#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hln s LEU 4 N 0.00 3.85 1.11 1.20 1.43 -1.26 -5.09 118.68 119.92 2hln s LEU 4 Ca 0.00 0.97 -0.17 0.00 -1.03 0.00 0.00 54.13 53.90 2hln s LEU 4 Cb 0.00 -3.85 0.25 0.00 0.03 0.00 0.00 46.19 42.62 2hln s LEU 4 CO 0.00 -0.39 1.12 -2.84 0.23 0.00 0.00 176.35 174.48 2hln s PRO 5 N -3.98 -0.52 -0.26 1.29 0.02 -1.26 -4.64 135.00 125.65 2hln s PRO 5 Ca 0.48 0.08 -0.01 0.00 0.02 0.00 0.00 61.00 61.57 2hln s PRO 5 Cb -0.10 -1.67 0.04 0.00 0.02 0.00 0.00 34.50 32.79 2hln s PRO 5 CO 0.34 -3.27 -0.06 -0.80 -0.33 0.00 0.00 177.00 172.88 2hln s ASN 6 N -3.86 4.43 -0.07 2.53 0.01 -1.26 -0.36 114.94 116.35 2hln s ASN 6 Ca 0.69 -1.04 0.04 0.00 -0.71 0.00 0.00 52.86 51.84 2hln s ASN 6 Cb -0.12 -1.65 -0.02 0.00 0.41 0.00 0.00 41.25 39.87 2hln s ASN 6 CO 0.56 -0.17 -0.19 -0.63 -1.51 0.00 0.00 177.10 175.17 2hln s ILE 7 N 1.27 2.59 -0.17 0.60 -1.09 -0.23 -0.46 121.20 123.71 2hln s ILE 7 Ca -0.02 -0.87 -0.03 0.00 -2.23 0.00 0.00 60.65 57.50 2hln s ILE 7 Cb -0.18 -2.01 -0.02 0.00 -1.58 0.00 0.00 42.46 38.68 2hln s ILE 7 CO -0.04 0.57 -0.06 -0.69 -1.23 0.00 0.00 174.94 173.48 2hln s VAL 8 N -0.20 3.51 -0.30 2.92 1.01 -1.09 -2.58 120.40 123.67 2hln s VAL 8 Ca -0.01 -0.48 -0.16 0.00 0.00 0.00 0.00 61.98 61.33 2hln s VAL 8 Cb -0.13 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 2hln s VAL 8 CO 0.03 0.47 0.42 -0.63 0.00 0.00 0.00 175.10 175.40 2hln s ILE 9 N 0.75 5.12 -0.43 2.22 1.01 0.18 -1.88 121.20 128.18 2hln s ILE 9 Ca -0.03 0.48 -0.14 0.00 0.00 0.00 0.00 60.65 60.97 2hln s ILE 9 Cb -0.15 -3.79 0.05 0.00 0.01 0.00 0.00 42.46 38.58 2hln s ILE 9 CO 0.02 0.03 0.31 -0.76 0.00 0.00 0.00 174.94 174.53 2hln s LEU 10 N 2.16 5.21 -0.04 2.97 1.02 0.10 -1.21 118.68 128.90 2hln s LEU 10 Ca 0.16 -1.14 -0.26 0.00 0.02 0.00 0.00 54.13 52.91 2hln s LEU 10 Cb -0.16 -2.12 -0.03 0.00 0.02 0.00 0.00 46.19 43.90 2hln s LEU 10 CO 0.11 -0.52 0.80 0.00 0.02 0.00 0.00 176.35 176.76 2hln s ALA 11 N 1.61 3.28 -0.06 4.21 0.00 0.04 -2.20 121.76 128.63 2hln s ALA 11 Ca 0.04 0.28 0.03 0.00 0.00 0.00 0.00 51.96 52.30 2hln s ALA 11 Cb -0.21 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 2hln s ALA 11 CO 0.07 -0.14 0.09 0.25 0.00 0.00 0.00 175.76 176.03 2hln n THR 12 N 3.78 0.00 0.00 0.00 -2.24 -0.76 -0.90 114.28 114.16 2hln n THR 12 Ca 0.01 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2hln n THR 12 Cb 0.51 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 2hln n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hln n GLY 13 N 1.80 0.49 0.00 3.38 0.00 -1.24 -2.13 105.19 107.49 2hln n GLY 13 Ca -0.00 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2hln n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hln n GLY 14 N 0.00 -0.82 0.01 -0.02 0.00 -1.23 -4.20 105.19 98.93 2hln n GLY 14 Ca 0.00 -1.66 0.14 0.00 0.00 0.00 0.00 46.02 44.50 2hln n GLY 14 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2hln n THR 15 N -0.84 0.00 -0.01 2.61 5.66 -1.26 -3.43 114.28 117.02 2hln n THR 15 Ca 0.00 -0.01 -0.03 0.00 -3.05 0.00 0.00 64.05 60.97 2hln n THR 15 Cb 0.00 -0.39 0.21 0.00 -1.55 0.00 0.00 70.33 68.60 2hln n THR 15 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 175.07 171.73 2hln h ILE 16 N 0.05 1.25 -1.37 1.09 2.10 -1.83 -3.27 117.51 115.53 2hln h ILE 16 Ca 0.00 -1.12 0.00 0.00 1.08 0.00 0.00 64.86 64.82 2hln h ILE 16 Cb 0.43 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 37.35 2hln h ILE 16 CO 0.00 0.37 0.00 0.00 -1.08 0.00 0.00 178.15 177.44 2hln n ALA 17 N -2.48 0.00 -1.13 0.18 0.00 -1.22 -4.74 120.51 111.11 2hln n ALA 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hln n ALA 17 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 2hln n ALA 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hln n GLY 35 N 5.00 0.00 0.09 0.00 0.00 -1.26 -4.88 105.19 104.14 2hln n GLY 35 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2hln n GLY 35 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2hln n VAL 36 N 0.20 1.27 0.51 1.61 3.14 -1.26 -4.04 118.33 119.76 2hln n VAL 36 Ca 0.00 -0.72 0.12 0.00 -2.96 0.00 0.00 64.34 60.78 2hln n VAL 36 Cb 0.00 -0.78 0.45 0.00 -1.06 0.00 0.00 33.84 32.45 2hln n VAL 36 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2hln n GLU 37 N -2.90 0.22 0.10 1.45 -0.58 -1.26 -2.75 120.64 114.91 2hln n GLU 37 Ca -0.12 0.32 -0.05 0.00 -0.42 0.00 0.00 57.16 56.89 2hln n GLU 37 Cb 0.90 -1.83 0.09 0.00 -0.57 0.00 0.00 31.44 30.03 2hln n GLU 37 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2hln h THR 38 N 0.00 1.46 0.20 2.62 2.02 -1.98 -3.05 112.91 114.18 2hln h THR 38 Ca 0.00 -2.30 -0.30 0.00 0.77 0.00 0.00 66.41 64.58 2hln h THR 38 Cb 0.54 2.23 0.03 0.00 -1.74 0.00 0.00 68.15 69.21 2hln h THR 38 CO 0.00 0.67 -1.29 -0.07 0.37 0.00 0.00 175.52 175.19 2hln h LEU 39 N 0.09 0.79 -1.12 2.58 3.38 -1.73 -2.73 115.31 116.57 2hln h LEU 39 Ca -0.02 -0.90 -0.02 0.00 0.09 0.00 0.00 57.88 57.03 2hln h LEU 39 Cb 1.25 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 2hln h LEU 39 CO 0.10 1.63 0.31 0.40 0.09 0.00 0.00 178.44 180.97 2hln h ILE 40 N 0.09 1.21 0.00 1.22 2.04 -1.61 -2.48 117.51 117.98 2hln h ILE 40 Ca -0.22 -0.60 -0.14 0.00 1.00 0.00 0.00 64.86 64.90 2hln h ILE 40 Cb 2.00 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 2hln h ILE 40 CO 0.24 0.25 -0.66 1.56 0.00 0.00 0.00 178.15 179.55 2hln h GLN 41 N 0.93 0.00 0.00 2.37 1.08 -1.62 -3.27 115.11 114.59 2hln h GLN 41 Ca 0.23 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.36 2hln h GLN 41 Cb 0.10 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 2hln h GLN 41 CO -0.03 0.66 -0.32 0.00 -0.95 0.00 0.00 178.83 178.18 2hln h ALA 42 N 1.34 0.98 -3.47 3.87 0.00 -1.12 -3.38 119.26 117.48 2hln h ALA 42 Ca -0.01 -0.29 -0.65 0.00 0.00 0.00 0.00 54.91 53.96 2hln h ALA 42 Cb 1.48 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 18.81 2hln h ALA 42 CO 0.09 0.40 -0.65 0.08 0.00 0.00 0.00 179.25 179.17 2hln s VAL 43 N -3.57 2.52 -0.70 0.00 1.01 -1.04 -4.95 120.40 113.69 2hln s VAL 43 Ca 0.01 -3.01 0.21 0.00 0.00 0.00 0.00 61.98 59.19 2hln s VAL 43 Cb 0.10 -2.78 0.21 0.00 0.00 0.00 0.00 36.38 33.91 2hln s VAL 43 CO 0.67 -0.74 1.65 -0.81 0.00 0.00 0.00 175.10 175.87 2hln n PRO 44 N 3.48 0.13 0.17 2.72 -0.04 -1.26 -2.80 135.00 137.40 2hln n PRO 44 Ca 0.05 0.33 0.13 0.00 -0.04 0.00 0.00 63.50 63.97 2hln n PRO 44 Cb 0.35 -1.72 0.50 0.00 -0.04 0.00 0.00 33.50 32.58 2hln n PRO 44 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2hln h GLU 45 N 0.00 0.00 -0.52 0.54 3.07 -1.93 -3.22 114.58 112.53 2hln h GLU 45 Ca 0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 2hln h GLU 45 Cb 0.37 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 2hln h GLU 45 CO 0.00 0.00 0.14 -0.07 -1.40 0.00 0.00 179.01 177.68 2hln h LEU 46 N 0.00 0.73 0.00 1.33 3.38 -1.88 -2.92 115.31 115.95 2hln h LEU 46 Ca 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2hln h LEU 46 Cb 0.53 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2hln h LEU 46 CO 0.00 0.71 0.00 2.29 0.09 0.00 0.00 178.44 181.53 2hln n LYS 47 N -4.29 0.49 -0.00 1.13 2.85 -1.21 -1.21 118.16 115.91 2hln n LYS 47 Ca 0.04 0.00 0.10 0.00 -1.05 0.00 0.00 58.31 57.40 2hln n LYS 47 Cb 0.21 -1.45 -0.13 0.00 -0.65 0.00 0.00 35.03 33.02 2hln n LYS 47 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2hln n THR 48 N -0.95 0.00 -0.10 0.58 -2.24 -1.10 -4.54 114.28 105.93 2hln n THR 48 Ca 0.11 -0.12 -0.20 0.00 -2.27 0.00 0.00 64.05 61.56 2hln n THR 48 Cb 0.05 0.76 -0.09 0.00 -2.10 0.00 0.00 70.33 68.95 2hln n THR 48 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2hln n LEU 49 N -1.67 1.87 -3.64 3.22 4.77 -0.35 -5.07 117.00 116.13 2hln n LEU 49 Ca 0.02 0.44 -0.06 0.00 -0.03 0.00 0.00 56.01 56.38 2hln n LEU 49 Cb 0.38 -0.92 -0.02 0.00 -2.33 0.00 0.00 43.42 40.53 2hln n LEU 49 CO 0.43 0.19 0.70 0.00 -1.33 0.00 0.00 177.39 177.38 2hln s ALA 50 N -2.46 -1.72 -0.02 -1.18 0.00 -1.14 -4.42 121.76 110.81 2hln s ALA 50 Ca -0.28 0.50 -0.30 0.00 0.00 0.00 0.00 51.96 51.88 2hln s ALA 50 Cb 0.07 0.55 -0.04 0.00 0.00 0.00 0.00 23.12 23.70 2hln s ALA 50 CO 0.51 -0.89 1.23 -0.80 0.00 0.00 0.00 175.76 175.81 2hln s ASN 51 N -2.75 7.03 -0.07 0.00 0.01 0.51 -4.51 114.94 115.16 2hln s ASN 51 Ca 0.09 1.90 0.04 0.00 -0.71 0.00 0.00 52.86 54.19 2hln s ASN 51 Cb -0.01 -2.56 -0.02 0.00 0.41 0.00 0.00 41.25 39.07 2hln s ASN 51 CO -0.03 -0.57 -0.20 -0.63 -1.51 0.00 0.00 177.10 174.16 2hln s ILE 52 N 1.96 2.53 0.02 0.60 1.01 -1.26 -1.07 121.20 124.99 2hln s ILE 52 Ca 0.58 -0.90 0.04 0.00 0.00 0.00 0.00 60.65 60.37 2hln s ILE 52 Cb -0.27 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.22 2hln s ILE 52 CO 0.24 0.57 -0.12 -0.54 0.00 0.00 0.00 174.94 175.09 2hln s LYS 53 N -0.26 0.91 0.10 2.79 1.02 -1.07 -5.03 119.74 118.20 2hln s LYS 53 Ca 0.00 -0.59 0.09 0.00 0.02 0.00 0.00 55.97 55.50 2hln s LYS 53 Cb -0.13 -0.89 -0.04 0.00 -0.52 0.00 0.00 37.83 36.25 2hln s LYS 53 CO 0.03 0.23 -0.21 0.20 -0.92 0.00 0.00 175.35 174.68 2hln s GLY 54 N -0.73 1.61 0.03 -3.33 0.00 -1.26 -0.65 107.32 102.99 2hln s GLY 54 Ca 0.02 -1.34 0.01 0.00 0.00 0.00 0.00 44.72 43.41 2hln s GLY 54 CO 0.00 -1.29 -0.05 -0.54 0.00 0.00 0.00 173.10 171.23 2hln s GLU 55 N -1.89 0.40 -0.42 2.90 2.02 -0.35 -4.95 118.70 116.42 2hln s GLU 55 Ca 0.16 -0.68 -0.06 0.00 0.02 0.00 0.00 54.97 54.41 2hln s GLU 55 Cb -0.10 -0.04 0.10 0.00 0.10 0.00 0.00 34.13 34.19 2hln s GLU 55 CO 0.07 -0.01 0.23 -1.14 0.02 0.00 0.00 175.26 174.43 2hln s GLN 56 N -1.57 2.28 -0.08 1.61 2.00 -1.26 -0.78 119.66 121.85 2hln s GLN 56 Ca -0.13 -1.68 -0.26 0.00 -2.00 0.00 0.00 55.36 51.28 2hln s GLN 56 Cb -0.10 -3.68 -0.25 0.00 0.80 0.00 0.00 33.01 29.79 2hln s GLN 56 CO -0.01 -1.04 0.95 0.28 -0.50 0.00 0.00 175.29 174.98 2hln h VAL 57 N 6.25 1.62 -3.91 1.34 2.07 -1.36 -3.48 116.25 118.78 2hln h VAL 57 Ca -0.18 -2.03 -0.11 0.00 0.82 0.00 0.00 66.70 65.21 2hln h VAL 57 Cb 1.06 2.95 -0.11 0.00 -1.52 0.00 0.00 31.29 33.68 2hln h VAL 57 CO 0.74 0.54 -0.27 0.00 0.02 0.00 0.00 177.57 178.60 2hln s ALA 58 N -2.89 0.14 -0.39 1.67 0.00 -1.08 -5.02 121.76 114.18 2hln s ALA 58 Ca -0.17 -1.08 0.11 0.00 0.00 0.00 0.00 51.96 50.82 2hln s ALA 58 Cb -0.01 1.13 0.34 0.00 0.00 0.00 0.00 23.12 24.59 2hln s ALA 58 CO 0.72 -0.77 0.73 0.45 0.00 0.00 0.00 175.76 176.89 2hln n SER 59 N -0.34 1.06 -4.19 0.00 2.88 -1.21 -3.78 113.62 108.05 2hln n SER 59 Ca -0.01 -3.04 -0.13 0.00 -1.33 0.00 0.00 58.87 54.36 2hln n SER 59 Cb 0.63 -0.62 -0.10 0.00 -0.75 0.00 0.00 64.21 63.37 2hln n SER 59 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2hln s ILE 60 N -2.48 0.91 0.47 2.46 -4.36 -0.91 -4.94 121.20 112.36 2hln s ILE 60 Ca 0.40 -1.81 -0.21 0.00 -0.26 0.00 0.00 60.65 58.77 2hln s ILE 60 Cb 0.33 -1.55 -0.08 0.00 1.25 0.00 0.00 42.46 42.41 2hln s ILE 60 CO -0.09 -0.69 1.06 -0.83 0.24 0.00 0.00 174.94 174.63 2hln s GLY 61 N -2.77 2.58 0.65 6.27 0.00 -1.26 -3.49 107.32 109.30 2hln s GLY 61 Ca 0.10 0.67 0.35 0.00 0.00 0.00 0.00 44.72 45.84 2hln s GLY 61 CO -0.01 1.02 2.13 1.48 0.00 0.00 0.00 173.10 177.72 2hln h SER 62 N 1.73 0.00 0.52 1.64 4.64 -1.92 0.15 113.55 120.31 2hln h SER 62 Ca -0.49 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.79 2hln h SER 62 Cb 1.