#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c3y s LYS 3 N 0.00 3.90 -0.03 1.61 1.02 -1.26 -1.42 119.74 123.56 2c3y s LYS 3 Ca 0.00 0.46 -0.00 0.00 0.02 0.00 0.00 55.97 56.45 2c3y s LYS 3 Cb 0.00 -2.58 0.03 0.00 -0.52 0.00 0.00 37.83 34.76 2c3y s LYS 3 CO 0.00 0.26 0.02 0.21 -0.92 0.00 0.00 175.35 174.92 2c3y s LYS 4 N -2.81 0.15 0.37 1.68 2.20 0.80 -4.94 119.74 117.19 2c3y s LYS 4 Ca 0.49 0.16 -0.22 0.00 -0.36 0.00 0.00 55.97 56.04 2c3y s LYS 4 Cb -0.11 -0.43 -0.10 0.00 -1.51 0.00 0.00 37.83 35.67 2c3y s LYS 4 CO 0.20 -0.18 0.92 -1.64 -0.36 0.00 0.00 175.35 174.28 2c3y s MET 5 N 1.24 4.35 -0.20 4.03 -1.94 -1.26 -0.33 119.30 125.20 2c3y s MET 5 Ca -0.07 1.15 -0.29 0.00 -1.71 0.00 0.00 55.69 54.78 2c3y s MET 5 Cb -0.13 -2.48 0.14 0.00 2.01 0.00 0.00 34.83 34.37 2c3y s MET 5 CO -0.02 0.13 1.07 0.00 -0.01 0.00 0.00 175.02 176.18 2c3y s MET 6 N -2.66 0.49 -0.34 2.03 0.00 -0.56 -4.93 119.30 113.32 2c3y s MET 6 Ca 0.56 0.18 -0.10 0.00 0.00 0.00 0.00 55.69 56.33 2c3y s MET 6 Cb -0.13 0.23 0.01 0.00 0.00 0.00 0.00 34.83 34.94 2c3y s MET 6 CO 0.18 -0.14 0.17 0.95 0.00 0.00 0.00 175.02 176.18 2c3y s THR 7 N -0.88 4.57 0.34 3.16 -4.23 -1.26 -0.64 115.64 116.69 2c3y s THR 7 Ca 0.01 -0.62 -0.10 0.00 -1.18 0.00 0.00 61.69 59.80 2c3y s THR 7 Cb -0.01 -3.42 0.02 0.00 1.34 0.00 0.00 72.50 70.42 2c3y s THR 7 CO -0.01 -0.06 0.60 0.42 -0.54 0.00 0.00 174.62 175.03 2c3y s THR 8 N 1.58 0.00 0.48 3.99 -4.23 -0.75 -4.91 115.64 111.81 2c3y s THR 8 Ca 0.03 -1.32 0.09 0.00 -1.18 0.00 0.00 61.69 59.31 2c3y s THR 8 Cb -0.18 -2.60 0.04 0.00 1.34 0.00 0.00 72.50 71.10 2c3y s THR 8 CO 0.06 0.00 0.65 1.51 -0.54 0.00 0.00 174.62 176.31 2c3y s ASP 9 N -3.12 5.43 0.28 3.99 3.84 -1.26 -1.65 116.67 124.18 2c3y s ASP 9 Ca 0.23 -0.60 0.01 0.00 -0.00 0.00 0.00 52.55 52.19 2c3y s ASP 9 Cb -0.02 -0.28 0.58 0.00 -1.38 0.00 0.00 42.92 41.81 2c3y s ASP 9 CO 0.14 -0.99 1.80 1.23 -0.00 0.00 0.00 175.17 177.36 2c3y h GLY 10 N 0.47 1.58 0.99 2.12 0.00 -1.21 -1.01 103.07 106.02 2c3y h GLY 10 Ca -0.36 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.61 2c3y h GLY 10 CO 0.44 0.06 0.01 3.43 0.00 0.00 0.00 176.54 180.47 2c3y h ASN 11 N 0.83 0.02 -0.46 0.19 -0.26 -1.62 -1.77 115.58 112.52 2c3y h ASN 11 Ca 0.50 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 56.11 2c3y h ASN 11 Cb 0.62 -0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.86 2c3y h ASN 11 CO -0.31 0.02 -0.21 0.71 -1.06 0.00 0.00 177.43 176.57 2c3y h THR 12 N 0.03 1.27 -0.85 2.81 1.35 -1.74 0.11 112.91 115.88 2c3y h THR 12 Ca 0.01 -1.37 0.04 0.00 -0.55 0.00 0.00 66.41 64.54 2c3y h THR 12 Cb -0.00 1.18 -0.05 0.00 -1.73 0.00 0.00 68.15 67.55 2c3y h THR 12 CO -0.01 0.47 0.56 0.00 -0.25 0.00 0.00 175.52 176.29 2c3y h ALA 13 N 0.85 1.50 0.11 6.62 0.00 -1.10 0.25 119.26 127.48 2c3y h ALA 13 Ca 0.10 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.77 2c3y h ALA 13 Cb 0.79 -0.29 0.02 0.00 0.00 0.00 0.00 17.79 18.31 2c3y h ALA 13 CO 0.07 0.41 -0.88 1.79 0.00 0.00 0.00 179.25 180.63 2c3y h THR 14 N 1.03 1.44 -0.89 0.00 1.35 -1.08 -3.26 112.91 111.50 2c3y h THR 14 Ca 0.35 -2.42 0.05 0.00 -0.55 0.00 0.00 66.41 63.84 2c3y h THR 14 Cb 0.08 2.96 -0.05 0.00 -1.73 0.00 0.00 68.15 69.40 2c3y h THR 14 CO -0.11 0.70 0.58 0.00 -0.25 0.00 0.00 175.52 176.45 2c3y h ALA 15 N 0.18 1.48 -0.76 6.62 0.00 -0.41 0.76 119.26 127.12 2c3y h ALA 15 Ca -0.14 -0.03 0.16 0.00 0.00 0.00 0.00 54.91 54.90 2c3y h ALA 15 Cb 1.64 -0.29 -0.11 0.00 0.00 0.00 0.00 17.79 19.04 2c3y h ALA 15 CO 0.17 0.41 0.24 1.25 0.00 0.00 0.00 179.25 181.31 2c3y h HIS 16 N 1.06 0.39 0.11 0.00 6.17 -0.56 -0.87 115.15 121.45 2c3y h HIS 16 Ca 0.37 0.04 -0.15 0.00 0.71 0.00 0.00 60.37 61.34 2c3y h HIS 16 Cb 0.11 -0.05 0.02 0.00 2.52 0.00 0.00 27.41 30.01 2c3y h HIS 16 CO -0.00 -0.04 -0.67 0.28 0.71 0.00 0.00 177.93 178.21 2c3y h VAL 17 N 0.33 1.57 -0.90 5.26 2.07 -1.26 -3.27 116.25 120.05 2c3y h VAL 17 Ca 0.44 -2.50 0.10 0.00 0.82 0.00 0.00 66.70 65.55 2c3y h VAL 17 Cb 0.74 3.23 -0.07 0.00 -1.52 0.00 0.00 31.29 33.68 2c3y h VAL 17 CO -0.49 0.70 0.58 0.00 0.02 0.00 0.00 177.57 178.38 2c3y h ALA 18 N 0.07 1.62 -0.17 1.67 0.00 -0.52 -1.49 119.26 120.43 2c3y h ALA 18 Ca -0.12 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2c3y h ALA 18 Cb 1.52 