Cb 0.19 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 3g2m h GLU 241 CO -0.18 0.94 0.13 -0.07 -1.00 0.00 0.00 179.01 178.83 3g2m h LEU 242 N 0.62 0.16 -0.05 1.33 3.38 -0.37 -0.92 115.31 119.46 3g2m h LEU 242 Ca 0.10 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.11 3g2m h LEU 242 Cb 0.65 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3g2m h LEU 242 CO 0.04 0.13 -0.02 0.58 0.09 0.00 0.00 178.44 179.26 3g2m h VAL 243 N 0.28 0.93 -0.86 1.22 2.07 -1.22 -1.72 116.25 116.94 3g2m h VAL 243 Ca 0.14 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.82 3g2m h VAL 243 Cb 0.09 0.93 -0.07 0.00 -1.52 0.00 0.00 31.29 30.73 3g2m h VAL 243 CO -0.13 0.00 0.56 -0.09 0.02 0.00 0.00 177.57 177.93 3g2m h ARG 244 N -0.02 0.55 0.00 1.57 2.43 -0.98 -0.71 114.38 117.22 3g2m h ARG 244 Ca 0.03 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3g2m h ARG 244 Cb 0.06 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3g2m h ARG 244 CO -0.06 0.36 0.00 -1.13 -1.51 0.00 0.00 179.97 177.64 3g2m n SER 245 N -4.54 0.00 0.00 -3.80 3.41 -0.37 -4.90 113.62 103.42 3g2m n SER 245 Ca 0.17 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 3g2m n SER 245 Cb 0.54 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 3g2m n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g2m n GLY 246 N 1.28 0.81 3.85 5.00 0.00 -0.27 -4.92 105.19 110.94 3g2m n GLY 246 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3g2m n GLY 246 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g2m s PHE 247 N -2.00 3.42 -0.28 1.61 0.08 -0.70 -4.33 117.98 115.78 3g2m s PHE 247 Ca 0.00 1.38 -0.12 0.00 0.12 0.00 0.00 56.93 58.30 3g2m s PHE 247 Cb 0.00 -2.70 -0.04 0.00 -0.57 0.00 0.00 43.02 39.71 3g2m s PHE 247 CO 0.00 -0.22 0.25 -0.51 -0.10 0.00 0.00 175.22 174.64 3g2m s ASP 248 N -2.86 6.09 -0.44 1.36 1.01 0.12 -3.98 116.67 117.97 3g2m s ASP 248 Ca 0.57 0.03 -0.24 0.00 0.71 0.00 0.00 52.55 53.62 3g2m s ASP 248 Cb -0.10 -2.15 0.02 0.00 1.01 0.00 0.00 42.92 41.71 3g2m s ASP 248 CO 0.27 -0.11 0.86 -0.69 0.21 0.00 0.00 175.17 175.71 3g2m s VAL 249 N 1.85 4.57 -0.77 -1.27 1.01 -1.26 -1.27 120.40 123.27 3g2m s VAL 249 Ca 0.09 0.71 0.20 0.00 0.00 0.00 0.00 61.98 62.97 3g2m s VAL 249 Cb -0.16 -4.36 -0.23 0.00 0.00 0.00 0.00 36.38 31.63 3g2m s VAL 249 CO 0.11 -0.71 0.77 2.30 0.00 0.00 0.00 175.10 177.56 3g2m n ILE 250 N 6.20 0.00 -3.60 2.22 -5.35 -0.02 -4.96 119.36 113.86 3g2m n ILE 250 Ca 0.05 -0.11 -0.13 0.00 -0.27 0.00 0.00 62.75 62.28 3g2m n ILE 250 Cb 0.48 0.83 -0.06 0.00 -1.74 0.00 0.00 39.64 39.15 3g2m n ILE 250 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3g2m s ALA 251 N -2.95 -1.87 -0.12 -1.28 0.00 -1.21 -4.99 121.76 109.34 