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2hln h SER 62 CO 0.59 0.00 -0.19 1.05 -0.87 0.00 0.00 176.83 177.41 2hln h GLU 63 N 0.00 0.00 -0.47 4.77 9.09 -1.92 -2.44 114.58 123.61 2hln h GLU 63 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.43 2hln h GLU 63 Cb 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.49 2hln h GLU 63 CO -0.00 0.19 0.00 0.09 0.05 0.00 0.00 179.01 179.34 2hln n ASN 64 N -3.64 3.34 -4.71 3.06 3.02 0.52 -4.97 115.26 111.87 2hln n ASN 64 Ca -0.01 -1.96 -0.42 0.00 -0.03 0.00 0.00 54.58 52.16 2hln n ASN 64 Cb 0.32 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 39.15 2hln n ASN 64 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2hln s MET 65 N -1.08 4.28 0.39 3.52 -2.45 -0.92 -4.94 119.30 118.10 2hln s MET 65 Ca 0.35 2.15 0.08 0.00 -1.25 0.00 0.00 55.69 57.02 2hln s MET 65 Cb 0.19 -3.31 -0.06 0.00 1.25 0.00 0.00 34.83 32.90 2hln s MET 65 CO 0.25 -0.53 0.09 0.95 1.05 0.00 0.00 175.02 176.83 2hln s THR 66 N 1.46 2.29 0.29 10.11 -4.23 -1.26 -5.03 115.64 119.26 2hln s THR 66 Ca 0.67 -1.85 0.21 0.00 -1.18 0.00 0.00 61.69 59.54 2hln s THR 66 Cb -0.38 -2.95 0.19 0.00 1.34 0.00 0.00 72.50 70.70 2hln s THR 66 CO 0.30 -0.05 1.87 0.77 -0.54 0.00 0.00 174.62 176.98 2hln h SER 67 N 1.62 0.00 -0.37 3.99 4.64 -1.99 -2.67 113.55 118.76 2hln h SER 67 Ca -0.43 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.81 2hln h SER 67 Cb 1.25 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 2hln h SER 67 CO 0.72 0.27 -0.03 0.44 -0.87 0.00 0.00 176.83 177.37 2hln h ASP 68 N 0.00 0.74 0.44 4.97 3.32 -1.96 -1.90 116.42 122.03 2hln h ASP 68 Ca -0.00 -0.19 -0.22 0.00 0.02 0.00 0.00 57.03 56.64 2hln h ASP 68 Cb 0.65 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 2hln h ASP 68 CO 0.04 0.83 -0.93 0.58 -1.72 0.00 0.00 179.24 178.03 2hln h VAL 69 N 0.71 1.44 -0.63 -1.35 2.07 -1.92 -2.86 116.25 113.72 2hln h VAL 69 Ca 0.14 -2.54 -0.02 0.00 0.82 0.00 0.00 66.70 65.09 2hln h VAL 69 Cb 0.48 2.46 -0.03 0.00 -1.52 0.00 0.00 31.29 32.68 2hln h VAL 69 CO 0.02 0.75 0.30 -0.07 0.02 0.00 0.00 177.57 178.59 2hln h LEU 70 N 0.18 0.80 -0.05 2.57 3.38 -1.18 0.60 115.31 121.61 2hln h LEU 70 Ca -0.07 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2hln h LEU 70 Cb 1.57 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.11 2hln h LEU 70 CO 0.15 0.69 0.02 -0.07 0.09 0.00 0.00 178.44 179.32 2hln h LEU 71 N 0.89 0.08 -0.99 1.67 3.38 -1.32 0.21 115.31 119.23 2hln h LEU 71 Ca 0.22 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2hln h LEU 71 Cb 0.10 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2hln h LEU 71 CO -0.03 0.24 0.55 0.74 0.09 0.00 0.00 178.44 180.03 2hln h THR 72 N -0.09 1.25 -0.15 0.22 2.02 -1.16 -1.14 112.91 113.86 2hln h THR 72 Ca 0.02 -0.55 -0.03 0.00 0.77 0.00 0.00 66.41 66.62 2hln h THR 72 Cb 0.18 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.54 2hln h THR 72 CO -0.00 0.26 -0.03 0.25 0.37 0.00 0.00 175.52 176.37 2hln h LEU 73 N 1.27 0.30 -0.79 2.58 5.85 0.40 -2.44 115.31 122.48 2hln h LEU 73 Ca 0.33 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 2hln h LEU 73 Cb -0.06 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 2hln h LEU 73 CO -0.06 0.59 0.36 -1.28 -0.34 0.00 0.00 178.44 177.70 2hln h SER 74 N 0.00 1.06 -0.56 1.25 0.87 -0.33 -1.72 113.55 114.12 2hln h SER 74 Ca 0.04 -0.15 -0.08 0.00 -1.23 0.00 0.00 61.79 60.37 2hln h SER 74 Cb 0.46 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 2hln h SER 74 CO 0.01 0.91 0.02 0.11 -0.53 0.00 0.00 176.83 177.36 2hln h LYS 75 N 1.13 0.98 -0.35 2.24 1.57 -1.21 -1.87 116.57 119.06 2hln h LYS 75 Ca 0.27 -0.30 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 2hln h LYS 75 Cb 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2hln h LYS 75 CO -0.03 0.97 -0.24 -0.09 -0.57 0.00 0.00 179.45 179.49 2hln h ARG 76 N 0.87 0.70 -0.10 3.15 9.65 -1.24 -2.55 114.38 124.86 2hln h ARG 76 Ca 0.16 -0.28 -0.01 0.00 -1.10 0.00 0.00 59.98 58.75 2hln h ARG 76 Cb 0.51 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.05 2hln h ARG 76 CO 0.02 0.87 0.00 0.28 2.80 0.00 0.00 179.97 183.95 2hln h VAL 77 N 0.61 1.24 -0.85 0.20 2.07 -1.17 -2.55 116.25 115.80 2hln h VAL 77 Ca 0.08 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2hln h VAL 77 Cb 0.72 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 2hln h VAL 77 CO 0.06 0.22 0.53 0.78 0.02 0.00 0.00 177.57 179.18 2hln h ASN 78 N -0.09 1.00 0.97 0.57 2.35 -1.29 -0.77 115.58 118.32 2hln h ASN 78 Ca 0.03 -0.05 -0.12 0.00 -0.55 0.00 0.00 56.30 55.61 2hln h ASN 78 Cb 0.33 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 2hln h ASN 78 CO 0.00 0.75 -0.57 1.05 -1.65 0.00 0.00 177.43 177.01 2hln h GLU 79 N 1.17 0.00 -0.02 0.81 4.11 -1.47 -2.52 114.58 116.66 2hln h GLU 79 Ca 0.31 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.59 2hln h GLU 79 Cb -0.08 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.18 2hln h GLU 79 CO -0.06 0.57 -0.58 -0.07 0.07 0.00 0.00 179.01 178.95 2hln h LEU 80 N 0.00 0.54 -1.85 3.06 3.38 -1.07 -3.23 115.31 116.15 2hln h LEU 80 Ca -0.01 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.23 2hln h LEU 80 Cb 1.21 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2hln h LEU 80 CO 0.07 1.20 0.00 -0.07 0.09 0.00 0.00 178.44 179.74 2hln h LEU 81 N -0.07 0.00 -0.75 1.67 3.38 -1.16 -1.87 115.31 116.50 2hln h LEU 81 Ca -0.07 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2hln h LEU 81 Cb 1.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2hln h LEU 81 CO 0.11 0.00 -0.42 0.00 0.09 0.00 0.00 178.44 178.22 2hln h ALA 82 N 2.00 0.92 -2.42 1.53 0.00 -1.46 -3.45 119.26 116.38 2hln h ALA 82 Ca 0.00 -0.38 -0.48 0.00 0.00 0.00 0.00 54.91 54.05 2hln h ALA 82 Cb 0.38 -0.07 0.05 0.00 0.00 0.00 0.00 17.79 18.14 2hln h ALA 82 CO 0.00 0.52 0.40 1.03 0.00 0.00 0.00 179.25 181.21 2hln s ARG 83 N -3.48 3.60 0.11 0.00 0.52 -0.70 -4.96 118.95 114.04 2hln s ARG 83 Ca 0.01 1.44 0.26 0.00 -0.52 0.00 0.00 55.73 56.92 2hln s ARG 83 Cb 0.10 -2.06 0.72 0.00 0.52 0.00 0.00 34.95 34.24 2hln s ARG 83 CO 0.70 -0.61 1.63 0.43 0.02 0.00 0.00 175.30 177.47 2hln n SER 84 N -1.17 0.57 -0.91 0.23 7.64 -1.26 -3.55 113.62 115.17 2hln n SER 84 Ca 0.10 0.32 0.09 0.00 1.01 0.00 0.00 58.87 60.38 2hln n SER 84 Cb 0.52 -0.31 0.24 0.00 -1.01 0.00 0.00 64.21 63.64 2hln n SER 84 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2hln n ASP 85 N -1.96 2.64 -4.05 6.43 5.75 -1.26 -4.78 116.55 119.33 2hln n ASP 85 Ca 0.05 -1.97 -0.31 0.00 -0.01 0.00 0.00 54.79 52.55 2hln n ASP 85 Cb 0.40 -0.31 -0.16 0.00 -1.03 0.00 0.00 41.12 40.02 2hln n ASP 85 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2hln s VAL 86 N -1.38 1.81 -0.13 2.12 1.01 -1.23 -4.70 120.40 117.90 2hln s VAL 86 Ca 0.34 -0.95 0.20 0.00 0.00 0.00 0.00 61.98 61.57 2hln s VAL 86 Cb 0.18 -1.76 -0.18 0.00 0.00 0.00 0.00 36.38 34.62 2hln s VAL 86 CO 0.24 0.35 0.67 0.47 0.00 0.00 0.00 175.10 176.82 2hln n ASP 87 N 4.66 0.46 -3.63 3.32 8.00 0.39 -4.86 116.55 124.90 2hln n ASP 87 Ca -0.17 0.19 -0.04 0.00 0.71 0.00 0.00 54.79 55.48 2hln n ASP 87 Cb 0.48 0.95 -0.01 0.00 -0.02 0.00 0.00 41.12 42.51 2hln n ASP 87 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2hln s GLY 88 N -4.68 -0.35 -0.06 0.44 0.00 -1.18 -4.43 107.32 97.06 2hln s GLY 88 Ca -0.05 0.73 0.02 0.00 0.00 0.00 0.00 44.72 45.42 2hln s GLY 88 CO 0.84 0.21 -0.09 0.14 0.00 0.00 0.00 173.10 174.19 2hln s VAL 89 N -2.94 0.92 -0.13 1.40 1.01 -0.54 -2.65 120.40 117.48 2hln s VAL 89 Ca 0.10 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 2hln s VAL 89 Cb 0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 2hln s VAL 89 CO -0.03 0.31 -0.05 -0.69 0.00 0.00 0.00 175.10 174.64 2hln s VAL 90 N 0.78 3.84 -0.23 2.92 1.01 -0.79 -0.42 120.40 127.52 2hln s VAL 90 Ca -0.13 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.48 2hln s VAL 90 Cb -0.15 -2.65 0.05 0.00 0.00 0.00 0.00 36.38 33.63 2hln s VAL 90 CO 0.02 0.53 -0.11 -0.63 0.00 0.00 0.00 175.10 174.91 2hln s ILE 91 N -0.05 1.96 -0.13 2.22 1.01 -0.07 0.01 121.20 126.15 2hln s ILE 91 Ca 0.01 -1.36 -0.29 0.00 0.00 0.00 0.00 60.65 59.01 2hln s ILE 91 Cb -0.13 -2.04 -0.01 0.00 0.01 0.00 0.00 42.46 40.29 2hln s ILE 91 CO 0.03 0.08 1.03 0.42 0.00 0.00 0.00 174.94 176.49 2hln s THR 92 N 1.23 4.73 0.22 2.92 -4.23 -0.93 -0.75 115.64 118.82 2hln s THR 92 Ca -0.05 2.02 0.00 0.00 -1.18 0.00 0.00 61.69 62.48 2hln s THR 92 Cb -0.18 -4.30 -0.04 0.00 1.34 0.00 0.00 72.50 69.32 2hln s THR 92 CO -0.07 -0.04 0.14 -2.28 -0.54 0.00 0.00 174.62 171.83 2hln s HIS 93 N 2.32 1.27 0.68 3.99 5.04 -0.16 -1.83 115.29 126.60 2hln s HIS 93 Ca 0.48 -1.38 -0.07 0.00 -1.54 0.00 0.00 55.06 52.54 2hln s HIS 93 Cb -0.18 -0.62 0.04 0.00 0.04 0.00 0.00 32.58 31.86 2hln s HIS 93 CO 0.15 -0.62 1.00 0.20 -2.34 0.00 0.00 174.74 173.14 2hln s GLY 94 N -3.20 1.65 -0.01 1.59 0.00 -1.26 -4.31 107.32 101.77 2hln s GLY 94 Ca 0.39 -0.78 0.15 0.00 0.00 0.00 0.00 44.72 44.47 2hln s GLY 94 CO 0.14 -0.41 0.69 -1.30 0.00 0.00 0.00 173.10 172.22 2hln n THR 95 N -2.87 1.40 -0.30 0.90 -2.24 -1.26 -3.90 114.28 106.01 2hln n THR 95 Ca 0.07 -0.75 0.07 0.00 -2.27 0.00 0.00 64.05 61.17 2hln n THR 95 Cb 0.59 -0.87 0.23 0.00 -2.10 0.00 0.00 70.33 68.18 2hln n THR 95 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2hln h ASP 96 N 0.00 0.58 -0.01 3.42 3.45 -1.96 -2.70 116.42 119.21 2hln h ASP 96 Ca -0.25 0.09 -0.02 0.00 0.43 0.00 0.00 57.03 57.28 2hln h ASP 96 Cb 1.84 -0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 40.57 2hln h ASP 96 CO 0.06 0.26 -0.53 0.35 -1.57 0.00 0.00 179.24 177.81 2hln n THR 97 N -4.84 2.12 1.50 0.35 -2.24 -1.26 -4.68 114.28 105.24 2hln n THR 97 Ca 0.17 -3.17 0.04 0.00 -2.27 0.00 0.00 64.05 58.82 2hln n THR 97 Cb 0.42 -0.20 0.22 0.00 -2.10 0.00 0.00 70.33 68.67 2hln n THR 97 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2hln n LEU 98 N -1.05 0.00 0.02 3.22 7.94 -1.02 -1.99 117.00 124.12 2hln n LEU 98 Ca 0.19 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.96 