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2c3y h ALA 18 CO 0.13 0.20 0.02 -0.92 0.00 0.00 0.00 179.25 178.68 2c3y h TYR 19 N 0.91 0.31 -0.74 0.00 3.20 -1.30 -2.21 116.97 117.14 2c3y h TYR 19 Ca 0.42 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.24 2c3y h TYR 19 Cb 0.40 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 2c3y h TYR 19 CO -0.00 0.46 0.45 0.00 -1.64 0.00 0.00 178.16 177.43 2c3y h ALA 20 N 0.81 0.94 -0.01 1.82 0.00 -1.45 -3.05 119.26 118.33 2c3y h ALA 20 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2c3y h ALA 20 Cb 0.32 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2c3y h ALA 20 CO 0.00 0.41 -0.01 -1.33 0.00 0.00 0.00 179.25 178.33 2c3y n MET 21 N -4.52 1.33 -4.45 0.00 2.81 -0.62 -1.48 117.12 110.19 2c3y n MET 21 Ca 0.07 -0.50 -0.25 0.00 -1.81 0.00 0.00 57.70 55.21 2c3y n MET 21 Cb 0.05 -1.49 -0.11 0.00 -0.71 0.00 0.00 33.22 30.97 2c3y n MET 21 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2c3y s SER 22 N -2.02 3.55 -0.08 7.83 0.01 -0.84 -4.86 113.70 117.29 2c3y s SER 22 Ca 0.42 -0.97 0.06 0.00 1.31 0.00 0.00 55.95 56.77 2c3y s SER 22 Cb 0.21 -0.29 -0.09 0.00 0.21 0.00 0.00 66.02 66.06 2c3y s SER 22 CO 0.36 0.07 0.02 -0.62 0.41 0.00 0.00 173.24 173.47 2c3y n GLU 23 N -0.32 2.51 -4.09 12.44 1.02 -0.02 -4.82 120.64 127.36 2c3y n GLU 23 Ca -0.08 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.92 2c3y n GLU 23 Cb 0.59 -1.20 -0.12 0.00 -0.02 0.00 0.00 31.44 30.69 2c3y n GLU 23 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2c3y s VAL 24 N -2.19 0.60 -0.13 2.62 1.01 -0.22 -1.39 120.40 120.71 2c3y s VAL 24 Ca -0.05 -1.00 -0.06 0.00 0.00 0.00 0.00 61.98 60.87 2c3y s VAL 24 Cb 0.02 -0.64 0.05 0.00 0.00 0.00 0.00 36.38 35.82 2c3y s VAL 24 CO 0.31 -0.29 0.29 0.00 0.00 0.00 0.00 175.10 175.41 2c3y s ALA 25 N -1.20 -0.70 -0.23 5.51 0.00 0.13 -1.82 121.76 123.44 2c3y s ALA 25 Ca -0.07 1.14 -0.05 0.00 0.00 0.00 0.00 51.96 52.98 2c3y s ALA 25 Cb -0.09 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.24 2c3y s ALA 25 CO 0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 175.76 175.46 2c3y s ALA 26 N 1.49 2.89 0.22 0.00 0.00 -1.21 -1.20 121.76 123.95 2c3y s ALA 26 Ca -0.08 -1.21 0.10 0.00 0.00 0.00 0.00 51.96 50.77 2c3y s ALA 26 Cb -0.10 -1.81 -0.05 0.00 0.00 0.00 0.00 23.12 21.16 2c3y s ALA 26 CO -0.10 -0.51 -0.19 0.42 0.00 0.00 0.00 175.76 175.38 2c3y s ILE 27 N 1.49 2.12 -0.16 0.00 1.09 0.08 -4.64 121.20 121.18 2c3y s ILE 27 Ca 0.05 -2.20 -0.12 0.00 -1.10 0.00 0.00 60.65 57.28 2c3y s ILE 27 Cb -0.15 -2.11 0.05 0.00 -1.06 0.00 0.00 42.46 39.19 2c3y s ILE 27 CO -0.02 -0.39 0.41 -0.47 -0.10 0.00 0.00 174.94 174.36 2c3y s TYR 28 N -2.42 -0.50 0.13 3.97 5.04 -1.26 -1.31 117.35 121.00 2c3y s TYR 28 Ca 0.24 1.15 -0.30 0.00 -2.44 0.00 0.00 57.07 55.72 2c3y s TYR 28 Cb -0.04 0.19 -0.07 0.00 0.35 0.00 0.00 41.96 42.39 2c3y s TYR 28 CO 0.10 -0.26 1.11 -1.25 -1.34 0.00 0.00 175.55 173.91 2c3y s PRO 29 N 0.63 4.55 -0.29 4.97 0.04 -1.26 -4.88 135.00 138.77 2c3y s PRO 29 Ca -0.03 1.69 -0.14 0.00 0.04 0.00 0.00 61.00 62.55 2c3y s PRO 29 Cb -0.05 -3.32 0.12 0.00 0.04 0.00 0.00 34.50 31.30 2c3y s PRO 29 CO -0.04 -0.02 0.79 -1.50 0.04 0.00 0.00 177.00 176.27 2c3y s ILE 30 N 0.22 -0.31 0.41 0.56 2.07 -1.26 -5.00 121.20 117.89 2c3y s ILE 30 Ca 0.52 0.00 -0.26 0.00 -1.41 0.00 0.00 60.65 59.50 2c3y s ILE 30 Cb -0.28 -1.00 -0.09 0.00 0.13 0.00 0.00 42.46 41.22 2c3y s ILE 30 CO 0.33 0.00 1.31 -0.89 -1.91 0.00 0.00 174.94 173.78 2c3y s THR 31 N 1.98 2.57 -0.42 4.00 2.01 -1.26 -0.93 115.64 123.58 2c3y s THR 31 Ca -0.08 0.51 0.05 0.00 0.31 0.00 0.00 61.69 62.48 2c3y s THR 31 Cb -0.06 -3.30 0.65 0.00 0.01 0.00 0.00 72.50 69.80 2c3y s THR 31 CO -0.18 0.07 1.85 -0.81 -0.69 0.00 0.00 174.62 174.87 2c3y n PRO 32 N 0.10 2.25 0.00 4.92 -0.04 -1.26 -4.88 135.00 136.08 2c3y n PRO 32 Ca 0.04 -3.04 0.10 0.00 -0.04 0.00 0.00 63.50 60.56 2c3y n PRO 32 Cb 0.43 -2.13 -0.08 0.00 -0.04 0.00 0.00 33.50 31.69 2c3y n PRO 32 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2c3y n SER 33 N -1.11 1.26 -0.34 3.54 3.41 -0.10 -4.54 113.62 115.74 2c3y n SER 33 Ca 0.56 -1.12 0.18 0.00 -0.26 0.00 0.00 58.87 58.23 2c3y n SER 33 Cb 1.58 0.84 0.39 0.00 -0.26 0.00 0.00 64.21 66.76 2c3y n SER 33 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2c3y h SER 34 N 0.65 