3g2m s ALA 251 Ca 0.05 1.73 -0.02 0.00 0.00 0.00 0.00 51.96 53.71 3g2m s ALA 251 Cb 0.15 -0.88 0.04 0.00 0.00 0.00 0.00 23.12 22.43 3g2m s ALA 251 CO 0.81 -0.31 0.01 -0.65 0.00 0.00 0.00 175.76 175.62 3g2m s GLN 252 N -0.35 0.66 -0.26 0.00 -0.21 -1.26 -0.77 119.66 117.47 3g2m s GLN 252 Ca -0.02 -0.10 0.03 0.00 0.02 0.00 0.00 55.36 55.29 3g2m s GLN 252 Cb -0.03 -1.43 0.06 0.00 1.00 0.00 0.00 33.01 32.62 3g2m s GLN 252 CO 0.01 -0.43 -0.10 0.99 -2.12 0.00 0.00 175.29 173.64 3g2m s THR 253 N 1.92 2.17 0.47 -0.19 2.01 0.18 -4.92 115.64 117.27 3g2m s THR 253 Ca 0.03 -1.66 -0.23 0.00 0.31 0.00 0.00 61.69 60.14 3g2m s THR 253 Cb -0.14 -2.29 -0.07 0.00 0.01 0.00 0.00 72.50 70.01 3g2m s THR 253 CO -0.06 -0.05 1.23 -2.16 -0.69 0.00 0.00 174.62 172.89 3g2m s PRO 254 N 1.10 3.68 0.18 4.92 0.04 -1.26 -0.24 135.00 143.41 3g2m s PRO 254 Ca -0.08 1.95 -0.19 0.00 0.04 0.00 0.00 61.00 62.72 3g2m s PRO 254 Cb -0.20 -2.46 0.04 0.00 0.04 0.00 0.00 34.50 31.93 3g2m s PRO 254 CO -0.05 -0.67 0.54 -0.59 0.04 0.00 0.00 177.00 176.27 3g2m s PHE 255 N -1.43 -0.26 -0.16 0.56 -0.12 -1.26 -4.91 117.98 110.41 3g2m s PHE 255 Ca 0.64 -0.06 -0.18 0.00 -0.05 0.00 0.00 56.93 57.28 3g2m s PHE 255 Cb -0.33 0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 42.46 3g2m s PHE 255 CO 0.40 -0.88 0.47 0.00 -0.05 0.00 0.00 175.22 175.16 3g2m s ALA 256 N -3.83 3.52 0.29 1.99 0.00 -1.26 -1.55 121.76 120.91 3g2m s ALA 256 Ca 0.06 -0.33 0.22 0.00 0.00 0.00 0.00 51.96 51.91 3g2m s ALA 256 Cb -0.01 -2.70 1.04 0.00 0.00 0.00 0.00 23.12 21.45 3g2m s ALA 256 CO -0.07 -0.21 1.90 0.66 0.00 0.00 0.00 175.76 178.04 3g2m h SER 257 N 7.10 0.00 -0.45 0.00 4.64 -1.87 -2.53 113.55 120.44 3g2m h SER 257 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3g2m h SER 257 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3g2m h SER 257 CO 0.74 0.24 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 3g2m n GLY 258 N -0.26 1.68 3.49 -0.77 0.00 -1.26 -4.48 105.19 103.60 3g2m n GLY 258 Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.46 3g2m n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g2m n GLY 259 N 0.99 0.42 3.49 -0.02 0.00 -0.95 -4.89 105.19 104.21 3g2m n GLY 259 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 3g2m n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g2m s ALA 260 N -2.24 -1.73 0.00 4.61 0.00 -1.26 -4.98 121.76 116.15 3g2m s ALA 260 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 51.96 52.95 3g2m s ALA 260 Cb 0.00 0.32 0.00 0.00 0.00 0.00 0.00 23.12 23.44 3g2m s ALA 260 CO 0.00 -0.57 0.00 0.41 0.00 0.00 0.00 175.76 175.60 3g2m n GLY 261 N 0.21 -1.50 3.75 0.00 0.00 -1.26 -4.79 105.19 101.60 3g2m n GLY 261 Ca -0.15 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 3g2m n GLY 261 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3g2m s ARG 262 N 0.00 4.18 -0.21 1.61 3.52 -1.26 -4.82 118.95 121.98 3g2m s ARG 262 Ca 0.00 2.46 -0.29 0.00 -0.13 0.00 0.00 55.73 57.77 3g2m s ARG 262 Cb 0.00 -3.05 -0.04 0.00 -1.56 0.00 0.00 34.95 30.30 3g2m s ARG 262 CO 0.00 -0.52 1.84 0.15 -0.81 0.00 0.00 175.30 175.96 3g2m s LYS 263 N -0.78 3.59 -0.27 5.12 1.02 -1.26 -4.46 119.74 122.70 3g2m s LYS 263 Ca 0.59 1.83 0.09 0.00 0.02 0.00 0.00 55.97 58.51 3g2m s LYS 263 Cb -0.45 -4.16 0.46 0.00 -0.52 0.00 0.00 37.83 33.15 3g2m s LYS 263 CO 0.49 -1.55 1.19 -0.40 -0.92 0.00 0.00 175.35 174.15 3g2m n ASP 264 N 9.45 4.20 -3.67 2.83 5.75 -0.60 -4.83 116.55 129.68 3g2m n ASP 264 Ca 0.22 -3.58 -0.09 0.00 -0.01 0.00 0.00 54.79 51.33 3g2m n ASP 264 Cb 0.45 -0.37 -0.09 0.00 -1.03 0.00 0.00 41.12 40.07 3g2m n ASP 264 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3g2m s VAL 266 N -4.31 -0.01 -0.37 2.12 1.01 0.44 -4.47 120.40 114.80 3g2m s VAL 266 Ca 0.47 0.05 -0.17 0.00 0.00 0.00 0.00 61.98 62.34 3g2m s VAL 266 Cb 0.40 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 36.01 3g2m s VAL 266 CO 0.02 0.02 0.45 -0.22 0.00 0.00 0.00 175.10 175.37 3g2m s LEU 267 N 1.48 4.52 -0.17 3.92 1.98 0.67 -1.08 118.68 130.00 3g2m s LEU 267 Ca -0.10 -0.29 -0.07 0.00 -2.89 0.00 0.00 54.13 50.78 3g2m s LEU 267 Cb -0.07 -2.45 -0.04 0.00 0.66 0.00 0.00 46.19 44.29 3g2m s LEU 267 CO -0.15 -0.47 0.06 -0.69 -1.89 0.00 0.00 176.35 173.21 3g2m s VAL 268 N 2.21 4.83 -0.15 1.68 1.01 0.55 -0.65 120.40 129.88 3g2m s VAL 268 Ca 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 3g2m s VAL 268 Cb -0.16 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 3g2m s VAL 268 CO 0.13 0.48 -0.08 -1.61 0.00 0.00 0.00 175.10 174.02 3g2m s GLU 269 N 0.17 3.50 0.02 2.72 2.02 0.05 -1.40 118.70 125.77 3g2m s GLU 269 Ca 0.05 -0.61 0.03 0.00 0.02 0.00 0.00 54.97 54.46 3g2m s GLU 269 Cb -0.12 -2.81 -0.01 0.00 0.10 0.00 0.00 34.13 31.29 3g2m s GLU 269 CO 0.00 0.16 -0.09 0.00 0.02 0.00 0.00 175.26 175.35 3g2m s ALA 270 N 0.54 0.74 0.00 5.21 0.00 -0.20 -0.84 121.76 127.20 3g2m s ALA 270 Ca -0.06 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.36 3g2m s ALA 270 Cb -0.15 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.86 3g2m s ALA 270 CO 0.03 0.13 0.00 1.33 0.00 0.00 0.00 175.76 177.25 3g2m n VAL 271 N 2.31 0.00 0.17 0.00 0.24 -0.40 -0.81 118.33 119.85 3g2m n VAL 271 Ca -0.17 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.15 3g2m n VAL 271 Cb 0.56 0.00 0.02 0.00 -1.47 0.00 0.00 33.84 32.95 3g2m n VAL 271 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04