2hln n LEU 98 Cb 0.71 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.53 2hln n LEU 98 CO -0.03 0.00 -0.43 0.44 -1.11 0.00 0.00 177.39 176.26 2hln h ASP 99 N 0.00 0.19 0.00 1.96 3.32 -1.83 -3.40 116.42 116.66 2hln h ASP 99 Ca 0.00 -0.32 -0.13 0.00 0.02 0.00 0.00 57.03 56.60 2hln h ASP 99 Cb 0.00 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 2hln h ASP 99 CO 0.00 1.28 -1.01 -0.62 -1.72 0.00 0.00 179.24 177.17 2hln n GLU 100 N -3.28 0.51 -0.20 3.56 4.71 -0.84 -4.48 120.64 120.62 2hln n GLU 100 Ca -0.17 0.50 -0.06 0.00 -0.01 0.00 0.00 57.16 57.42 2hln n GLU 100 Cb 1.03 -1.68 -0.01 0.00 -1.01 0.00 0.00 31.44 29.78 2hln n GLU 100 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 2hln h SER 101 N -1.00 -1.26 -0.04 1.62 0.02 -1.76 -1.83 113.55 109.30 2hln h SER 101 Ca -0.20 0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 60.91 2hln h SER 101 Cb 0.95 0.61 -0.01 0.00 0.14 0.00 0.00 62.40 64.08 2hln h SER 101 CO -0.12 -0.32 -0.19 -0.65 -1.14 0.00 0.00 176.83 174.42 2hln h PRO 102 N -0.18 0.40 0.00 3.45 0.11 -1.84 -2.59 132.00 131.34 2hln h PRO 102 Ca 0.22 -0.12 -0.06 0.00 0.11 0.00 0.00 66.00 66.14 2hln h PRO 102 Cb 0.56 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 2hln h PRO 102 CO -0.68 0.58 -0.27 -0.92 -0.21 0.00 0.00 178.00 176.50 2hln h TYR 103 N 0.37 0.00 0.06 0.65 3.20 -1.60 -1.12 116.97 118.53 2hln h TYR 103 Ca 0.06 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 2hln h TYR 103 Cb 0.54 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.81 2hln h TYR 103 CO 0.01 0.27 -0.03 0.35 -1.64 0.00 0.00 178.16 177.12 2hln h PHE 104 N 0.00 -0.08 0.00 -3.82 3.04 -0.95 -2.98 116.94 112.15 2hln h PHE 104 Ca -0.00 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 2hln h PHE 104 Cb 0.78 0.03 -0.00 0.00 2.56 0.00 0.00 35.95 39.31 2hln h PHE 104 CO 0.00 0.25 -0.06 -0.07 -2.02 0.00 0.00 178.31 176.41 2hln h LEU 105 N -0.41 0.00 -1.94 0.59 4.07 -1.41 -2.01 115.31 114.21 2hln h LEU 105 Ca -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 2hln h LEU 105 Cb 0.36 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.10 2hln h LEU 105 CO 0.01 0.06 -0.10 -1.13 -1.08 0.00 0.00 178.44 176.20 2hln h ASN 106 N 0.00 0.00 0.00 -0.43 -1.24 -1.05 0.36 115.58 113.22 2hln h ASN 106 Ca -0.00 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 56.90 2hln h ASN 106 Cb 0.61 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.64 2hln h ASN 106 CO 0.01 0.10 -2.00 0.18 -1.29 0.00 0.00 177.43 174.43 2hln n LEU 107 N -3.57 0.00 -0.01 0.34 4.77 -0.90 -0.71 117.00 116.92 2hln n LEU 107 Ca -0.02 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.05 2hln n LEU 107 Cb 0.23 0.14 -0.14 0.00 -2.33 0.00 0.00 43.42 41.33 2hln n LEU 107 CO 0.29 0.14 -0.61 0.35 -1.33 0.00 0.00 177.39 176.24 2hln n THR 108 N -2.34 0.00 -2.28 -5.08 -2.24 -0.80 -4.25 114.28 97.29 2hln n THR 108 Ca -0.12 -0.37 -0.41 0.00 -2.27 0.00 0.00 64.05 60.89 2hln n THR 108 Cb 0.69 0.23 -0.03 0.00 -2.10 0.00 0.00 70.33 69.12 2hln n THR 108 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2hln s VAL 109 N -3.18 3.24 -0.37 2.28 1.01 0.09 -4.82 120.40 118.65 2hln s VAL 109 Ca -0.05 1.10 0.15 0.00 0.00 0.00 0.00 61.98 63.19 2hln s VAL 109 Cb 0.12 -3.70 0.48 0.00 0.00 0.00 0.00 36.38 33.28 2hln s VAL 109 CO 0.76 0.20 1.38 0.29 0.00 0.00 0.00 175.10 177.74 2hln n LYS 110 N 2.00 2.94 -4.39 2.72 4.76 -1.26 -3.92 118.16 121.00 2hln n LYS 110 Ca 0.03 -2.65 -0.26 0.00 -2.87 0.00 0.00 58.31 52.57 2hln n LYS 110 Cb 0.43 -1.71 -0.10 0.00 -1.84 0.00 0.00 35.03 31.81 2hln n LYS 110 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2hln s SER 111 N -1.68 3.78 0.38 4.39 0.15 -1.26 -4.63 113.70 114.83 2hln s SER 111 Ca 0.38 -0.83 0.22 0.00 0.70 0.00 0.00 55.95 56.42 2hln s SER 111 Cb 0.29 -0.44 0.25 0.00 -1.71 0.00 0.00 66.02 64.41 2hln s SER 111 CO 0.11 0.08 1.49 -0.78 1.20 0.00 0.00 173.24 175.34 2hln h ASP 112 N 2.71 0.00 -3.94 5.45 3.58 -1.95 -3.39 116.42 118.88 2hln h ASP 112 Ca -0.44 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.49 2hln h ASP 112 Cb 1.23 0.00 0.07 0.00 1.72 0.00 0.00 39.33 42.35 2hln h ASP 112 CO 0.54 0.08 0.57 -0.54 -2.88 0.00 0.00 179.24 177.01 2hln s LYS 113 N -3.19 4.03 0.13 0.28 1.02 -1.26 -1.55 119.74 119.20 2hln s LYS 113 Ca 0.05 2.03 -0.31 0.00 0.02 0.00 0.00 55.97 57.76 2hln s LYS 113 Cb 0.06 -2.75 -0.09 0.00 -0.52 0.00 0.00 37.83 34.53 2hln s LYS 113 CO 0.70 -0.40 1.51 -2.14 -0.92 0.00 0.00 175.35 174.11 2hln s PRO 114 N -2.22 4.25 -0.30 -1.68 0.02 -1.26 -4.87 135.00 128.94 2hln s PRO 114 Ca 0.56 2.25 -0.03 0.00 0.02 0.00 0.00 61.00 63.80 2hln s PRO 114 Cb -0.35 -3.24 0.04 0.00 0.02 0.00 0.00 34.50 30.96 2hln s PRO 114 CO 0.45 -0.56 0.02 0.08 -0.33 0.00 0.00 177.00 176.66 2hln s VAL 115 N 1.32 3.27 -0.29 3.83 1.01 -1.26 -1.46 120.40 126.82 2hln s VAL 115 Ca 0.68 -1.16 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2hln s VAL 115 Cb -0.41 -2.80 0.06 0.00 0.00 0.00 0.00 36.38 33.23 2hln s VAL 115 CO 0.31 -0.03 -0.04 -0.69 0.00 0.00 0.00 175.10 174.64 2hln s VAL 116 N 1.33 2.61 0.34 2.92 1.01 0.44 -1.19 120.40 127.88 2hln s VAL 116 Ca -0.02 -1.55 -0.26 0.00 0.00 0.00 0.00 61.98 60.15 2hln s VAL 116 Cb -0.19 -2.54 -0.10 0.00 0.00 0.00 0.00 36.38 33.56 2hln s VAL 116 CO -0.00 -0.11 1.00 -0.36 0.00 0.00 0.00 175.10 175.63 2hln s PHE 117 N 1.17 3.54 -0.00 5.22 0.40 0.18 -0.89 117.98 127.60 2hln s PHE 117 Ca -0.06 1.73 -0.05 0.00 -0.60 0.00 0.00 56.93 57.95 2hln s PHE 117 Cb -0.20 -3.04 -0.00 0.00 0.51 0.00 0.00 43.02 40.29 2hln s PHE 117 CO -0.03 -0.16 0.09 0.54 0.70 0.00 0.00 175.22 176.36 2hln s VAL 118 N -1.57 0.07 0.12 -0.44 0.11 0.07 -1.45 120.40 117.31 2hln s VAL 118 Ca 0.52 -0.61 -0.02 0.00 -2.93 0.00 0.00 61.98 58.94 2hln s VAL 118 Cb -0.21 -0.33 0.01 0.00 -1.53 0.00 0.00 36.38 34.31 2hln s VAL 118 CO 0.27 -0.34 0.20 0.00 -3.33 0.00 0.00 175.10 171.90 2hln n ALA 119 N 1.81 -0.26 -3.29 1.54 0.00 -1.26 -0.98 120.51 118.06 2hln n ALA 119 Ca -0.21 -0.51 -0.13 0.00 0.00 0.00 0.00 53.44 52.58 2hln n ALA 119 Cb 0.56 0.41 -0.10 0.00 0.00 0.00 0.00 19.45 20.33 2hln n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hln s ALA 120 N -1.79 -0.97 -0.12 0.00 0.00 -1.26 -4.70 121.76 112.92 2hln s ALA 120 Ca 0.08 0.92 0.17 0.00 0.00 0.00 0.00 51.96 53.14 2hln s ALA 120 Cb -0.01 -0.43 -0.15 0.00 0.00 0.00 0.00 23.12 22.53 2hln s ALA 120 CO 0.06 -0.22 0.75 -1.33 0.00 0.00 0.00 175.76 175.03 2hln n MET 121 N 2.35 0.63 -4.46 0.00 2.81 -1.26 -4.68 117.12 112.50 2hln n MET 121 Ca -0.16 0.19 -0.34 0.00 -1.81 0.00 0.00 57.70 55.58 2hln n MET 121 Cb 0.57 -1.78 -0.10 0.00 -0.71 0.00 0.00 33.22 31.20 2hln n MET 121 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2hln s ARG 122 N -2.91 2.94 0.74 0.03 0.52 -1.26 -5.06 118.95 113.95 2hln s ARG 122 Ca -0.04 -0.46 -0.15 0.00 -0.52 0.00 0.00 55.73 54.56 2hln s ARG 122 Cb 0.09 -2.73 0.03 0.00 0.52 0.00 0.00 34.95 32.86 2hln s ARG 122 CO 0.82 0.66 1.13 -0.35 0.02 0.00 0.00 175.30 177.58 2hln n PRO 123 N 2.26 0.52 0.32 3.54 -0.04 -1.26 -4.55 135.00 135.78 2hln n PRO 123 Ca -0.18 0.24 0.20 0.00 -0.04 0.00 0.00 63.50 63.72 2hln n PRO 123 Cb 0.53 -2.38 1.06 0.00 -0.04 0.00 0.00 33.50 32.67 2hln n PRO 123 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hln h ALA 124 N -0.34 1.23 -0.63 0.55 0.00 -1.85 -1.64 119.26 116.59 2hln h ALA 124 Ca -0.48 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.24 2hln h ALA 124 Cb 1.32 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.00 2hln h ALA 124 CO 0.48 -0.11 0.21 0.25 0.00 0.00 0.00 179.25 180.07 2hln n THR 125 N -3.22 2.81 -3.47 0.00 -2.24 -1.26 -4.85 114.28 102.06 2hln n THR 125 Ca -0.02 -1.83 -0.19 0.00 -2.27 0.00 0.00 64.05 59.74 2hln n THR 125 Cb 0.17 -0.34 -0.01 0.00 -2.10 0.00 0.00 70.33 68.05 2hln n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hln s ALA 126 N -3.02 4.22 -0.07 6.98 0.00 -0.62 -5.05 121.76 124.19 2hln s ALA 126 Ca 0.52 -1.52 -0.30 0.00 0.00 0.00 0.00 51.96 50.67 2hln s ALA 126 Cb 0.42 -1.59 -0.04 0.00 0.00 0.00 0.00 23.12 21.91 2hln s ALA 126 CO 0.11 -0.06 1.46 0.42 0.00 0.00 0.00 175.76 177.69 2hln s ILE 127 N -2.22 3.84 -1.09 0.00 1.01 -1.26 -3.17 121.20 118.31 2hln s ILE 127 Ca 0.46 1.08 -0.00 0.00 0.00 0.00 0.00 60.65 62.19 2hln s ILE 127 Cb -0.09 -3.70 -0.01 0.00 0.01 0.00 0.00 42.46 38.68 2hln s ILE 127 CO 0.31 -0.07 0.91 -1.20 0.00 0.00 0.00 174.94 174.89 2hln n SER 128 N 6.44 -2.42 -4.72 3.58 7.64 -1.26 -4.93 113.62 117.96 2hln n SER 128 Ca 0.15 -0.58 -0.42 0.00 1.01 0.00 0.00 58.87 59.03 2hln n SER 128 Cb 0.44 -4.76 -0.03 0.00 -1.01 0.00 0.00 64.21 58.84 2hln n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hln s ALA 129 N -3.33 3.84 -0.53 -0.43 0.00 -1.19 -4.90 121.76 115.22 2hln s ALA 129 Ca 0.04 1.46 0.26 0.00 0.00 0.00 0.00 51.96 53.72 2hln s ALA 129 Cb -0.00 -3.67 0.78 0.00 0.00 0.00 0.00 23.12 20.22 2hln s ALA 129 CO 0.67 -0.89 1.74 0.38 0.00 0.00 0.00 175.76 177.67 2hln h ASP 130 N 6.99 0.00 -0.63 0.00 2.03 -1.88 -3.38 116.42 119.55 2hln h ASP 130 Ca -0.43 0.00 0.07 0.00 -0.73 0.00 0.00 57.03 55.94 2hln h ASP 130 Cb 1.20 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 39.61 2hln h ASP 130 CO 0.94 0.00 -0.56 1.23 -1.03 0.00 0.00 179.24 179.81 2hln h GLY 131 N 3.75 -0.92 0.01 7.15 0.00 -1.84 -1.90 103.07 109.33 2hln h GLY 131 Ca 0.00 0.74 0.09 0.00 0.00 0.00 0.00 47.33 48.16 2hln h GLY 131 CO 0.00 -0.06 -0.16 -2.55 0.00 0.00 0.00 176.54 173.77 2hln h PRO 132 N -0.25 -0.06 -0.21 4.80 0.11 -1.95 -1.06 132.00 133.39 2hln h PRO 132 Ca 0.11 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.07 2hln h PRO 132 Cb 0.53 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 2hln h PRO 132 CO -0.73 -0.04 -0.49 1.98 -0.21 0.00 0.00 178.00 178.51 2hln h MET 133 N -0.06 0.56 -0.66 1.05 4.05 -1.79 -1.57 114.93 116.52 2hln h MET 133 Ca 0.22 -0.33 -0.06 0.00 -0.28 0.00 0.00 59.70 59.25 2hln h MET 133 Cb 0.39 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 31.19 2hln h MET 133 CO -0.50 0.93 0.17 -0.91 0.23 0.00 0.00 176.91 176.83 2hln h ASN 134 N 0.44 0.97 -0.45 1.39 4.21 -1.07 -0.87 115.58 120.21 2hln h ASN 134 Ca 0.02 -0.19 -0.10 0.00 1.21 0.00 0.00 56.30 57.24 2hln h ASN 134 Cb 1.02 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.95 2hln h ASN 134 CO 0.09 0.93 -0.12 0.25 -1.29 0.00 0.00 177.43 177.29 2hln h LEU 135 N 0.99 0.88 -0.60 1.61 5.85 -1.05 -0.49 115.31 122.50 2hln h LEU 135 Ca 0.21 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2hln h LEU 135 Cb 0.33 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2hln h LEU 135 CO -0.00 1.05 0.38 0.22 -0.34 0.00 0.00 178.44 179.75 2hln h TYR 136 N 0.71 0.78 -0.21 1.25 5.03 -1.04 -1.52 116.97 121.95 2hln h TYR 136 Ca 0.11 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.41 2hln h TYR 136 Cb 0.67 -0.26 -0.01 0.00 1.55 0.00 0.00 36.73 38.68 2hln h TYR 136 CO 0.05 0.51 0.05 0.78 -1.32 0.00 0.00 178.16 178.23 2hln h GLY 137 N 0.82 0.37 1.00 1.82 0.00 -0.97 -1.87 103.07 104.24 2hln h GLY 137 Ca 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2hln h GLY 137 CO -0.04 0.22 0.43 0.00 0.00 0.00 0.00 176.54 177.14 2hln h ALA 138 N 0.87 0.85 -0.53 3.60 0.00 -0.92 -0.70 119.26 122.42 2hln h ALA 138 Ca 0.07 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2hln h ALA 138 Cb 0.27 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2hln h ALA 138 CO 0.00 0.31 -0.13 0.28 0.00 0.00 0.00 179.25 179.70 2hln h VAL 139 N 0.91 1.27 -0.74 0.00 2.07 -1.26 -0.85 116.25 117.65 2hln h VAL 139 Ca 0.24 -1.