0.65 -0.70 4.04 0.02 -1.81 -1.91 113.55 114.50 2c3y h SER 34 Ca 0.00 0.14 0.13 0.00 -0.84 0.00 0.00 61.79 61.23 2c3y h SER 34 Cb 0.57 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 63.06 2c3y h SER 34 CO 0.00 0.08 0.22 0.74 -1.14 0.00 0.00 176.83 176.72 2c3y h THR 35 N 0.55 0.62 -0.12 -2.27 2.02 -1.91 -1.43 112.91 110.37 2c3y h THR 35 Ca 0.65 -0.12 0.02 0.00 0.77 0.00 0.00 66.41 67.73 2c3y h THR 35 Cb 1.27 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 2c3y h THR 35 CO -0.49 0.06 0.00 0.24 0.37 0.00 0.00 175.52 175.70 2c3y h MET 36 N 0.35 0.04 -0.58 6.66 2.86 -1.62 0.26 114.93 122.90 2c3y h MET 36 Ca 0.38 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 58.01 2c3y h MET 36 Cb 0.59 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.21 2c3y h MET 36 CO -0.42 0.03 0.32 0.78 1.06 0.00 0.00 176.91 178.67 2c3y h GLY 37 N 0.04 0.87 1.14 8.32 0.00 -1.51 -1.25 103.07 110.69 2c3y h GLY 37 Ca 0.06 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 2c3y h GLY 37 CO -0.10 0.38 0.24 0.83 0.00 0.00 0.00 176.54 177.90 2c3y h GLU 38 N 0.79 1.08 -0.29 4.80 5.08 -0.98 -1.05 114.58 124.00 2c3y h GLU 38 Ca 0.20 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2c3y h GLU 38 Cb 0.05 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2c3y h GLU 38 CO -0.03 0.91 0.06 0.93 -1.00 0.00 0.00 179.01 179.87 2c3y h GLU 39 N 1.04 0.47 -0.56 2.33 5.08 -0.63 -0.60 114.58 121.71 2c3y h GLU 39 Ca 0.23 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 2c3y h GLU 39 Cb 0.26 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 2c3y h GLU 39 CO -0.01 0.56 0.31 0.00 -1.00 0.00 0.00 179.01 178.87 2c3y h ALA 40 N 0.89 0.72 -0.36 3.43 0.00 -0.91 0.13 119.26 123.15 2c3y h ALA 40 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2c3y h ALA 40 Cb 0.31 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2c3y h ALA 40 CO 0.00 0.00 0.06 0.22 0.00 0.00 0.00 179.25 179.54 2c3y h ASP 41 N 0.61 0.58 -0.59 0.00 1.82 -1.03 -0.81 116.42 117.01 2c3y h ASP 41 Ca 0.23 -0.26 -0.05 0.00 -0.39 0.00 0.00 57.03 56.56 2c3y h ASP 41 Cb 0.08 -0.15 -0.02 0.00 0.68 0.00 0.00 39.33 39.92 2c3y h ASP 41 CO -0.13 0.69 0.17 0.44 -1.61 0.00 0.00 179.24 178.80 2c3y h ASP 42 N 0.44 0.88 -0.52 2.28 3.32 -0.74 0.13 116.42 122.20 2c3y h ASP 42 Ca 0.11 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.87 2c3y h ASP 42 Cb 0.36 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2c3y h ASP 42 CO 0.01 0.86 0.07 -0.50 -1.72 0.00 0.00 179.24 177.97 2c3y h TRP 43 N 0.84 0.97 -0.41 4.55 6.55 -0.62 0.59 115.95 128.44 2c3y h TRP 43 Ca 0.19 -0.12 -0.08 0.00 0.95 0.00 0.00 58.89 59.82 2c3y h TRP 43 Cb 0.32 -0.27 -0.01 0.00 -0.86 0.00 0.00 29.16 28.33 2c3y h TRP 43 CO 0.02 0.84 -0.07 0.00 -1.05 0.00 0.00 178.44 178.18 2c3y h ALA 44 N 1.21 0.56 -0.14 1.49 0.00 -0.85 0.12 119.26 121.65 2c3y h ALA 44 Ca 0.18 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2c3y h ALA 44 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2c3y h ALA 44 CO 0.01 0.41 -0.12 0.00 0.00 0.00 0.00 179.25 179.55 2c3y h ALA 45 N 0.86 1.55 0.00 0.00 0.00 -0.58 -1.61 119.26 119.48 2c3y h ALA 45 Ca 0.11 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2c3y h ALA 45 Cb 0.58 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2c3y h ALA 45 CO 0.03 0.33 0.00 1.96 0.00 0.00 0.00 179.25 181.57 2c3y h GLN 46 N 0.20 0.00 0.00 0.00 4.20 -0.50 -3.47 115.11 115.54 2c3y h GLN 46 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2c3y h GLN 46 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2c3y h GLN 46 CO 0.02 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.59 2c3y n GLY 47 N 0.98 0.97 3.75 3.46 0.00 -0.53 -5.06 105.19 108.76 2c3y n GLY 47 Ca 0.04 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 2c3y n GLY 47 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2c3y s ARG 48 N -0.47 4.21 -0.02 1.61 3.52 0.32 -4.85 118.95 123.28 2c3y s ARG 48 Ca 0.00 2.41 -0.06 0.00 -0.13 0.00 0.00 55.73 57.95 2c3y s ARG 48 Cb 0.00 -3.07 -0.04 0.00 -1.56 0.00 0.00 34.95 30.28 2c3y s ARG 48 CO 0.00 -0.48 0.23 0.15 -0.81 0.00 0.00 175.30 174.38 2c3y s LYS 49 N -0.60 3.53 0.02 5.12 -0.14 -1.26 -4.19 119.74 122.21 2c3y s LYS 49 Ca 0.60 -0.13 -0.00 0.00 -1.36 0.00 0.00 55.97 55.08 2c3y s LYS 49 Cb -0.44 -3.11 0.00 0.00 -1.68 0.00 