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.44 2hln h VAL 139 Cb -0.07 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 2hln h VAL 139 CO -0.05 0.46 0.36 0.50 0.02 0.00 0.00 177.57 178.86 2hln h LYS 140 N 0.91 1.07 -0.43 1.57 3.64 -1.00 0.20 116.57 122.53 2hln h LYS 140 Ca 0.13 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.31 2hln h LYS 140 Cb 0.71 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 2hln h LYS 140 CO 0.05 0.83 0.07 0.28 -2.27 0.00 0.00 179.45 178.42 2hln h VAL 141 N 1.04 1.24 0.00 2.00 2.07 -0.96 -2.32 116.25 119.33 2hln h VAL 141 Ca 0.26 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.83 2hln h VAL 141 Cb 0.11 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2hln h VAL 141 CO -0.03 0.31 -0.29 0.00 0.02 0.00 0.00 177.57 177.57 2hln h ALA 142 N 0.94 1.29 -0.02 1.67 0.00 -0.75 -2.62 119.26 119.76 2hln h ALA 142 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2hln h ALA 142 Cb 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2hln h ALA 142 CO 0.01 0.37 -0.03 0.00 0.00 0.00 0.00 179.25 179.59 2hln n ALA 143 N -2.38 2.63 -2.69 0.00 0.00 0.02 -4.36 120.51 113.73 2hln n ALA 143 Ca -0.02 -0.46 -0.38 0.00 0.00 0.00 0.00 53.44 52.59 2hln n ALA 143 Cb 0.38 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.62 2hln n ALA 143 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2hln s ASP 144 N -2.06 6.52 0.49 0.00 3.68 -0.89 -4.88 116.67 119.52 2hln s ASP 144 Ca 0.36 0.61 0.26 0.00 2.13 0.00 0.00 52.55 55.91 2hln s ASP 144 Cb 0.21 -2.25 1.23 0.00 -1.45 0.00 0.00 42.92 40.66 2hln s ASP 144 CO 0.35 -0.05 1.96 0.11 0.13 0.00 0.00 175.17 177.68 2hln h LYS 145 N 7.11 0.00 0.00 4.34 1.57 -1.88 -2.53 116.57 125.19 2hln h LYS 145 Ca -0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 2hln h LYS 145 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2hln h LYS 145 CO 0.74 0.16 0.00 -1.71 -0.57 0.00 0.00 179.45 178.07 2hln n ASN 146 N -3.50 0.00 -0.42 0.86 5.15 -1.26 -2.98 115.26 113.11 2hln n ASN 146 Ca -0.01 -0.09 0.14 0.00 -0.60 0.00 0.00 54.58 54.02 2hln n ASN 146 Cb 0.32 -0.28 0.49 0.00 -0.53 0.00 0.00 39.78 39.78 2hln n ASN 146 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2hln n SER 147 N -1.28 1.38 -4.80 1.20 7.64 -0.95 -4.93 113.62 111.88 2hln n SER 147 Ca 0.12 -1.34 -0.34 0.00 1.01 0.00 0.00 58.87 58.32 2hln n SER 147 Cb 0.20 0.03 -0.05 0.00 -1.01 0.00 0.00 64.21 63.38 2hln n SER 147 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2hln s ARG 148 N -2.13 4.00 -1.24 1.43 0.52 -1.16 -4.04 118.95 116.32 2hln s ARG 148 Ca 0.34 1.29 -0.03 0.00 -0.52 0.00 0.00 55.73 56.81 2hln s ARG 148 Cb 0.21 -2.18 0.00 0.00 0.52 0.00 0.00 34.95 33.50 2hln s ARG 148 CO 0.38 -0.25 0.39 0.41 0.02 0.00 0.00 175.30 176.25 2hln n GLY 149 N -0.32 -0.26 0.00 -3.53 0.00 -0.59 -4.91 105.19 95.57 2hln n GLY 149 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2hln n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hln n ARG 150 N -3.17 2.71 0.00 1.61 1.74 -1.26 -5.02 116.66 113.28 2hln n ARG 150 Ca -0.11 -1.43 0.00 0.00 -0.77 0.00 0.00 57.85 55.55 2hln n ARG 150 Cb 0.60 -0.99 0.00 0.00 -1.02 0.00 0.00 32.46 31.05 2hln n ARG 150 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hln n GLY 151 N -0.46 -2.48 3.74 -0.13 0.00 -1.26 -4.71 105.19 99.88 2hln n GLY 151 Ca 0.00 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 2hln n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hln s VAL 152 N -0.94 3.27 0.09 1.61 1.01 -1.26 -4.64 120.40 119.54 2hln s VAL 152 Ca 0.00 1.07 0.05 0.00 0.00 0.00 0.00 61.98 63.10 2hln s VAL 152 Cb 0.00 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2hln s VAL 152 CO 0.00 0.17 -0.01 -0.76 0.00 0.00 0.00 175.10 174.50 2hln s LEU 153 N -0.31 3.41 -0.18 3.92 1.43 -0.33 -1.89 118.68 124.73 2hln s LEU 153 Ca 0.55 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2hln s LEU 153 Cb -0.36 -2.15 0.04 0.00 0.03 0.00 0.00 46.19 43.76 2hln s LEU 153 CO 0.39 0.17 -0.09 -0.69 0.23 0.00 0.00 176.35 176.36 2hln s VAL 154 N -1.31 1.46 -0.27 -1.59 1.01 0.28 -0.65 120.40 119.33 2hln s VAL 154 Ca 0.25 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 2hln s VAL 154 Cb -0.12 -1.54 0.04 0.00 0.00 0.00 0.00 36.38 34.76 2hln s VAL 154 CO 0.18 0.20 -0.04 -0.69 0.00 0.00 0.00 175.10 174.76 2hln s VAL 155 N 1.49 2.91 -0.06 2.92 1.01 -0.53 -0.75 120.40 127.40 2hln s VAL 155 Ca 0.00 -1.18 -0.14 0.00 0.00 0.00 0.00 61.98 60.66 2hln s VAL 155 Cb -0.15 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 33.69 2hln s VAL 155 CO -0.08 0.07 0.34 -0.76 0.00 0.00 0.00 175.10 174.66 2hln s LEU 156 N 1.29 0.74 -1.42 3.92 1.02 -1.15 -4.21 118.68 118.86 2hln s LEU 156 Ca -0.02 0.32 -0.07 0.00 0.02 0.00 0.00 54.13 54.38 2hln s LEU 156 Cb -0.18 1.29 0.04 0.00 0.02 0.00 0.00 46.19 47.36 2hln s LEU 156 CO -0.03 -0.34 0.86 -3.20 0.02 0.00 0.00 176.35 173.66 2hln n ASN 157 N 1.82 -3.13 0.00 2.29 5.15 -1.26 -1.77 115.26 118.36 2hln n ASN 157 Ca -0.19 -0.79 0.00 0.00 -0.60 0.00 0.00 54.58 53.01 2hln n ASN 157 Cb 0.57 -4.03 0.00 0.00 -0.53 0.00 0.00 39.78 35.78 2hln n ASN 157 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2hln n ASP 158 N -2.95 -4.48 -4.77 1.20 8.00 -1.26 -4.98 116.55 107.31 2hln n ASP 158 Ca -0.13 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.09 2hln n ASP 158 Cb 0.60 -2.51 -0.06 0.00 -0.02 0.00 0.00 41.12 39.13 2hln n ASP 158 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2hln s ARG 159 N -1.32 2.81 -0.36 -1.24 1.81 -0.73 -0.00 118.95 119.91 2hln s ARG 159 Ca 0.00 -0.82 0.04 0.00 -1.72 0.00 0.00 55.73 53.22 2hln s ARG 159 Cb 0.00 -2.64 0.10 0.00 -0.45 0.00 0.00 34.95 31.97 2hln s ARG 159 CO 0.00 0.52 0.08 0.42 -0.68 0.00 0.00 175.30 175.64 2hln s ILE 160 N -1.57 2.18 0.11 1.52 1.01 0.51 -2.96 121.20 122.00 2hln s ILE 160 Ca 0.29 -2.39 -0.02 0.00 0.00 0.00 0.00 60.65 58.53 2hln s ILE 160 Cb -0.11 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.71 2hln s ILE 160 CO 0.22 -0.64 0.29 -0.83 0.00 0.00 0.00 174.94 173.98 2hln s GLY 161 N 0.80 2.15 0.18 6.18 0.00 0.07 -0.90 107.32 115.81 2hln s GLY 161 Ca 0.12 -0.74 -0.29 0.00 0.00 0.00 0.00 44.72 43.80 2hln s GLY 161 CO -0.08 -0.70 0.91 -0.45 0.00 0.00 0.00 173.10 172.78 2hln s SER 162 N -2.57 7.54 0.57 1.64 0.15 -1.26 -0.55 113.70 119.21 2hln s SER 162 Ca 0.38 1.82 0.25 0.00 0.70 0.00 0.00 55.95 59.10 2hln s SER 162 Cb -0.12 -2.58 1.63 0.00 -1.71 0.00 0.00 66.02 63.24 2hln s SER 162 CO 0.27 0.09 2.22 0.00 1.20 0.00 0.00 173.24 177.01 2hln h ALA 163 N 4.71 1.70 -0.03 5.45 0.00 -1.71 0.17 119.26 129.55 2hln h ALA 163 Ca -0.45 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.31 2hln h ALA 163 Cb 1.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2hln h ALA 163 CO 0.69 -0.01 -0.66 -0.09 0.00 0.00 0.00 179.25 179.18 2hln h ARG 164 N 0.00 0.12 0.00 0.00 9.65 -1.91 -3.37 114.38 118.87 2hln h ARG 164 Ca 0.00 -0.10 -0.21 0.00 -1.10 0.00 0.00 59.98 58.58 2hln h ARG 164 Cb 0.02 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 2hln h ARG 164 CO -0.00 0.74 -1.72 1.19 2.80 0.00 0.00 179.97 182.98 2hln n PHE 165 N -3.79 0.00 -1.66 2.20 3.72 -0.63 -4.95 117.46 112.35 2hln n PHE 165 Ca -0.02 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.94 2hln n PHE 165 Cb 0.66 -0.47 -0.01 0.00 -0.94 0.00 0.00 39.48 38.71 2hln n PHE 165 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 176.76 178.22 2hln n ILE 166 N -3.39 1.72 -3.56 4.37 0.13 0.49 -4.81 119.36 114.31 2hln n ILE 166 Ca -0.25 -0.43 -0.11 0.00 -1.10 0.00 0.00 62.75 60.86 2hln n ILE 166 Cb 0.70 -1.37 -0.04 0.00 -0.84 0.00 0.00 39.64 38.09 2hln n ILE 166 CO 0.00 0.00 0.00 -0.94 2.80 0.00 0.00 176.55 178.41 2hln s SER 167 N -0.23 -0.37 -0.46 9.51 1.04 -1.12 -4.83 113.70 117.24 2hln s SER 167 Ca 0.60 -0.14 -0.28 0.00 0.48 0.00 0.00 55.95 56.60 2hln s SER 167 Cb -0.63 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.01 2hln s SER 167 CO 0.58 -0.86 1.42 -0.75 0.98 0.00 0.00 173.24 174.61 2hln s LYS 168 N -3.55 3.47 0.09 4.02 2.20 -1.26 -2.50 119.74 122.21 2hln s LYS 168 Ca 0.01 0.79 0.21 0.00 -0.36 0.00 0.00 55.97 56.62 2hln s LYS 168 Cb 0.01 -4.06 -0.14 0.00 -1.51 0.00 0.00 37.83 32.12 2hln s LYS 168 CO -0.11 -1.70 0.78 0.25 -0.36 0.00 0.00 175.35 174.22 2hln n THR 169 N 7.03 0.53 -4.77 3.43 -2.24 0.05 -4.92 114.28 113.38 2hln n THR 169 Ca 0.15 -0.57 -0.25 0.00 -2.27 0.00 0.00 64.05 61.12 2hln n THR 169 Cb 0.48 -0.29 -0.15 0.00 -2.10 0.00 0.00 70.33 68.28 2hln n THR 169 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2hln s ASN 170 N -5.15 2.17 0.25 3.42 3.84 -1.24 -5.06 114.94 113.16 2hln s ASN 170 Ca -0.04 -0.38 -0.06 0.00 0.21 0.00 0.00 52.86 52.59 2hln s ASN 170 Cb 0.11 -0.22 0.28 0.00 -0.55 0.00 0.00 41.25 40.87 2hln s ASN 170 CO 0.83 0.19 1.91 0.00 -2.79 0.00 0.00 177.10 177.24 2hln h ALA 171 N 5.43 1.25 0.00 1.71 0.00 -1.96 -3.39 119.26 122.30 2hln h ALA 171 Ca -0.39 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2hln h ALA 171 Cb 1.15 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2hln h ALA 171 CO 0.47 0.56 0.00 0.43 0.00 0.00 0.00 179.25 180.71 2hln n SER 172 N -4.44 0.04 -4.86 0.00 7.64 -1.26 -5.12 113.62 105.62 2hln n SER 172 Ca 0.12 -0.99 -0.31 0.00 1.01 0.00 0.00 58.87 58.70 2hln n SER 172 Cb 0.05 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.27 2hln n SER 172 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2hln s THR 173 N -0.00 4.51 0.28 0.44 -4.23 -1.26 -4.97 115.64 110.40 2hln s THR 173 Ca 0.00 0.82 0.12 0.00 -1.18 0.00 0.00 61.69 61.45 2hln s THR 173 Cb 0.00 -3.77 0.03 0.00 1.34 0.00 0.00 72.50 70.09 2hln s THR 173 CO 0.00 -1.07 1.68 -0.07 -0.54 0.00 0.00 174.62 174.62 2hln h LEU 174 N -0.41 0.00 -3.46 4.79 3.38 -1.97 -3.15 115.31 114.50 2hln h LEU 174 Ca -0.44 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.39 2hln h LEU 174 Cb 1.20 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.87 2hln h LEU 174 CO 0.61 0.53 0.17 -0.90 0.09 0.00 0.00 178.44 178.95 2hln n ASP 175 N -3.81 4.83 -0.24 -0.43 3.85 -1.26 -4.63 116.55 114.85 2hln n ASP 175 Ca -0.01 -3.02 0.12 0.00 -0.71 0.00 0.00 54.79 51.16 2hln n ASP 175 Cb 0.55 -0.71 0.39 0.00 -1.35 0.00 0.00 41.12 40.01 2hln n ASP 175 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2hln h THR 176 N 2.82 0.86 -3.22 2.12 1.03 -1.86 -3.40 112.91 111.26 2hln h THR 176 Ca 0.17 -0.23 -0.56 0.00 -0.01 0.00 0.00 66.41 65.79 2hln h THR 176 Cb 2.10 0.14 -0.06 0.00 -1.07 0.00 0.00 68.15 69.25 2hln h THR 176 CO 0.61 0.12 1.03 -0.36 -0.01 0.00 0.00 175.52 176.91 2hln s PHE 177 N -5.63 2.50 0.33 0.00 0.40 -1.26 -0.77 117.98 113.54 2hln s PHE 177 Ca -0.10 0.56 0.05 0.00 -0.60 0.00 0.00 56.93 56.84 2hln s PHE 177 Cb 0.21 -4.42 -0.03 0.00 0.51 0.00 0.00 43.02 39.30 2hln s PHE 177 CO 0.78 -1.73 0.22 0.15 0.70 0.00 0.00 175.22 175.34 2hln s LYS 178 N 5.02 1.70 -0.49 0.44 1.02 -1.04 -4.91 119.74 121.48 2hln s LYS 178 Ca 0.51 -1.99 0.07 0.00 0.02 0.00 0.00 55.97 54.58 2hln s LYS 178 Cb -0.10 0.08 0.19 0.00 -0.52 0.00 0.00 37.83 37.48 2hln s LYS 178 CO 0.28 -0.56 0.66 0.00 -0.92 0.00 0.00 175.35 174.81 2hln s ALA 179 N -3.51 -1.55 0.33 5.17 0.00 -1.26 -2.78 121.76 118.15 2hln s ALA 179 Ca 0.37 -0.70 0.11 0.00 0.00 0.00 0.00 51.96 51.74 2hln s ALA 179 Cb 0.03 -2.53 0.95 0.00 0.00 0.00 0.00 23.12 21.57 2hln s ALA 179 CO 0.22 -2.20 1.71 -1.35 0.00 0.00 0.00 175.76 174.15 2hln h PRO 180 N 5.27 0.49 0.00 0.00 0.11 -1.95 1.42 132.00 137.34 2hln h PRO 180 Ca 0.09 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.17 2hln h PRO 180 Cb 1.08 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2hln h PRO 180 CO 0.08 0.32 -0.64 0.39 -0.21 0.00 0.00 178.00 177.94 2hln n GLU 181 N -4.92 0.02 0.00 1.05 -0.58 -1.26 -4.44 120.64 110.51 2hln n GLU 181 Ca 0.28 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.02 2hln n GLU 181 Cb 0.82 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 30.18 2hln n GLU 181 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2hln n GLU 182 N -1.54 2.36 0.00 3.49 4.71 -0.41 -5.14 120.64 124.12 2hln n GLU 182 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 2hln n GLU 182 Cb 0.34 -0.76 0.00 0.00 -1.01 0.00 0.00 31.44 30.01 2hln n GLU 182 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2hln n GLY 183 N 1.55 0.50 3.65 0.62 0.00 0.47 -4.84 105.19 107.14 2hln n GLY 183 Ca 0.00 -0.82 -0.25 0.00 0.00 0.00 0.00 46.02 44.95 2hln n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hln s TYR 184 N 0.00 2.76 0.19 1.61 1.51 -1.26 -4.54 117.35 117.61 2hln s TYR 184 Ca 0.00 -0.18 -0.03 0.00 -1.01 0.00 0.00 57.07 55.85 2hln s TYR 184 Cb 0.00 -1.29 0.10 0.00 -0.11 0.00 0.00 41.96 40.65 2hln s TYR 184 CO 0.00 0.56 1.48 -0.07 -1.11 0.00 0.00 175.55 176.41 2hln h LEU 185 N 2.38 0.57 -7.76 -1.29 3.38 -1.27 -3.38 115.31 107.94 2hln h LEU 185 Ca -0.46 -0.33 0.16 0.00 0.09 0.00 0.00 57.88 57.34 2hln h LEU 185 Cb 1.22 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.74 2hln h LEU 185 CO 0.58 1.05 0.47 -0.83 0.09 0.00 0.00 178.44 179.80 2hln s GLY 186 N -4.19 -0.12 0.15 0.83 0.00 -1.09 0.12 107.32 103.02 2hln s GLY 186 Ca -0.07 -0.05 0.05 0.00 0.00 0.00 0.00 44.72 44.65 2hln s GLY 186 CO 0.84 0.39 -0.10 -1.34 0.00 0.00 0.00 173.10 172.89 2hln s VAL 187 N -3.08 1.22 -0.35 1.40 -7.23 -0.34 -0.36 120.40 111.65 2hln s VAL 187 Ca 0.14 -2.07 0.02 0.00 -1.81 0.00 0.00 61.98 58.25 2hln s VAL 187 Cb -0.02 -1.88 0.10 0.00 0.56 0.00 0.00 36.38 35.13 2hln s VAL 187 CO 0.04 -0.72 0.07 -0.63 -0.31 0.00 0.00 175.10 173.55 2hln s ILE 188 N -3.30 2.58 -0.06 -0.62 1.01 0.99 -1.07 121.20 120.74 2hln s ILE 188 Ca 0.18 -2.15 0.03 0.00 0.00 0.00 0.00 60.65 58.71 2hln s ILE 188 Cb 0.02 -2.81 0.00 0.00 0.01 0.00 0.00 42.46 39.69 2hln s ILE 188 CO 0.01 -0.54 -0.16 -0.63 0.00 0.00 0.00 174.94 173.62 2hln s ILE 189 N 1.00 1.35 -1.42 2.92 -1.09 -0.65 -4.78 121.20 118.53 2hln s ILE 189 Ca 0.08 -0.64 -0.09 0.00 -2.23 0.00 0.00 60.65 57.77 2hln s ILE 189 Cb -0.20 -1.18 0.04 0.00 -1.58 0.00 0.00 42.46 39.54 2hln s ILE 189 CO -0.06 0.40 0.96 0.61 -1.23 0.00 0.00 174.94 175.61 2hln n GLY 190 N 3.42 -0.45 3.23 6.18 0.00 -1.26 -1.96 105.19 114.35 2hln n GLY 190 Ca -0.20 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 2hln n GLY 190 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hln n ASP 191 N -2.95 -6.26 -3.95 1.61 4.64 -1.26 -5.01 116.55 103.38 2hln n ASP 191 Ca -0.07 -0.38 -0.10 0.00 -1.38 0.00 0.00 54.79 52.86 2hln n ASP 191 Cb 0.58 -5.00 -0.10 0.00 -1.04 0.00 0.00 41.12 35.55 2hln n ASP 191 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 2hln s LYS 192 N -5.93 0.45 -0.18 -0.67 1.02 -0.83 -5.15 119.74 108.44 2hln s LYS 192 Ca 0.41 -0.63 -0.06 0.00 0.02 0.00 0.00 55.97 55.70 2hln s LYS 192 Cb -0.18 0.17 -0.03 0.00 -0.52 0.00 0.00 37.83 37.27 2hln s LYS 192 CO 0.51 -0.09 0.03 0.42 -0.92 0.00 0.00 175.35 175.29 2hln s ILE 193 N -1.89 4.43 -0.32 2.17 1.01 -1.26 -1.63 121.20 123.70 2hln s ILE 193 Ca -0.11 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.41 2hln s ILE 193 Cb -0.06 -2.99 0.09 0.00 0.01 0.00 0.00 42.46 39.51 2hln s ILE 193 CO -0.02 0.45 0.03 -0.31 0.00 0.00 0.00 174.94 175.09 2hln s TYR 194 N 0.55 3.53 0.10 3.97 1.51 -0.23 -4.99 117.35 121.78 2hln s TYR 194 Ca 0.01 -2.80 -0.29 0.00 -1.01 0.00 0.00 57.07 52.99 2hln s TYR 194 Cb -0.13 -2.67 -0.06 0.00 -0.11 0.00 0.00 41.96 38.99 2hln s TYR 194 CO 0.02 -0.93 0.92 0.71 -1.11 0.00 0.00 175.55 175.16 2hln s TYR 195 N 0.99 3.80 -0.09 2.71 1.51 -1.26 -1.20 117.35 123.80 2hln s TYR 195 Ca 0.08 1.74 -0.06 0.00 -1.01 0.00 0.00 57.07 57.81 2hln s TYR 195 Cb -0.19 -3.01 -0.04 0.00 -0.11 0.00 0.00 41.96 38.61 2hln s TYR 195 CO -0.09 0.22 -0.14 1.04 -1.11 0.00 0.00 175.55 175.47 2hln n GLN 196 N 2.80 0.23 -4.37 -0.62 6.02 0.32 -4.94 117.38 116.83 2hln n GLN 196 Ca 0.01 0.10 -0.19 0.00 -0.01 0.00 0.00 57.00 56.92 2hln n GLN 196 Cb 0.49 -0.89 -0.10 0.00 1.02 0.00 0.00 30.24 30.76 2hln n GLN 196 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2hln s THR 197 N -2.24 1.25 0.02 5.09 -4.23 -0.70 -5.04 115.64 109.78 2hln s THR 197 Ca -0.15 -2.06 0.07 0.00 -1.18 0.00 0.00 61.69 58.37 2hln s THR 197 Cb 0.05 -2.40 -0.02 0.00 1.34 0.00 0.00 72.50 71.47 2hln s THR 197 CO 0.19 -0.30 -0.21 -0.13 -0.54 0.00 0.00 174.62 173.63 2hln s ARG 198 N -3.82 1.52 -0.03 3.99 0.52 -1.26 -4.62 118.95 115.26 2hln s ARG 198 Ca 0.29 -0.84 -0.30 0.00 -0.52 0.00 0.00 55.73 54.36 2hln s ARG 198 Cb 0.05 -1.56 -0.06 0.00 0.52 0.00 0.00 34.95 33.90 2hln s ARG 198 CO 0.10 0.41 1.69 -1.17 0.02 0.00 0.00 175.30 176.36 2hln s LEU 199 N -0.85 4.34 -0.91 2.53 2.96 -1.26 -4.91 118.68 120.59 2hln s LEU 199 Ca 0.08 2.32 -0.02 0.00 -0.22 0.00 0.00 54.13 56.29 2hln s LEU 199 Cb -0.08 -3.54 0.33 0.00 0.50 0.00 0.00 46.19 43.40 2hln s LEU 199 CO 0.01 -0.93 1.99 -0.67 -1.32 0.00 0.00 176.35 175.42 2hln n ASP 200 N 6.98 7.46 -4.15 3.68 2.03 -1.26 -4.92 116.55 126.38 2hln n ASP 200 Ca 0.17 -3.76 -0.10 0.00 0.52 0.00 0.00 54.79 51.62 2hln n ASP 200 Cb 0.42 -1.11 -0.10 0.00 -0.72 0.00 0.00 41.12 39.61 2hln n ASP 200 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2hln s LYS 201 N -4.06 1.05 0.09 -0.67 -0.14 -1.26 -5.07 119.74 109.67 2hln s LYS 201 Ca 0.48 -1.48 -0.30 0.00 -1.36 0.00 0.00 55.97 53.30 2hln s LYS 201 Cb 0.35 0.26 -0.05 0.00 -1.68 0.00 0.00 37.83 36.71 2hln s LYS 201 CO -0.31 -0.32 0.98 0.08 -0.76 0.00 0.00 175.35 175.02 2hln s VAL 202 N -4.08 4.54 0.29 3.17 1.01 -0.51 -5.02 120.40 119.80 2hln s VAL 202 Ca 0.29 2.03 -0.19 0.00 0.00 0.00 0.00 61.98 64.11 2hln s VAL 202 Cb 0.07 -4.30 0.02 0.00 0.00 0.00 0.00 36.38 32.17 2hln s VAL 202 CO 0.05 0.27 0.69 -1.38 0.00 0.00 0.00 175.10 174.73 2hln s HIS 203 N 0.25 -0.06 0.00 5.22 -3.43 -1.26 -4.66 115.29 111.36 2hln s HIS 203 Ca 0.49 -0.41 0.00 0.00 -0.80 0.00 0.00 55.06 54.34 2hln s HIS 203 Cb -0.23 0.63 0.00 0.00 -1.43 0.00 0.00 32.58 31.55 2hln s HIS 203 CO 0.30 -1.24 0.00 0.25 -2.00 0.00 0.00 174.74 172.05 2hln n THR 204 N -0.46 0.00 0.32 -5.38 -2.24 0.11 -1.58 114.28 105.06 2hln n THR 204 Ca -0.04 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 61.92 2hln n THR 204 Cb 0.60 0.00 0.98 0.00 -2.10 0.00 0.00 70.33 69.80 2hln n THR 204 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2hln h THR 205 N 0.00 0.00 -0.23 4.28 1.35 -1.77 -1.02 112.91 115.52 2hln h THR 205 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2hln h THR 205 Cb 0.00 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 67.22 2hln h THR 205 CO 0.00 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.81 2hln n ARG 206 N -2.91 1.91 -2.85 4.72 1.74 -0.62 -4.99 116.66 113.66 2hln n ARG 206 Ca -0.02 -1.80 -0.37 0.00 -0.77 0.00 0.00 57.85 54.88 2hln n ARG 206 Cb 0.21 -1.33 -0.06 0.00 -1.02 0.00 0.00 32.46 30.26 2hln n ARG 206 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2hln s SER 207 N -1.15 7.33 0.00 0.55 0.15 -0.39 -4.74 113.70 115.44 2hln s SER 207 Ca 0.24 1.76 0.25 0.00 0.70 0.00 0.00 55.95 58.90 2hln s SER 207 Cb 0.15 -2.55 0.41 0.00 -1.71 0.00 0.00 66.02 62.32 2hln s SER 207 CO 0.20 -0.00 1.35 1.33 1.20 0.00 0.00 173.24 177.32 2hln n VAL 208 N 0.78 0.00 -2.62 4.45 0.24 -1.26 -4.87 118.33 115.04 2hln n VAL 208 Ca 0.00 -0.06 -0.43 0.00 -2.04 0.00 0.00 64.34 61.81 2hln n VAL 208 Cb 0.50 0.50 -0.02 0.00 -1.47 0.00 0.00 33.84 33.35 2hln n VAL 208 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2hln s PHE 209 N -2.82 3.16 -0.10 6.34 0.08 -1.26 -5.02 117.98 118.37 2hln s PHE 209 Ca 0.15 1.24 0.00 0.00 0.12 0.00 0.00 56.93 58.44 2hln s PHE 209 Cb 0.18 -3.59 0.02 0.00 -0.57 0.00 0.00 43.02 39.06 2hln s PHE 209 CO 0.67 -0.78 -0.09 0.34 -0.10 0.00 0.00 175.22 175.25 2hln s ASP 210 N 1.62 2.06 -0.18 1.36 2.15 -1.26 -4.37 116.67 118.05 2hln s ASP 210 Ca 0.46 -0.30 0.15 0.00 0.43 0.00 0.00 52.55 53.29 2hln s ASP 210 Cb -0.13 -0.84 0.38 0.00 -0.30 0.00 0.00 42.92 42.03 2hln s ASP 210 CO 0.13 -0.08 1.24 1.33 -0.17 0.00 0.00 175.17 177.63 2hln n VAL 211 N 4.64 2.11 -0.02 1.11 0.24 -1.26 -4.77 118.33 120.37 2hln n VAL 211 Ca -0.15 -2.52 -0.09 0.00 -2.04 0.00 0.00 64.34 59.53 2hln n VAL 211 Cb 0.50 -0.25 -0.04 0.00 -1.47 0.00 0.00 33.84 32.59 2hln n VAL 211 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 2hln h THR 212 N 0.64 0.91 -0.93 3.34 2.02 -1.95 -2.74 112.91 114.20 2hln h THR 212 Ca 0.02 -0.03 -0.48 0.00 0.77 0.00 0.00 66.41 66.70 2hln h THR 212 Cb 1.14 0.83 -0.29 0.00 -1.74 