0.00 37.83 32.60 2c3y s LYS 49 CO 0.47 0.68 0.02 0.27 -0.76 0.00 0.00 175.35 176.03 2c3y n ASN 50 N 1.28 0.01 0.09 2.83 0.23 0.75 -4.81 115.26 115.64 2c3y n ASN 50 Ca -0.13 -1.01 0.08 0.00 -0.53 0.00 0.00 54.58 52.99 2c3y n ASN 50 Cb 0.53 -0.02 0.38 0.00 -2.08 0.00 0.00 39.78 38.60 2c3y n ASN 50 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 2c3y n ILE 51 N -1.83 1.21 0.30 1.53 -5.35 -0.55 -0.88 119.36 113.79 2c3y n ILE 51 Ca 0.00 0.48 0.12 0.00 -0.27 0.00 0.00 62.75 63.09 2c3y n ILE 51 Cb 0.01 -1.43 0.24 0.00 -1.74 0.00 0.00 39.64 36.72 2c3y n ILE 51 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2c3y n PHE 52 N -1.96 0.54 -1.21 4.28 3.01 -1.26 -4.94 117.46 115.92 2c3y n PHE 52 Ca 0.00 -0.27 -0.07 0.00 1.01 0.00 0.00 57.45 58.12 2c3y n PHE 52 Cb 0.09 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.53 2c3y n PHE 52 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2c3y n GLY 53 N 1.51 0.95 3.50 1.37 0.00 -0.06 -5.03 105.19 107.43 2c3y n GLY 53 Ca 0.20 -0.71 -0.26 0.00 0.00 0.00 0.00 46.02 45.25 2c3y n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c3y s GLN 54 N -2.61 1.80 0.30 1.61 -1.52 -1.26 -4.76 119.66 113.21 2c3y s GLN 54 Ca 0.00 -1.49 -0.23 0.00 -1.95 0.00 0.00 55.36 51.69 2c3y s GLN 54 Cb 0.00 -1.96 -0.09 0.00 -0.22 0.00 0.00 33.01 30.74 2c3y s GLN 54 CO 0.00 0.39 0.87 0.95 -0.25 0.00 0.00 175.29 177.25 2c3y s THR 55 N -1.92 4.35 0.32 -0.19 -4.23 -1.26 -0.18 115.64 112.53 2c3y s THR 55 Ca 0.25 1.60 -0.29 0.00 -1.18 0.00 0.00 61.69 62.08 2c3y s THR 55 Cb -0.07 -3.92 -0.10 0.00 1.34 0.00 0.00 72.50 69.74 2c3y s THR 55 CO 0.14 0.13 1.33 -0.22 -0.54 0.00 0.00 174.62 175.45 2c3y s LEU 56 N -2.12 4.42 -0.49 4.79 2.96 -1.26 -4.94 118.68 122.03 2c3y s LEU 56 Ca 0.49 2.71 -0.17 0.00 -0.22 0.00 0.00 54.13 56.93 2c3y s LEU 56 Cb -0.17 -3.65 0.07 0.00 0.50 0.00 0.00 46.19 42.94 2c3y s LEU 56 CO 0.22 -0.57 0.50 -0.89 -1.32 0.00 0.00 176.35 174.29 2c3y s THR 57 N -1.01 5.07 -0.06 3.68 2.01 -0.49 -4.85 115.64 119.99 2c3y s THR 57 Ca 0.50 -0.82 0.06 0.00 0.31 0.00 0.00 61.69 61.74 2c3y s THR 57 Cb -0.40 -4.21 -0.01 0.00 0.01 0.00 0.00 72.50 67.88 2c3y s THR 57 CO 0.52 -0.69 -0.24 -0.63 -0.69 0.00 0.00 174.62 172.89 2c3y s ILE 58 N 2.09 2.16 -0.00 1.82 1.01 -1.26 -0.70 121.20 126.32 2c3y s ILE 58 Ca 0.09 -1.03 0.02 0.00 0.00 0.00 0.00 60.65 59.72 2c3y s ILE 58 Cb -0.22 -1.79 -0.00 0.00 0.01 0.00 0.00 42.46 40.46 2c3y s ILE 58 CO 0.09 0.57 -0.05 -0.13 0.00 0.00 0.00 174.94 175.42 2c3y s ARG 59 N -0.22 0.43 -0.15 2.79 1.81 -0.34 -4.98 118.95 118.28 2c3y s ARG 59 Ca -0.02 -0.20 -0.18 0.00 -1.72 0.00 0.00 55.73 53.61 2c3y s ARG 59 Cb -0.13 -0.41 -0.04 0.00 -0.45 0.00 0.00 34.95 33.92 2c3y s ARG 59 CO 0.03 0.11 0.49 -2.00 -0.68 0.00 0.00 175.30 173.25 2c3y s GLU 60 N -0.15 4.29 0.22 3.54 2.12 -1.26 -0.74 118.70 126.72 2c3y s GLU 60 Ca 0.02 0.43 0.02 0.00 0.36 0.00 0.00 54.97 55.80 2c3y s GLU 60 Cb -0.02 -3.48 0.04 0.00 0.26 0.00 0.00 34.13 30.93 2c3y s GLU 60 CO -0.00 0.05 0.30 -1.33 -0.54 0.00 0.00 175.26 173.74 2c3y n MET 61 N 4.08 0.68 0.08 4.30 2.81 -0.43 -4.93 117.12 123.70 2c3y n MET 61 Ca -0.06 -1.03 0.12 0.00 -1.81 0.00 0.00 57.70 54.92 2c3y n MET 61 Cb 0.51 -0.14 0.24 0.00 -0.71 0.00 0.00 33.22 33.12 2c3y n MET 61 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c3y n GLN 62 N -1.51 0.29 -3.78 0.03 0.00 -1.26 -4.89 117.38 106.26 2c3y n GLN 62 Ca 0.06 0.13 -0.01 0.00 0.00 0.00 0.00 57.00 57.17 2c3y n GLN 62 Cb 0.21 -1.73 0.00 0.00 0.00 0.00 0.00 30.24 28.72 2c3y n GLN 62 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2c3y s SER 63 N -4.35 -0.07 0.45 2.61 1.04 -1.26 -2.08 113.70 110.04 2c3y s SER 63 Ca 0.07 -0.38 0.23 0.00 0.48 0.00 0.00 55.95 56.36 2c3y s SER 63 Cb 0.13 0.36 1.07 0.00 0.10 0.00 0.00 66.02 67.68 2c3y s SER 63 CO 0.68 -0.68 1.91 -0.33 0.98 0.00 0.00 173.24 175.81 2c3y h GLU 64 N 2.00 0.00 -0.48 4.02 3.07 -1.93 -0.69 114.58 120.58 2c3y h GLU 64 Ca -0.27 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.52 2c3y h GLU 64 Cb 1.21 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.11 2c3y h GLU 64 CO 0.30 0.23 0.01 0.00 -1.40 0.00 0.00 179.01 178.14 2c3y h ALA 65 N 1.77 0.64 -0.53 3.43 0.00 -1.86 0.85 119.26 123.56 2c3y h ALA 65 Ca -0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 2c3y h