0.00 0.00 68.15 68.09 2hln h THR 212 CO 0.08 0.01 0.61 0.59 0.37 0.00 0.00 175.52 177.18 2hln n ASN 213 N -5.10 3.74 -4.41 4.18 3.02 -1.26 -4.91 115.26 110.51 2hln n ASN 213 Ca -0.03 -3.50 -0.35 0.00 -0.03 0.00 0.00 54.58 50.67 2hln n ASN 213 Cb 0.08 -0.82 -0.13 0.00 -0.61 0.00 0.00 39.78 38.31 2hln n ASN 213 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2hln s VAL 214 N -3.09 3.80 -0.14 2.41 1.01 -1.04 -4.99 120.40 118.38 2hln s VAL 214 Ca 0.53 -0.36 0.06 0.00 0.00 0.00 0.00 61.98 62.21 2hln s VAL 214 Cb 0.45 -2.72 -0.23 0.00 0.00 0.00 0.00 36.38 33.88 2hln s VAL 214 CO 0.10 0.43 0.29 0.47 0.00 0.00 0.00 175.10 176.40 2hln n ASP 215 N 4.36 1.28 -3.85 3.32 10.43 -1.26 -4.95 116.55 125.89 2hln n ASP 215 Ca -0.17 0.17 -0.16 0.00 2.57 0.00 0.00 54.79 57.20 2hln n ASP 215 Cb 0.52 -0.16 -0.16 0.00 1.84 0.00 0.00 41.12 43.16 2hln n ASP 215 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 2hln s LYS 216 N -2.55 0.27 0.23 -1.24 2.20 -1.26 -4.99 119.74 112.39 2hln s LYS 216 Ca -0.17 0.02 -0.03 0.00 -0.36 0.00 0.00 55.97 55.44 2hln s LYS 216 Cb 0.07 -0.39 -0.05 0.00 -1.51 0.00 0.00 37.83 35.96 2hln s LYS 216 CO 0.77 -0.07 0.45 -0.51 -0.36 0.00 0.00 175.35 175.62 2hln s LEU 217 N 0.66 4.17 0.51 5.43 1.43 -1.26 -5.07 118.68 124.55 2hln s LEU 217 Ca -0.07 0.53 -0.22 0.00 -1.03 0.00 0.00 54.13 53.34 2hln s LEU 217 Cb -0.10 -3.31 -0.06 0.00 0.03 0.00 0.00 46.19 42.76 2hln s LEU 217 CO -0.01 -0.09 1.30 -2.84 0.23 0.00 0.00 176.35 174.94 2hln s PRO 218 N -3.34 3.38 0.03 1.29 0.02 -1.26 -4.98 135.00 130.14 2hln s PRO 218 Ca 0.41 2.11 -0.29 0.00 0.02 0.00 0.00 61.00 63.24 2hln s PRO 218 Cb -0.11 -2.34 -0.04 0.00 0.02 0.00 0.00 34.50 32.03 2hln s PRO 218 CO 0.29 -0.96 0.95 0.00 -0.33 0.00 0.00 177.00 176.95 2hln s ALA 219 N -1.37 3.20 -0.06 -1.55 0.00 -1.26 -4.88 121.76 115.85 2hln s ALA 219 Ca 0.68 0.52 0.00 0.00 0.00 0.00 0.00 51.96 53.17 2hln s ALA 219 Cb -0.37 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.48 2hln s ALA 219 CO 0.44 -0.15 -0.03 0.08 0.00 0.00 0.00 175.76 176.10 2hln s VAL 220 N 0.66 0.51 0.24 0.00 1.01 -1.26 -1.37 120.40 120.19 2hln s VAL 220 Ca 0.49 -0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.47 2hln s VAL 220 Cb -0.22 -0.58 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 2hln s VAL 220 CO 0.28 0.24 0.28 -1.81 0.00 0.00 0.00 175.10 174.09 2hln s ASP 221 N 1.25 5.94 -0.16 3.32 1.01 -0.99 -4.97 116.67 122.07 2hln s ASP 221 Ca -0.06 -0.08 0.01 0.00 0.71 0.00 0.00 52.55 53.13 2hln s ASP 221 Cb -0.14 -1.64 0.02 0.00 1.01 0.00 0.00 42.92 42.17 2hln s ASP 221 CO -0.02 -0.05 -0.16 -0.63 0.21 0.00 0.00 175.17 174.52 2hln s ILE 222 N -2.05 1.76 -0.20 0.77 1.01 -1.26 -0.36 121.20 120.87 2hln s ILE 222 Ca 0.33 -0.75 -0.03 0.00 0.00 0.00 0.00 60.65 60.20 2hln s ILE 222 Cb -0.08 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.75 2hln s ILE 222 CO 0.27 0.49 -0.05 -0.63 0.00 0.00 0.00 174.94 175.02 2hln s ILE 223 N 1.41 3.41 0.41 2.92 1.01 -0.25 -4.98 121.20 125.13 2hln s ILE 223 Ca 0.05 -0.49 -0.24 0.00 0.00 0.00 0.00 60.65 59.97 2hln s ILE 223 Cb -0.13 -2.53 -0.09 0.00 0.01 0.00 0.00 42.46 39.73 2hln s ILE 223 CO -0.12 0.45 1.06 -0.47 0.00 0.00 0.00 174.94 175.86 2hln s TYR 224 N 1.17 3.21 -0.22 3.97 5.04 -1.26 -1.41 117.35 127.85 2hln s TYR 224 Ca 0.02 1.63 -0.07 0.00 -2.44 0.00 0.00 57.07 56.21 2hln s TYR 224 Cb -0.14 -3.16 -0.03 0.00 0.35 0.00 0.00 41.96 38.98 2hln s TYR 224 CO -0.01 -0.74 0.06 0.20 -1.34 0.00 0.00 175.55 173.71 2hln s GLY 225 N -1.56 1.80 0.31 8.97 0.00 0.12 -4.87 107.32 112.11 2hln s GLY 225 Ca 0.59 -0.98 -0.18 0.00 0.00 0.00 0.00 44.72 44.15 2hln s GLY 225 CO 0.28 0.32 0.71 -2.52 0.00 0.00 0.00 173.10 171.89 2hln s TYR 226 N 1.10 0.03 0.29 1.90 1.13 -1.26 -4.27 117.35 116.27 2hln s TYR 226 Ca 0.04 -0.54 -0.30 0.00 -1.41 0.00 0.00 57.07 54.86 2hln s TYR 226 Cb -0.14 0.66 -0.11 0.00 -1.10 0.00 0.00 41.96 41.27 2hln s TYR 226 CO 0.03 -1.32 1.51 -0.65 -2.51 0.00 0.00 175.55 172.61 2hln s GLN 227 N -3.35 4.19 -1.48 -3.49 -0.21 -1.26 -2.44 119.66 111.61 2hln s GLN 227 Ca 0.15 2.45 -0.02 0.00 0.02 0.00 0.00 55.36 57.96 2hln s GLN 227 Cb -0.05 -3.05 0.00 0.00 1.00 0.00 0.00 33.01 30.91 2hln s GLN 227 CO 0.09 -0.52 0.20 -0.25 -2.12 0.00 0.00 175.29 172.70 2hln n ASP 228 N 1.95 -5.38 -4.71 5.90 8.00 -1.26 -4.94 116.55 116.11 2hln n ASP 228 Ca 0.06 -0.10 -0.42 0.00 0.71 0.00 0.00 54.79 55.04 2hln n ASP 228 Cb 0.39 -4.36 -0.03 0.00 -0.02 0.00 0.00 41.12 37.10 2hln n ASP 228 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2hln s ASP 229 N -2.39 6.59 0.24 -2.24 -4.77 -1.02 -4.96 116.67 108.11 2hln s ASP 229 Ca 0.10 2.59 -0.30 0.00 -3.30 0.00 0.00 52.55 51.64 2hln s ASP 229 Cb -0.04 -2.59 -0.10 0.00 -1.09 0.00 0.00 42.92 39.10 2hln s ASP 229 CO 0.12 -0.84 1.36 -2.16 0.70 0.00 0.00 175.17 174.36 2hln s PRO 230 N 1.46 4.34 0.36 2.11 0.04 -1.26 -4.70 135.00 137.35 2hln s PRO 230 Ca 0.71 2.18 0.20 0.00 0.04 0.00 0.00 61.00 64.13 2hln s PRO 230 Cb -0.43 -3.14 0.21 0.00 0.04 0.00 0.00 34.50 31.18 2hln s PRO 230 CO 0.31 -0.31 1.52 1.49 0.04 0.00 0.00 177.00 180.06 2hln h GLU 231 N 4.90 0.00 0.00 4.56 4.81 -1.93 -3.29 114.58 123.63 2hln h GLU 231 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2hln h GLU 231 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2hln h GLU 231 CO 0.75 0.21 0.00 2.48 -0.73 0.00 0.00 179.01 181.73 2hln n TYR 232 N -3.14 0.65 0.05 0.92 0.18 -1.26 -2.15 117.16 112.41 2hln n TYR 232 Ca 0.03 0.27 -0.04 0.00 1.88 0.00 0.00 57.90 60.04 2hln n TYR 232 Cb 0.62 -0.94 0.19 0.00 -0.38 0.00 0.00 39.34 38.83 2hln n TYR 232 CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 2hln h MET 233 N 0.00 0.38 -0.20 -3.48 2.86 -1.99 -1.78 114.93 110.73 2hln h MET 233 Ca 0.00 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.33 2hln h MET 233 Cb 0.27 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2hln h MET 233 CO 0.00 0.70 -0.41 1.88 1.06 0.00 0.00 176.91 180.14 2hln h TYR 234 N 0.32 0.79 -0.52 -0.22 -1.99 -1.68 -2.94 116.97 110.73 2hln h TYR 234 Ca 0.03 -0.29 0.00 0.00 2.00 0.00 0.00 58.73 60.48 2hln h TYR 234 Cb 0.81 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 39.37 2hln h TYR 234 CO 0.02 1.05 0.34 -0.44 -0.00 0.00 0.00 178.16 179.14 2hln h ASP 235 N 0.31 0.60 -0.24 3.88 3.32 -1.52 -1.36 116.42 121.42 2hln h ASP 235 Ca 0.00 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 2hln h ASP 235 Cb 1.02 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 2hln h ASP 235 CO 0.09 0.44 -0.16 0.00 -1.72 0.00 0.00 179.24 177.88 2hln h ALA 236 N 1.67 1.03 -0.15 3.45 0.00 -1.26 -1.34 119.26 122.65 2hln h ALA 236 Ca 0.19 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 2hln h ALA 236 Cb -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2hln h ALA 236 CO -0.04 0.58 -0.59 0.77 0.00 0.00 0.00 179.25 179.97 2hln h SER 237 N 0.60 0.57 -0.18 0.00 0.02 -1.16 -3.12 113.55 110.29 2hln h SER 237 Ca 0.10 -0.32 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 2hln h SER 237 Cb 0.62 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2hln h SER 237 CO 0.04 1.03 -0.02 0.40 -1.14 0.00 0.00 176.83 177.14 2hln h ILE 238 N 0.38 1.27 -0.26 3.27 2.04 -1.02 -2.75 117.51 120.45 2hln h ILE 238 Ca -0.00 -0.95 -0.00 0.00 1.00 0.00 0.00 64.86 64.91 2hln h ILE 238 Cb 1.14 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 2hln h ILE 238 CO 0.11 0.28 0.16 0.11 0.00 0.00 0.00 178.15 178.81 2hln h LYS 239 N 0.07 0.34 -0.42 2.37 1.79 -1.30 -0.37 116.57 119.05 2hln h LYS 239 Ca 0.05 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2hln h LYS 239 Cb 0.44 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.02 2hln h LYS 239 CO 0.01 0.24 0.00 0.72 -1.08 0.00 0.00 179.45 179.34 2hln n HIS 240 N -4.48 0.56 -3.81 -1.35 8.25 -1.18 -4.96 115.22 108.24 2hln n HIS 240 Ca 0.01 -0.26 -0.25 0.00 -0.26 0.00 0.00 57.72 56.96 2hln n HIS 240 Cb 0.08 -0.04 0.01 0.00 1.12 0.00 0.00 29.99 31.17 2hln n HIS 240 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hln n GLY 241 N 1.00 -0.41 3.82 -1.41 0.00 -0.15 -4.98 105.19 103.06 2hln n GLY 241 Ca 0.12 0.21 -0.32 0.00 0.00 0.00 0.00 46.02 46.03 2hln n GLY 241 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hln s VAL 242 N -3.77 4.03 -0.07 1.61 -7.23 -1.05 -4.91 120.40 109.00 2hln s VAL 242 Ca 0.10 0.88 0.14 0.00 -1.81 0.00 0.00 61.98 61.30 2hln s VAL 242 Cb -0.04 -3.47 -0.17 0.00 0.56 0.00 0.00 36.38 33.27 2hln s VAL 242 CO 0.86 -0.64 0.82 0.11 -0.31 0.00 0.00 175.10 175.93 2hln h LYS 243 N 0.24 0.00 -3.63 4.82 1.79 -1.58 -3.45 116.57 114.75 2hln h LYS 243 Ca -0.46 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 57.90 2hln h LYS 243 Cb 1.21 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 31.70 2hln h LYS 243 CO 0.58 0.43 -0.39 0.20 -1.08 0.00 0.00 179.45 179.19 2hln s GLY 244 N -4.90 0.06 -0.06 3.86 0.00 -1.14 -2.16 107.32 102.97 2hln s GLY 244 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 44.72 44.32 2hln s GLY 244 CO 0.81 -0.55 -0.04 -0.42 0.00 0.00 0.00 173.10 172.90 2hln s ILE 245 N -2.88 0.54 -0.26 0.90 1.01 -0.74 -2.35 121.20 117.41 2hln s ILE 245 Ca -0.03 -0.08 -0.10 0.00 0.00 0.00 0.00 60.65 60.45 2hln s ILE 245 Cb 0.00 -0.60 -0.05 0.00 0.01 0.00 0.00 42.46 41.83 2hln s ILE 245 CO -0.06 0.25 0.15 -0.69 0.00 0.00 0.00 174.94 174.59 2hln s VAL 246 N 1.23 5.12 -0.46 2.92 1.01 0.51 -1.32 120.40 129.40 2hln s VAL 246 Ca -0.06 0.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.86 2hln s VAL 246 Cb -0.14 -3.41 0.06 0.00 0.00 0.00 0.00 36.38 32.89 2hln s VAL 246 CO -0.02 0.31 0.43 -0.47 0.00 0.00 0.00 175.10 175.35 2hln s TYR 247 N 1.43 3.20 -1.34 5.22 5.04 0.37 -1.09 117.35 130.18 2hln s TYR 247 Ca 0.07 -0.73 -0.16 0.00 -2.44 0.00 0.00 57.07 53.80 2hln s TYR 247 Cb -0.15 -3.11 0.02 0.00 0.35 0.00 0.00 41.96 39.08 2hln s TYR 247 CO 0.07 -0.79 2.05 0.00 -1.34 0.00 0.00 175.55 175.53 2hln n ALA 248 N 5.42 4.60 -1.24 3.97 0.00 -0.50 0.79 120.51 133.55 2hln n ALA 248 Ca -0.11 -3.78 -0.30 0.00 0.00 0.00 0.00 53.44 49.25 2hln n ALA 248 Cb 0.45 -3.57 0.12 0.00 0.00 0.00 0.00 19.45 16.45 2hln n ALA 248 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2hln s GLY 249 N 3.81 1.63 0.04 0.00 0.00 -1.02 -0.70 107.32 111.08 2hln s GLY 249 Ca 0.51 0.02 -0.30 0.00 0.00 0.00 0.00 44.72 44.94 2hln s GLY 249 CO -0.01 0.46 1.27 1.06 0.00 0.00 0.00 173.10 175.88 2hln s MET 250 N -4.94 4.37 7.89 2.90 -1.94 -1.23 -1.11 119.30 125.24 2hln s MET 250 Ca 0.63 1.84 0.00 0.00 -1.71 0.00 0.00 55.69 56.44 2hln s MET 250 Cb -0.17 -3.41 0.00 0.00 2.01 0.00 0.00 34.83 33.25 2hln s MET 250 CO 0.56 -0.38 0.00 0.41 -0.01 0.00 0.00 175.02 175.60 2hln n GLY 251 N 3.37 3.70 2.60 -0.03 0.00 -1.26 -1.57 105.19 112.01 2hln n GLY 251 Ca 0.10 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2hln n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hln n ALA 252 N 12.06 6.29 -1.92 4.61 0.00 -1.26 -4.38 120.51 135.90 2hln n ALA 252 Ca 0.00 -4.43 -0.14 0.00 0.00 0.00 0.00 53.44 48.87 2hln n ALA 252 Cb 0.00 -2.41 -0.03 0.00 0.00 0.00 0.00 19.45 17.01 2hln n ALA 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hln n GLY 253 N 0.65 0.46 3.75 0.00 0.00 -1.19 -4.72 105.19 104.15 2hln n GLY 253 Ca 0.52 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2hln n GLY 253 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hln s SER 254 N -2.57 6.82 0.01 1.61 0.01 -0.61 -4.80 113.70 114.18 2hln s SER 254 Ca 0.00 2.56 0.02 0.00 1.31 0.00 0.00 55.95 59.83 2hln s SER 254 Cb 0.00 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 2hln s SER 254 CO 0.00 -0.54 0.01 0.68 0.41 0.00 0.00 173.24 173.80 2hln s VAL 255 N -0.47 4.18 0.84 3.43 -7.23 -1.26 -3.51 120.40 116.38 2hln s VAL 255 Ca 0.53 -0.62 -0.11 0.00 -1.81 0.00 0.00 61.98 59.97 2hln s VAL 255 Cb -0.39 -2.88 0.13 0.00 0.56 0.00 0.00 36.38 33.80 2hln s VAL 255 CO 0.45 0.35 1.18 -0.94 -0.31 0.00 0.00 175.10 175.83 2hln s SER 256 N -1.64 4.00 0.40 4.85 1.04 -1.26 -4.74 113.70 116.35 2hln s SER 256 Ca 0.20 0.36 0.07 0.00 0.48 0.00 0.00 55.95 57.06 2hln s SER 256 Cb -0.12 -0.70 0.84 0.00 0.10 0.00 0.00 66.02 66.14 2hln s SER 256 CO 0.11 -2.16 2.05 0.11 0.98 0.00 0.00 173.24 174.33 2hln h LYS 257 N -1.12 0.57 0.06 4.02 1.57 -1.98 0.48 116.57 120.16 2hln h LYS 257 Ca -0.44 -0.03 -0.26 0.00 -1.87 0.00 0.00 60.65 58.05 2hln h LYS 257 Cb 1.28 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 33.48 2hln h LYS 257 CO 0.50 0.38 -1.10 0.00 -0.57 0.00 0.00 179.45 178.67 2hln h ARG 258 N 0.59 0.50 -0.11 3.15 3.08 -1.93 -2.62 114.38 117.05 2hln h ARG 258 Ca 0.17 -0.62 -0.14 0.00 0.07 0.00 0.00 59.98 59.46 2hln h ARG 258 Cb -0.03 0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2hln h ARG 258 CO -0.04 1.24 -0.55 0.78 -1.07 0.00 0.00 179.97 180.34 2hln h GLY 259 N 0.87 0.35 0.92 0.04 0.00 -1.65 0.09 103.07 103.68 2hln h GLY 259 Ca -0.13 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 2hln h GLY 259 CO 0.20 0.36 0.07 -1.80 0.00 0.00 0.00 176.54 175.37 2hln h ASP 260 N 0.25 0.56 -0.04 0.19 -0.00 -0.10 -1.37 116.42 115.91 2hln h ASP 260 Ca 0.00 -0.25 -0.16 0.00 -0.00 0.00 0.00 57.03 56.63 2hln h ASP 260 Cb 1.04 -0.15 -0.01 0.00 -0.00 0.00 0.00 39.33 40.21 2hln h ASP 260 CO 0.09 0.67 -0.50 0.00 -0.00 0.00 0.00 179.24 179.49 2hln h ALA 261 N 0.92 0.71 -0.27 -0.78 0.00 -1.35 -2.62 119.26 115.86 2hln h ALA 261 Ca 0.11 -0.49 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 2hln h ALA 261 Cb 0.34 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2hln h ALA 261 CO 0.00 0.68 -0.26 0.78 0.00 0.00 0.00 179.25 180.45 2hln h GLY 262 N 1.02 0.57 0.65 0.00 0.00 -0.85 -2.29 103.07 102.17 2hln h GLY 262 Ca 0.02 -0.48 -0.11 0.00 0.00 0.00 0.00 47.33 46.77 2hln h GLY 262 CO 0.10 0.44 -0.40 -2.22 0.00 0.00 0.00 176.54 174.46 2hln h ILE 263 N 0.46 1.46 -0.10 2.60 2.04 -1.23 -2.98 117.51 119.76 2hln h ILE 263 Ca 0.07 -1.92 -0.04 0.00 1.00 0.00 0.00 64.86 63.97 2hln h ILE 263 Cb 0.70 2.56 -0.01 0.00 -0.74 0.00 0.00 36.82 39.33 2hln h ILE 263 CO 0.05 0.55 -0.14 0.03 0.00 0.00 0.00 178.15 178.64 2hln h ARG 264 N -0.24 0.15 -0.23 2.37 3.08 -1.48 -0.84 114.38 117.18 2hln h ARG 264 Ca -0.04 -0.03 -0.16 0.00 0.07 0.00 0.00 59.98 59.82 2hln h ARG 264 Cb 1.10 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 2hln h ARG 264 CO 0.08 0.29 -0.50 -0.22 -1.07 0.00 0.00 179.97 178.55 2hln h LYS 265 N 0.14 0.64 -0.31 0.04 3.64 -1.48 -2.48 116.57 116.76 2hln h LYS 265 Ca 0.03 -0.38 -0.15 0.00 -1.27 0.00 0.00 60.65 58.88 2hln h LYS 265 Cb 0.33 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2hln h LYS 265 CO 0.02 0.99 -0.40 0.00 -2.27 0.00 0.00 179.45 177.79 2hln h ALA 266 N 0.94 0.71 -0.08 5.00 0.00 -1.22 -3.08 119.26 121.54 2hln h ALA 266 Ca 0.02 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 2hln h ALA 266 Cb 1.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2hln h ALA 266 CO 0.10 0.66 -0.29 0.93 0.00 0.00 0.00 179.25 180.65 2hln h GLU 267 N 0.61 0.14 0.00 0.00 5.08 -1.08 -2.20 114.58 117.12 2hln h GLU 267 Ca 0.05 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2hln h GLU 267 Cb 0.95 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.19 2hln h GLU 267 CO 0.09 0.42 0.00 -1.13 -1.00 0.00 0.00 179.01 177.39 2hln n SER 268 N -4.15 0.71 -1.04 1.42 3.41 -0.95 -2.05 113.62 110.97 2hln n SER 268 Ca -0.01 0.66 0.11 0.00 -0.26 0.00 0.00 58.87 59.37 2hln n SER 268 Cb 0.37 -0.81 0.25 0.00 -0.26 0.00 0.00 64.21 63.75 2hln n SER 268 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2hln n LYS 269 N -2.26 2.36 -0.56 4.33 4.76 -0.87 -4.93 118.16 120.99 2hln n LYS 269 Ca 0.03 -2.06 0.00 0.00 -2.87 0.00 0.00 58.31 53.40 2hln n LYS 269 Cb 0.26 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 2hln n LYS 269 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hln n GLY 270 N 1.44 0.75 3.72 0.72 0.00 -0.87 -5.04 105.19 105.90 2hln n GLY 270 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2hln n GLY 270 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hln s ILE 271 N -2.55 4.74 -0.24 -0.61 1.01 -0.93 -4.99 121.20 117.63 2hln s ILE 271 Ca 0.00 2.04 -0.21 0.00 0.00 0.00 0.00 60.65 62.48 2hln s ILE 271 Cb 0.00 -4.31 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 2hln s ILE 271 CO 0.00 0.22 0.67 -0.69 0.00 0.00 0.00 174.94 175.15 2hln s VAL 272 N 0.62 4.96 -0.13 2.92 1.01 -0.92 -3.92 120.40 124.94 2hln s VAL 272 Ca 0.50 1.24 -0.03 0.00 0.00 0.00 0.00 61.98 63.69 2hln s VAL 272 Cb -0.22 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 2hln s VAL 272 CO 0.28 0.03 -0.03 -0.69 0.00 0.00 0.00 175.10 174.69 2hln s VAL 273 N 2.42 3.96 -0.14 2.92 1.01 -1.26 -1.80 120.40 127.50 2hln s VAL 273 Ca 0.29 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2hln s VAL 273 Cb -0.16 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.53 2hln s VAL 273 CO 0.09 0.52 -0.21 -0.69 0.00 0.00 0.00 175.10 174.81 2hln s VAL 274 N 0.00 1.99 -0.46 2.92 1.01 -0.44 -0.34 120.40 125.09 2hln s VAL 274 Ca 0.01 -0.93 -0.23 0.00 0.00 0.00 0.00 61.98 60.83 2hln s VAL 274 Cb -0.13 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.50 2hln s VAL 274 CO 0.03 0.54 0.78 -0.13 0.00 0.00 0.00 175.10 176.31 2hln s ARG 275 N 0.92 3.38 0.00 2.72 0.52 0.37 -0.48 118.95 126.38 2hln s ARG 275 Ca -0.05 -0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.01 2hln s ARG 275 Cb -0.15 -3.95 0.00 0.00 0.52 0.00 0.00 34.95 31.37 2hln s ARG 275 CO -0.04 -1.14 0.00 0.45 0.02 0.00 0.00 175.30 174.59 2hln n SER 276 N 6.72 0.12 -3.95 0.23 2.88 0.24 -2.11 113.62 117.75 2hln n SER 276 Ca 0.02 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.42 2hln n SER 276 Cb 0.48 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.80 2hln n SER 276 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2hln s SER 277 N -0.85 0.47 0.03 -3.46 0.15 -1.26 -2.43 113.70 106.35 2hln s SER 277 Ca 0.00 -0.17 0.26 0.00 0.70 0.00 0.00 55.95 56.74 2hln s SER 277 Cb 0.00 -0.02 0.61 0.00 -1.71 0.00 0.00 66.02 64.89 2hln s SER 277 CO 0.00 -0.02 1.49 -2.11 1.20 0.00 0.00 173.24 173.81 2hln n ARG 278 N 2.67 0.06 -0.22 5.44 1.85 -0.27 -4.23 116.66 121.96 2hln n ARG 278 Ca -0.15 0.02 -0.01 0.00 -1.00 0.00 0.00 57.85 56.72 2hln n ARG 278 Cb 0.58 -1.54 0.11 0.00 -1.05 0.00 0.00 32.46 30.55 2hln n ARG 278 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 2hln h THR 279 N 0.00 0.89 0.00 8.89 1.35 -1.79 -3.47 112.91 118.78 2hln h THR 279 Ca 0.00 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 2hln h THR 279 Cb 0.55 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.23 2hln h THR 279 CO 0.00 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 175.99 2hln n GLY 280 N -1.29 2.03 3.81 5.82 0.00 -1.26 -5.08 105.19 109.23 2hln n GLY 280 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.06 2hln n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hln s SER 281 N -1.97 -0.14 0.00 1.61 1.04 -1.26 -5.01 113.70 107.97 2hln s SER 281 Ca 0.00 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.79 2hln s SER 281 Cb 0.00 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.74 2hln s SER 281 CO 0.00 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 173.65 2hln n GLY 282 N -0.52 0.55 3.67 7.32 0.00 -1.26 -5.00 105.19 109.96 2hln n GLY 282 Ca -0.05 -2.01 -0.35 0.00 0.00 0.00 0.00 46.02 43.61 2hln n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hln s ILE 283 N -1.42 4.96 -0.43 -0.61 -1.09 -1.26 -4.26 121.20 117.08 2hln s ILE 283 Ca 0.00 0.03 -0.18 0.00 -2.23 0.00 0.00 60.65 58.26 2hln s ILE 283 Cb 0.00 -3.24 0.03 0.00 -1.58 0.00 0.00 42.46 37.67 2hln s ILE 283 CO 0.00 0.47 0.50 -0.69 -1.23 0.00 0.00 174.94 173.99 2hln s VAL 284 N 0.27 5.01 0.52 2.92 1.01 0.53 -4.92 120.40 125.73 2hln s VAL 284 Ca 0.05 -0.25 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 2hln s VAL 284 Cb -0.12 -4.10 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 2hln s VAL 284 CO -0.00 -0.50 0.99 -2.16 0.00 0.00 0.00 175.10 173.43 2hln s PRO 285 N 2.34 3.92 0.47 2.72 0.04 -1.26 -3.96 135.00 139.26 2hln s PRO 285 Ca 0.15 0.97 -0.24 0.00 0.04 0.00 0.00 61.00 61.92 2hln s PRO 285 Cb -0.17 -2.13 -0.07 0.00 0.04 0.00 0.00 34.50 32.17 2hln s PRO 285 CO 0.15 -0.30 1.36 -1.25 0.04 0.00 0.00 177.00 177.00 2hln s PRO 286 N -4.06 3.58 -0.23 0.56 0.04 -1.26 -4.94 135.00 128.69 2hln s PRO 286 Ca 0.59 2.25 -0.03 0.00 0.04 0.00 0.00 61.00 63.85 2hln s PRO 286 Cb -0.10 -2.53 0.12 0.00 0.04 0.00 0.00 34.50 32.03 2hln s PRO 286 CO 0.31 -0.84 0.35 0.34 0.04 0.00 0.00 177.00 177.20 2hln s ASP 287 N -0.77 0.43 0.00 6.66 2.15 -1.26 -5.01 116.67 118.87 2hln s ASP 287 Ca 0.64 0.19 0.16 0.00 0.43 0.00 0.00 52.55 53.97 2hln s ASP 287 Cb -0.40 0.98 0.79 0.00 -0.30 0.00 0.00 42.92 43.99 2hln s ASP 287 CO 0.50 -0.30 1.48 0.00 -0.17 0.00 0.00 175.17 176.68 2hln n ALA 288 N 5.36 1.86 0.06 3.66 0.00 -1.26 -2.55 120.51 127.64 2hln n ALA 288 Ca -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2hln n ALA 288 Cb 0.50 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 2hln n ALA 288 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2hln h GLY 289 N 2.69 0.00 -4.71 0.00 0.00 -2.01 -3.46 103.07 95.58 2hln h GLY 289 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 2hln h GLY 289 CO 0.00 0.00 -0.63 1.20 0.00 0.00 0.00 176.54 177.11 2hln s GLN 290 N -2.92 2.76 0.78 4.80 -0.21 -1.06 -5.12 119.66 118.70 2hln s GLN 290 Ca -0.01 -0.69 -0.12 0.00 0.02 0.00 0.00 55.36 54.56 2hln s GLN 290 Cb 0.08 -2.66 0.06 0.00 1.00 0.00 0.00 33.01 31.49 2hln s GLN 290 CO 0.80 0.59 1.12 -1.25 -2.12 0.00 0.00 175.29 174.42 2hln s PRO 291 N -2.02 2.22 0.00 2.91 0.04 -1.26 -4.84 135.00 132.05 2hln s PRO 291 Ca 0.24 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.71 2hln s PRO 291 Cb -0.12 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2hln s PRO 291 CO 0.16 -1.48 0.00 0.41 0.04 0.00 0.00 177.00 176.13 2hln n GLY 292 N -2.69 -1.08 3.98 0.56 0.00 -1.26 -4.89 105.19 99.80 2hln n GLY 292 Ca 0.07 -1.