ALA 65 Cb 0.59 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2c3y h ALA 65 CO 0.03 0.44 -0.10 0.78 0.00 0.00 0.00 179.25 180.39 2c3y h GLY 66 N 0.69 1.07 0.92 0.00 0.00 -1.71 -1.47 103.07 102.57 2c3y h GLY 66 Ca 0.14 -0.85 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 2c3y h GLY 66 CO 0.02 0.78 0.11 0.00 0.00 0.00 0.00 176.54 177.46 2c3y h ALA 67 N 0.98 0.32 -0.88 3.60 0.00 -0.82 -0.18 119.26 122.29 2c3y h ALA 67 Ca 0.14 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2c3y h ALA 67 Cb 0.66 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2c3y h ALA 67 CO 0.05 -0.11 0.45 0.00 0.00 0.00 0.00 179.25 179.63 2c3y h ALA 68 N 0.97 1.13 -0.66 0.00 0.00 -0.75 0.10 119.26 120.05 2c3y h ALA 68 Ca 0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2c3y h ALA 68 Cb 0.13 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2c3y h ALA 68 CO -0.01 0.67 0.24 0.78 0.00 0.00 0.00 179.25 180.93 2c3y h GLY 69 N 1.24 1.08 0.93 0.00 0.00 -0.91 -0.35 103.07 105.06 2c3y h GLY 69 Ca 0.31 -0.61 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 2c3y h GLY 69 CO -0.04 0.57 -0.05 0.00 0.00 0.00 0.00 176.54 177.02 2c3y h ALA 70 N 1.10 0.49 -0.61 3.60 0.00 -0.45 -1.26 119.26 122.13 2c3y h ALA 70 Ca 0.22 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.89 2c3y h ALA 70 Cb 0.24 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2c3y h ALA 70 CO -0.01 0.31 0.36 0.28 0.00 0.00 0.00 179.25 180.18 2c3y h VAL 71 N 0.47 1.02 -0.53 0.00 2.07 -0.59 0.12 116.25 118.81 2c3y h VAL 71 Ca 0.10 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2c3y h VAL 71 Cb 0.54 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2c3y h VAL 71 CO 0.03 0.13 0.31 -0.74 0.02 0.00 0.00 177.57 177.32 2c3y h HIS 72 N 0.69 0.70 -0.64 1.57 6.17 -0.85 -1.28 115.15 121.51 2c3y h HIS 72 Ca 0.26 -0.00 -0.05 0.00 0.71 0.00 0.00 60.37 61.28 2c3y h HIS 72 Cb 0.09 -0.23 -0.03 0.00 2.52 0.00 0.00 27.41 29.76 2c3y h HIS 72 CO -0.07 0.49 0.20 0.78 0.71 0.00 0.00 177.93 180.04 2c3y h GLY 73 N 0.71 1.07 1.04 5.26 0.00 -0.33 -0.90 103.07 109.92 2c3y h GLY 73 Ca 0.19 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.82 2c3y h GLY 73 CO -0.03 0.60 0.18 0.00 0.00 0.00 0.00 176.54 177.28 2c3y h ALA 74 N 1.07 0.86 -0.32 3.60 0.00 -0.55 -1.75 119.26 122.18 2c3y h ALA 74 Ca 0.21 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2c3y h ALA 74 Cb 0.30 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2c3y h ALA 74 CO -0.01 0.57 -0.18 -0.07 0.00 0.00 0.00 179.25 179.56 2c3y h LEU 75 N 0.97 0.72 -1.85 0.00 3.38 -1.11 -1.12 115.31 116.30 2c3y h LEU 75 Ca 0.21 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.77 2c3y h LEU 75 Cb 0.34 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2c3y h LEU 75 CO -0.00 0.98 0.12 0.00 0.09 0.00 0.00 178.44 179.63 2c3y h ALA 76 N 0.76 1.90 -0.50 1.53 0.00 -1.02 -1.51 119.26 120.42 2c3y h ALA 76 Ca 0.07 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2c3y h ALA 76 Cb 0.72 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2c3y h ALA 76 CO 0.05 0.08 0.07 0.00 0.00 0.00 0.00 179.25 179.46 2c3y n ALA 77 N -2.52 3.79 -1.63 0.00 0.00 -0.67 -0.02 120.51 119.46 2c3y n ALA 77 Ca -0.00 -1.62 -0.03 0.00 0.00 0.00 0.00 53.44 51.79 2c3y n ALA 77 Cb 0.10 -1.14 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 2c3y n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3y n GLY 78 N 0.32 0.40 3.41 0.00 0.00 -0.57 -4.73 105.19 104.02 2c3y n GLY 78 Ca 0.25 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 45.09 2c3y n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y s ALA 79 N -2.11 2.53 0.00 4.61 0.00 -0.45 -4.76 121.76 121.59 2c3y s ALA 79 Ca 0.00 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 50.67 2c3y s ALA 79 Cb 0.00 -0.91 -0.06 0.00 0.00 0.00 0.00 23.12 22.15 2c3y s ALA 79 CO 0.00 0.49 1.48 -0.51 0.00 0.00 0.00 175.76 177.22 2c3y s LEU 80 N -0.48 4.32 0.08 0.00 1.43 -1.26 -3.91 118.68 118.86 2c3y s LEU 80 Ca 0.06 2.19 0.06 0.00 -1.03 0.00 0.00 54.13 55.41 2c3y s LEU 80 Cb -0.12 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 2c3y s LEU 80 CO 0.01 -0.78 -0.16 -0.89 0.23 0.00 0.00 176.35 174.77 2c3y s THR 81 N 2.67 1.25 0.20 5.49 2.01 -1.26 -0.84 115.64 125.17 2c3y s THR 81 Ca 0.67 -1.39 -0.07 0.00 0.31 0.00 0.00 61.69 61.21 2c3y s THR 81 Cb -0.33 -1.21 -0.02 0.00 0.01 0.00 0.00 72.50 70.95 2c3y s THR 81 CO 0.28 -0.21 0.26 -0.89 -0.69 0.00 0.00 174.62 173.37 2c3y s THR 82 N -1.33 0.03 0.22 -0.82 2.01 -0.76 -2.87 115.64 112.12 2c3y s THR 82 Ca 0.01 -1.66 -0.19 0.00 0.31 0.00 0.00 61.69 60.16 2c3y s THR 82 Cb -0.10 -2.19 0.03 0.00 0.01 0.00 0.00 72.50 70.26 2c3y s THR 82 CO 0.03 -0.13 0.59 0.28 -0.69 0.00 0.00 174.62 174.70 2c3y s THR 83 N -4.06 0.01 -0.04 -0.82 -1.32 -1.13 -3.31 115.64 104.97 2c3y s THR 83 Ca 0.27 -0.75 0.02 0.00 -1.21 0.00 0.00 61.69 60.02 2c3y s THR 83 Cb 0.04 -1.65 0.01 0.00 -1.51 0.00 0.00 72.50 69.39 2c3y s THR 83 CO 0.07 -0.05 -0.10 -0.36 -2.21 0.00 0.00 174.62 171.97 2c3y s PHE 84 N -3.88 1.10 0.00 9.09 0.40 -1.26 -1.62 117.98 121.82 2c3y s PHE 84 Ca 0.09 -0.33 0.00 0.00 -0.60 0.00 0.00 56.93 56.09 2c3y s PHE 84 Cb -0.03 -0.82 0.00 0.00 0.51 0.00 0.00 43.02 42.68 2c3y s PHE 84 CO -0.01 -0.18 0.00 -2.37 0.70 0.00 0.00 175.22 173.37 2c3y n THR 85 N 3.60 0.00 -3.60 0.64 5.66 -0.88 -4.64 114.28 115.06 2c3y n THR 85 Ca -0.21 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 60.80 2c3y n THR 85 Cb 0.53 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.30 2c3y n THR 85 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2c3y s ALA 86 N -1.00 -2.31 0.00 1.79 0.00 -1.26 -2.20 121.76 116.77 2c3y s ALA 86 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.11 2c3y s ALA 86 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.22 2c3y s ALA 86 CO 0.00 -0.90 0.00 0.45 0.00 0.00 0.00 175.76 175.31 2c3y n SER 87 N -0.35 0.00 -0.18 0.00 2.88 -1.26 -0.33 113.62 114.38 2c3y n SER 87 Ca -0.05 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.65 2c3y n SER 87 Cb 0.61 0.00 0.51 0.00 -0.75 0.00 0.00 64.21 64.59 2c3y n SER 87 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 2c3y h GLN 88 N 0.00 0.39 -0.18 -1.46 1.08 -1.90 -1.24 115.11 111.79 2c3y h GLN 88 Ca 0.00 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 2c3y h GLN 88 Cb 0.00 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 2c3y h GLN 88 CO 0.00 0.26 0.00 0.78 -0.95 0.00 0.00 178.83 178.92 2c3y h GLY 89 N 0.40 0.35 1.34 3.46 0.00 -1.10 -2.88 103.07 104.64 2c3y h GLY 89 Ca 0.39 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 2c3y h GLY 89 CO -0.13 0.24 0.32 -2.00 0.00 0.00 0.00 176.54 174.97 2c3y h LEU 90 N 0.08 0.77 -0.82 3.11 5.85 -0.48 -1.98 115.31 121.84 2c3y h LEU 90 Ca 0.05 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.76 2c3y h LEU 90 Cb 0.38 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 2c3y h LEU 90 CO 0.01 0.64 0.51 -0.07 -0.34 0.00 0.00 178.44 179.19 2c3y h LEU 91 N 0.87 0.81 -0.78 2.25 3.38 -1.22 -0.85 115.31 119.76 2c3y h LEU 91 Ca 0.22 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2c3y h LEU 91 Cb 0.05 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2c3y h LEU 91 CO -0.03 0.54 0.00 -0.07 0.09 0.00 0.00 178.44 178.96 2c3y h LEU 92 N 0.95 0.00 0.00 1.67 3.38 -1.15 -2.65 115.31 117.50 2c3y h LEU 92 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2c3y h LEU 92 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2c3y h LEU 92 CO -0.15 0.00 -0.89 0.23 0.09 0.00 0.00 178.44 177.71 2c3y n MET 93 N -2.31 0.24 -0.21 1.13 2.81 -0.36 -4.09 117.12 114.35 2c3y n MET 93 Ca 0.02 0.01 -0.01 0.00 -1.81 0.00 0.00 57.70 55.91 2c3y n MET 93 Cb 0.23 -1.60 0.06 0.00 -0.71 0.00 0.00 33.22 31.20 2c3y n MET 93 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 2c3y h ILE 94 N 0.00 0.37 -0.49 2.02 2.04 -1.12 0.23 117.51 120.56 2c3y h ILE 94 Ca 0.00 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.93 2c3y h ILE 94 Cb 0.70 0.37 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 2c3y h ILE 94 CO 0.00 0.00 0.14 -0.65 0.00 0.00 0.00 178.15 177.64 2c3y h PRO 95 N -0.01 0.28 0.00 2.37 0.11 -1.80 -0.90 132.00 132.05 2c3y h PRO 95 Ca 0.29 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.31 2c3y h PRO 95 Cb 0.46 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 2c3y h PRO 95 CO -0.64 0.19 -0.35 -0.91 -0.21 0.00 0.00 178.00 176.08 2c3y h ASN 96 N 0.29 0.00 -0.48 -2.05 2.35 -1.61 -2.86 115.58 111.23 2c3y h ASN 96 Ca 0.24 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.97 2c3y h ASN 96 Cb 0.29 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.63 