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.23 2hln n GLY 292 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hln s LEU 293 N -3.69 3.02 -0.00 0.99 1.43 0.54 -4.88 118.68 116.09 2hln s LEU 293 Ca 0.00 -0.20 0.05 0.00 -1.03 0.00 0.00 54.13 52.94 2hln s LEU 293 Cb 0.00 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 2hln s LEU 293 CO 0.00 -1.71 -0.13 0.68 0.23 0.00 0.00 176.35 175.42 2hln s VAL 294 N -3.09 3.16 -1.45 -1.59 -7.23 -1.26 -0.48 120.40 108.46 2hln s VAL 294 Ca 0.64 -0.88 0.07 0.00 -1.81 0.00 0.00 61.98 60.00 2hln s VAL 294 Cb -0.07 -2.31 0.27 0.00 0.56 0.00 0.00 36.38 34.83 2hln s VAL 294 CO 0.43 0.45 1.10 0.00 -0.31 0.00 0.00 175.10 176.77 2hln n ALA 295 N 1.84 2.69 -0.85 1.32 0.00 -0.90 -4.84 120.51 119.78 2hln n ALA 295 Ca -0.16 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.70 2hln n ALA 295 Cb 0.52 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.97 2hln n ALA 295 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2hln n ASP 296 N 0.27 0.00 -0.25 0.00 2.03 -1.25 -0.66 116.55 116.68 2hln n ASP 296 Ca 0.10 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.43 2hln n ASP 296 Cb 0.39 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.85 2hln n ASP 296 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2hln n SER 297 N 9.29 2.37 -4.74 1.67 3.41 -1.26 -0.35 113.62 124.02 2hln n SER 297 Ca 0.00 -2.04 -0.41 0.00 -0.26 0.00 0.00 58.87 56.16 2hln n SER 297 Cb 0.00 -0.10 -0.04 0.00 -0.26 0.00 0.00 64.21 63.81 2hln n SER 297 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2hln s LEU 298 N -1.07 4.48 0.79 1.04 1.43 0.16 -4.71 118.68 120.80 2hln s LEU 298 Ca 0.10 2.17 -0.11 0.00 -1.03 0.00 0.00 54.13 55.26 2hln s LEU 298 Cb 0.06 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.73 2hln s LEU 298 CO 0.06 -0.28 1.09 -0.94 0.23 0.00 0.00 176.35 176.51 2hln s SER 299 N -0.08 4.46 0.29 2.29 1.04 -1.26 -4.57 113.70 115.87 2hln s SER 299 Ca 0.50 1.66 0.02 0.00 0.48 0.00 0.00 55.95 58.61 2hln s SER 299 Cb -0.31 -2.39 0.60 0.00 0.10 0.00 0.00 66.02 64.02 2hln s SER 299 CO 0.36 -2.04 1.81 -0.65 0.98 0.00 0.00 173.24 173.71 2hln h PRO 300 N -1.13 0.87 -0.40 4.02 0.11 -1.95 0.45 132.00 133.96 2hln h PRO 300 Ca -0.45 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 2hln h PRO 300 Cb 1.24 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2hln h PRO 300 CO 0.54 0.58 0.04 0.00 -0.21 0.00 0.00 178.00 178.94 2hln h ALA 301 N 1.57 0.54 0.00 -0.75 0.00 -1.95 -2.34 119.26 116.33 2hln h ALA 301 Ca 0.52 -0.24 -0.19 0.00 0.00 0.00 0.00 54.91 55.00 2hln h ALA 301 Cb 0.62 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2hln h ALA 301 CO -0.31 0.28 -0.85 0.87 0.00 0.00 0.00 179.25 179.24 2hln h LYS 302 N 0.53 0.15 -0.32 0.00 1.57 -1.64 -3.09 116.57 113.77 2hln h LYS 302 Ca 0.12 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 2hln h LYS 302 Cb 0.42 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 2hln h LYS 302 CO 0.01 0.91 -0.06 0.77 -0.57 0.00 0.00 179.45 180.51 2hln h SER 303 N 0.08 0.49 -0.45 0.86 0.02 -0.06 -1.86 113.55 112.63 2hln h SER 303 Ca -0.03 -0.11 -0.07 0.00 -0.84 0.00 0.00 61.79 60.73 2hln h SER 303 Cb 1.47 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.87 2hln h SER 303 CO 0.13 0.60 -0.01 -0.09 -1.14 0.00 0.00 176.83 176.32 2hln h ARG 304 N 0.48 0.80 -0.81 3.45 2.43 -1.40 -0.51 114.38 118.83 2hln h ARG 304 Ca 0.10 -0.26 -0.03 0.00 -0.81 0.00 0.00 59.98 58.98 2hln h ARG 304 Cb 0.41 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 2hln h ARG 304 CO 0.02 0.86 0.39 0.82 -1.51 0.00 0.00 179.97 180.55 2hln h ILE 305 N 0.64 1.25 -0.09 1.20 1.08 -1.38 0.41 117.51 120.61 2hln h ILE 305 Ca 0.13 -0.69 -0.20 0.00 -0.39 0.00 0.00 64.86 63.70 2hln h ILE 305 Cb 0.51 0.21 0.01 0.00 -3.07 0.00 0.00 36.82 34.48 2hln h ILE 305 CO 0.02 0.30 -0.74 0.25 -0.69 0.00 0.00 178.15 177.29 2hln h LEU 306 N 1.15 0.81 -0.86 1.44 5.85 -1.23 -2.73 115.31 119.74 2hln h LEU 306 Ca 0.28 -0.67 -0.08 0.00 0.84 0.00 0.00 57.88 58.25 2hln h LEU 306 Cb 0.11 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2hln h LEU 306 CO -0.04 1.36 -0.06 0.25 -0.34 0.00 0.00 178.44 179.61 2hln h LEU 307 N 0.33 0.77 -0.92 2.25 5.85 -0.93 0.14 115.31 122.80 2hln h LEU 307 Ca -0.07 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 2hln h LEU 307 Cb 1.39 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 2hln h LEU 307 CO 0.15 0.87 0.18 -0.03 -0.34 0.00 0.00 178.44 179.27 2hln h MET 308 N 0.72 0.97 0.00 1.25 4.05 -0.93 -1.99 114.93 119.00 2hln h MET 308 Ca 0.13 -0.20 -0.14 0.00 -0.28 0.00 0.00 59.70 59.21 2hln h MET 308 Cb 0.53 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.16 2hln h MET 308 CO 0.03 0.85 -0.80 -0.07 0.23 0.00 0.00 176.91 177.15 2hln h LEU 309 N 0.93 0.00 -0.66 3.39 3.38 -1.17 -3.28 115.31 117.91 2hln h LEU 309 Ca 0.20 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 2hln h LEU 309 Cb 0.30 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2hln h LEU 309 CO -0.00 0.60 -0.50 0.00 0.09 0.00 0.00 178.44 178.62 2hln h ALA 310 N 1.40 0.88 0.00 1.53 0.00 -0.45 -3.07 119.26 119.54 2hln h ALA 310 Ca -0.05 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2hln h ALA 310 Cb 1.50 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2hln h ALA 310 CO 0.07 0.63 0.00 1.28 0.00 0.00 0.00 179.25 181.23 2hln n LEU 311 N -3.52 0.00 0.10 0.00 4.77 -0.77 -1.80 117.00 115.78 2hln n LEU 311 Ca -0.00 0.50 0.12 0.00 -0.03 0.00 0.00 56.01 56.60 2hln n LEU 311 Cb 0.61 -0.50 0.26 0.00 -2.33 0.00 0.00 43.42 41.46 2hln n LEU 311 CO 0.39 -0.04 0.60 0.71 -1.33 0.00 0.00 177.39 177.72 2hln h THR 312 N 0.00 0.00 0.00 -5.08 1.35 -1.65 -3.37 112.91 104.16 2hln h THR 312 Ca 0.00 -0.57 -0.20 0.00 -0.55 0.00 0.00 66.41 65.08 2hln h THR 312 Cb 0.46 1.36 -0.04 0.00 -1.73 0.00 0.00 68.15 68.21 2hln h THR 312 CO 0.00 0.00 -1.77 0.29 -0.25 0.00 0.00 175.52 173.79 2hln n LYS 313 N -2.31 1.06 -3.84 4.72 5.02 -1.10 -5.10 118.16 116.61 2hln n LYS 313 Ca 0.04 0.05 -0.07 0.00 -2.02 0.00 0.00 58.31 56.31 2hln n LYS 313 Cb 0.45 -1.28 -0.01 0.00 -0.02 0.00 0.00 35.03 34.17 2hln n LYS 313 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2hln s THR 314 N -2.27 0.00 0.00 -0.18 -1.32 -0.75 -5.03 115.64 106.09 2hln s THR 314 Ca -0.14 -0.94 0.00 0.00 -1.21 0.00 0.00 61.69 59.40 2hln s THR 314 Cb 0.04 -2.18 0.00 0.00 -1.51 0.00 0.00 72.50 68.86 2hln s THR 314 CO 0.37 0.00 0.20 0.35 -2.21 0.00 0.00 174.62 173.33 2hln n THR 315 N -0.48 0.00 -1.86 5.08 -2.24 -1.26 -3.99 114.28 109.53 2hln n THR 315 Ca -0.05 -0.36 -0.42 0.00 -2.27 0.00 0.00 64.05 60.95 2hln n THR 315 Cb 0.59 1.15 -0.03 0.00 -2.10 0.00 0.00 70.33 69.95 2hln n THR 315 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2hln s ASN 316 N -0.32 6.56 0.22 3.42 3.84 -1.26 -4.92 114.94 122.48 2hln s ASN 316 Ca 0.00 2.51 -0.08 0.00 0.21 0.00 0.00 52.86 55.50 2hln s ASN 316 Cb 0.00 -2.55 0.27 0.00 -0.55 0.00 0.00 41.25 38.42 2hln s ASN 316 CO 0.00 -0.95 1.81 -0.65 -2.79 0.00 0.00 177.10 174.52 2hln h PRO 317 N 9.10 0.69 -0.43 0.43 0.11 -1.99 -2.06 132.00 137.85 2hln h PRO 317 Ca -0.44 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 2hln h PRO 317 Cb 1.21 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2hln h PRO 317 CO 0.94 0.46 0.17 0.00 -0.21 0.00 0.00 178.00 179.36 2hln h ALA 318 N 1.37 0.57 -0.52 -0.75 0.00 -1.99 -0.68 119.26 117.25 2hln h ALA 318 Ca 0.32 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2hln h ALA 318 Cb 0.22 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2hln h ALA 318 CO -0.20 0.18 -0.06 0.28 0.00 0.00 0.00 179.25 179.45 2hln h VAL 319 N 0.56 1.27 -0.34 0.00 2.07 -1.92 -2.07 116.25 115.82 2hln h VAL 319 Ca 0.14 -1.18 -0.10 0.00 0.82 0.00 0.00 66.70 66.38 2hln h VAL 319 Cb 0.20 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2hln h VAL 319 CO -0.01 0.42 -0.22 0.40 0.02 0.00 0.00 177.57 178.18 2hln h ILE 320 N 0.82 1.27 -0.50 4.57 2.04 -1.28 -2.51 117.51 121.93 2hln h ILE 320 Ca 0.14 -1.28 -0.08 0.00 1.00 0.00 0.00 64.86 64.64 2hln h ILE 320 Cb 0.60 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 2hln h ILE 320 CO 0.04 0.42 -0.01 -0.61 0.00 0.00 0.00 178.15 177.99 2hln h GLN 321 N 0.57 0.84 -0.48 2.37 5.75 -0.96 -2.57 115.11 120.63 2hln h GLN 321 Ca 0.08 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.30 2hln h GLN 321 Cb 0.68 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.12 2hln h GLN 321 CO 0.05 0.84 0.11 -0.44 -2.65 0.00 0.00 178.83 176.74 2hln h ASP 322 N 0.78 0.67 -0.46 -0.69 3.32 -1.01 -2.82 116.42 116.21 2hln h ASP 322 Ca 0.15 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 2hln h ASP 322 Cb 0.48 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 2hln h ASP 322 CO 0.02 0.67 0.25 1.88 -1.72 0.00 0.00 179.24 180.35 2hln h TYR 323 N 0.70 0.64 -0.03 4.55 0.99 -1.05 -2.18 116.97 120.59 2hln h TYR 323 Ca 0.16 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.86 2hln h TYR 323 Cb 0.28 -0.20 -0.00 0.00 1.00 0.00 0.00 36.73 37.80 2hln h TYR 323 CO 0.01 0.48 -0.03 0.74 -0.00 0.00 0.00 178.16 179.36 2hln h PHE 324 N 0.61 0.04 0.00 4.88 0.04 -1.37 0.50 116.94 121.64 2hln h PHE 324 Ca 0.16 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.92 2hln h PHE 324 Cb 0.05 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.19 2hln h PHE 324 CO -0.02 0.08 -0.72 0.45 -0.60 0.00 0.00 178.31 177.50 2hln h HIS 325 N 0.04 0.00 0.00 -0.55 3.86 -1.39 -3.39 115.15 113.73 2hln h HIS 325 Ca 0.01 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.87 2hln h HIS 325 Cb 0.09 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.49 2hln h HIS 325 CO 0.00 0.03 -2.33 0.00 0.86 0.00 0.00 177.93 176.50 2hln n ALA 326 N -2.17 1.51 1.05 2.45 0.00 -0.84 -5.04 120.51 117.49 2hln n ALA 326 Ca 0.01 -1.18 0.12 0.00 0.00 0.00 0.00 53.44 52.39 2hln n ALA 326 Cb 0.56 -0.12 0.15 0.00 0.00 0.00 0.00 19.45 20.04 2hln n ALA 326 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16