2c3y h ASN 96 CO -0.28 0.35 0.25 0.24 -1.65 0.00 0.00 177.43 176.34 2c3y h MET 97 N 0.00 0.72 -0.28 0.81 2.86 0.43 0.81 114.93 120.28 2c3y h MET 97 Ca -0.00 -0.08 -0.10 0.00 -2.06 0.00 0.00 59.70 57.45 2c3y h MET 97 Cb 0.71 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 2c3y h MET 97 CO 0.05 0.56 -0.24 1.88 1.06 0.00 0.00 176.91 180.21 2c3y h TYR 98 N 0.72 0.59 -0.22 -0.22 -1.99 -1.23 -2.23 116.97 112.40 2c3y h TYR 98 Ca 0.18 -0.13 -0.10 0.00 2.00 0.00 0.00 58.73 60.69 2c3y h TYR 98 Cb 0.08 -0.15 -0.00 0.00 2.00 0.00 0.00 36.73 38.66 2c3y h TYR 98 CO 0.01 0.73 -0.26 0.87 -0.00 0.00 0.00 178.16 179.51 2c3y h LYS 99 N 0.47 0.55 -0.42 4.88 1.79 -1.28 0.11 116.57 122.67 2c3y h LYS 99 Ca 0.07 -0.31 -0.03 0.00 -2.18 0.00 0.00 60.65 58.20 2c3y h LYS 99 Cb 0.67 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.32 2c3y h LYS 99 CO 0.05 0.90 0.13 0.82 -1.08 0.00 0.00 179.45 180.27 2c3y h ILE 100 N 0.24 1.22 -0.08 1.86 2.04 -0.81 0.87 117.51 122.85 2c3y h ILE 100 Ca 0.03 -0.73 -0.21 0.00 1.00 0.00 0.00 64.86 64.95 2c3y h ILE 100 Cb 0.82 0.90 0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2c3y h ILE 100 CO 0.06 0.26 -0.77 0.77 0.00 0.00 0.00 178.15 178.47 2c3y h SER 101 N 0.54 0.82 -0.18 1.72 4.64 -1.47 -1.61 113.55 118.01 2c3y h SER 101 Ca 0.14 -0.68 0.03 0.00 -0.47 0.00 0.00 61.79 60.81 2c3y h SER 101 Cb 0.27 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2c3y h SER 101 CO -0.00 1.37 0.12 1.23 -0.87 0.00 0.00 176.83 178.68 2c3y h GLY 102 N 0.33 0.12 -2.37 -0.77 0.00 -0.60 0.27 103.07 100.06 2c3y h GLY 102 Ca -0.07 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.21 2c3y h GLY 102 CO 0.16 0.04 0.00 1.18 0.00 0.00 0.00 176.54 177.91 2c3y n GLU 103 N -4.50 2.50 -3.71 4.80 1.02 0.29 -4.98 120.64 116.05 2c3y n GLU 103 Ca 0.01 -2.32 -0.32 0.00 -0.02 0.00 0.00 57.16 54.50 2c3y n GLU 103 Cb 0.18 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.13 2c3y n GLU 103 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2c3y n LEU 104 N 1.40 -2.61 -4.59 -4.62 4.77 0.08 -4.99 117.00 106.44 2c3y n LEU 104 Ca 0.22 -1.03 -0.34 0.00 -0.03 0.00 0.00 56.01 54.83 2c3y n LEU 104 Cb 0.55 -2.30 -0.11 0.00 -2.33 0.00 0.00 43.42 39.23 2c3y n LEU 104 CO 0.15 0.47 -0.32 -0.76 -1.33 0.00 0.00 177.39 175.60 2c3y s LEU 105 N -6.48 3.45 0.00 2.23 1.43 -0.64 -4.73 118.68 113.94 2c3y s LEU 105 Ca 0.46 0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.55 2c3y s LEU 105 Cb -0.17 -1.81 -0.06 0.00 0.03 0.00 0.00 46.19 44.17 2c3y s LEU 105 CO 0.87 0.26 1.51 -0.81 0.23 0.00 0.00 176.35 178.41 2c3y n PRO 106 N 2.91 0.74 -1.62 1.29 -0.04 -1.26 -2.82 135.00 134.21 2c3y n PRO 106 Ca -0.18 -0.23 -0.32 0.00 -0.04 0.00 0.00 63.50 62.74 2c3y n PRO 106 Cb 0.53 -1.47 0.05 0.00 -0.04 0.00 0.00 33.50 32.57 2c3y n PRO 106 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2c3y s GLY 107 N 2.22 1.82 -0.04 0.55 0.00 -1.26 -4.68 107.32 105.92 2c3y s GLY 107 Ca 0.15 0.24 -0.02 0.00 0.00 0.00 0.00 44.72 45.10 2c3y s GLY 107 CO 0.00 0.57 0.06 0.14 0.00 0.00 0.00 173.10 173.86 2c3y s VAL 108 N -2.81 -0.07 -0.15 1.40 1.01 -1.14 -1.37 120.40 117.27 2c3y s VAL 108 Ca 0.61 0.40 -0.06 0.00 0.00 0.00 0.00 61.98 62.93 2c3y s VAL 108 Cb -0.16 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 2c3y s VAL 108 CO 0.50 0.18 0.04 -0.36 0.00 0.00 0.00 175.10 175.47 2c3y s PHE 109 N 2.15 3.24 -0.28 5.22 2.99 0.49 -2.85 117.98 128.94 2c3y s PHE 109 Ca 0.05 0.10 -0.04 0.00 0.00 0.00 0.00 56.93 57.04 2c3y s PHE 109 Cb -0.12 -1.98 0.03 0.00 0.00 0.00 0.00 43.02 40.94 2c3y s PHE 109 CO -0.03 0.26 0.01 -1.01 -0.00 0.00 0.00 175.22 174.46 2c3y s HIS 110 N -0.07 3.14 -0.03 0.36 3.76 -0.64 -0.35 115.29 121.46 2c3y s HIS 110 Ca 0.06 -1.39 0.07 0.00 -0.15 0.00 0.00 55.06 53.65 2c3y s HIS 110 Cb -0.12 -2.16 -0.02 0.00 1.11 0.00 0.00 32.58 31.39 2c3y s HIS 110 CO 0.01 -0.69 -0.25 0.14 -0.85 0.00 0.00 174.74 173.11 2c3y s VAL 111 N 1.38 1.98 -0.64 -0.90 -7.23 0.08 -2.07 120.40 113.01 2c3y s VAL 111 Ca -0.00 -1.06 -0.18 0.00 -1.81 0.00 0.00 61.98 58.92 2c3y s VAL 111 Cb -0.18 -1.66 0.12 0.00 0.56 0.00 0.00 36.38 35.22 2c3y s VAL 111 CO -0.01 0.56 0.74 0.42 -0.31 0.00 0.00 175.10 176.50 2c3y s THR 112 N -0.46 4.88 -0.29 5.32 -4.23 -0.93 -2.08 115.64 117.85 2c3y s THR 112 Ca 0.06 -1.17 -0.38 0.00 -1.18 0.00 0.00 61.69 59.02 2c3y s THR 112 Cb -0.11 -4.51 -0.14 0.00 1.34 0.00 0.00 72.50 69.09 2c3y s THR 112 CO 0.00 -1.15 1.96 0.00 -0.54 0.00 0.00 174.62 174.89 2c3y n ALA 113 N 6.14 0.48 -2.72 3.99 0.00 0.24 -4.43 120.51 124.21 2c3y n ALA 113 Ca -0.05 0.19 -0.18 0.00 0.00 0.00 0.00 53.44 53.40 2c3y n ALA 113 Cb 0.43 -2.38 -0.12 0.00 0.00 0.00 0.00 19.45 17.38 2c3y n ALA 113 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2c3y s ARG 114 N 4.78 0.78 0.64 0.00 3.52 -1.13 -1.03 118.95 126.50 2c3y s ARG 114 Ca 1.03 -0.89 -0.18 0.00 -0.13 0.00 0.00 55.73 55.56 2c3y s ARG 114 Cb -0.95 -0.75 -0.02 0.00 -1.56 0.00 0.00 34.95 31.67 2c3y s ARG 114 CO 0.57 0.17 1.23 0.00 -0.81 0.00 0.00 175.30 176.46 2c3y n ALA 115 N 1.40 0.97 -2.61 6.12 0.00 -0.05 -3.51 120.51 122.83 2c3y n ALA 115 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.88 2c3y n ALA 115 Cb 0.54 -2.28 -0.05 0.00 0.00 0.00 0.00 19.45 17.65 2c3y n ALA 115 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2c3y s ILE 116 N -1.41 5.13 -0.19 0.00 -1.09 -1.26 -4.65 121.20 117.74 2c3y s ILE 116 Ca 0.81 0.42 -0.29 0.00 -2.23 0.00 0.00 60.65 59.36 2c3y s ILE 116 Cb -0.39 -3.63 -0.02 0.00 -1.58 0.00 0.00 42.46 36.84 2c3y s ILE 116 CO 0.41 0.32 1.33 0.00 -1.23 0.00 0.00 174.94 175.78 2c3y s ALA 117 N -1.36 3.57 0.00 9.38 0.00 -1.26 -4.74 121.76 127.36 2c3y s ALA 117 Ca 0.31 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.70 2c3y s ALA 117 Cb -0.14 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2c3y s ALA 117 CO 0.17 -1.36 0.00 0.00 0.00 0.00 0.00 175.76 174.57 2c3y n ALA 118 N 6.98 0.62 0.39 0.00 0.00 -1.26 -4.85 120.51 122.40 2c3y n ALA 118 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.72 2c3y n ALA 118 Cb 0.45 0.00 0.45 0.00 0.00 0.00 0.00 19.45 20.35 2c3y n ALA 118 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2c3y h HIS 119 N 0.00 0.00 -2.54 0.00 2.07 -1.89 -3.45 115.15 109.33 2c3y h HIS 119 Ca 0.00 0.00 0.07 0.00 -2.85 0.00 0.00 60.37 57.59 2c3y h HIS 119 Cb 0.00 0.00 -0.13 0.00 2.57 0.00 0.00 27.41 29.85 2c3y h HIS 119 CO 0.00 0.00 0.39 0.00 -3.07 0.00 0.00 177.93 175.25 2c3y s ALA 120 N -3.33 -1.71 0.14 6.11 0.00 -1.26 -4.41 121.76 117.31 2c3y s ALA 120 Ca 0.06 0.69 -0.10 0.00 0.00 0.00 0.00 51.96 52.61 2c3y s ALA 120 Cb 0.09 0.61 -0.06 0.00 0.00 0.00 0.00 23.12 23.75 2c3y s ALA 120 CO 0.54 -0.77 0.47 -1.17 0.00 0.00 0.00 175.76 174.83 2c3y s LEU 121 N -2.63 4.29 -0.13 0.00 0.20 -1.26 -4.25 118.68 114.89 2c3y s LEU 121 Ca 0.05 0.86 -0.08 0.00 0.69 0.00 0.00 54.13 55.65 2c3y s LEU 121 Cb -0.01 -3.29 0.04 0.00 -0.43 0.00 0.00 46.19 42.51 2c3y s LEU 121 CO -0.08 0.07 0.32 -0.55 -0.29 0.00 0.00 176.35 175.82 2c3y s SER 122 N -2.01 -0.36 0.00 3.68 0.15 -1.26 -5.01 113.70 108.89 2c3y s SER 122 Ca 0.39 0.66 0.26 0.00 0.70 0.00 0.00 55.95 57.96 2c3y s SER 122 Cb -0.13 0.59 0.71 0.00 -1.71 0.00 0.00 66.02 65.48 2c3y s SER 122 CO 0.20 -0.15 1.55 2.30 1.20 0.00 0.00 173.24 178.34 2c3y n ILE 123 N 3.77 0.05 -2.26 6.45 -5.35 -1.26 -4.30 119.36 116.46 2c3y n ILE 123 Ca -0.20 -0.37 -0.27 0.00 -0.27 0.00 0.00 62.75 61.63 2c3y n ILE 123 Cb 0.55 0.83 0.04 0.00 -1.74 0.00 0.00 39.64 39.32 2c3y n ILE 123 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2c3y s PHE 124 N -1.95 3.23 0.09 4.28 0.08 -1.26 -4.37 117.98 118.08 2c3y s PHE 124 Ca 0.34 0.71 -0.30 0.00 0.12 0.00 0.00 56.93 57.80 2c3y s PHE 124 Cb 0.20 -2.86 -0.05 0.00 -0.57 0.00 0.00 43.02 39.74 2c3y s PHE 124 CO 0.32 -0.97 0.96 0.20 -0.10 0.00 0.00 175.22 175.63 2c3y s GLY 125 N -4.34 2.99 0.08 4.36 0.00 -1.19 -0.87 107.32 108.34 2c3y s GLY 125 Ca 0.55 0.57 -0.27 0.00 0.00 0.00 0.00 44.72 45.58 2c3y s GLY 125 CO 0.46 1.48 1.14 0.51 0.00 0.00 0.00 173.10 176.69 2c3y s ASP 126 N 0.13 -0.06 -0.12 1.64 3.84 -1.06 -0.43 116.67 120.61 2c3y s ASP 126 Ca 0.47 -0.36 0.13 0.00 -0.00 0.00 0.00 52.55 52.80 2c3y s ASP 126 Cb -0.23 0.33 0.59 0.00 -1.38 0.00 0.00 42.92 42.23 2c3y s ASP 126 CO 0.29 -0.64 1.44 1.41 -0.00 0.00 0.00 175.17 177.68 2c3y n HIS 127 N -0.60 1.33 -0.37 2.11 8.25 0.41 -2.84 115.22 123.50 2c3y n HIS 127 Ca -0.05 -0.50 0.02 0.00 -0.26 0.00 0.00 57.72 56.94 2c3y n HIS 127 Cb 0.61 -0.28 0.16 0.00 1.12 0.00 0.00 29.99 31.60 2c3y n HIS 127 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2c3y h GLN 128 N 3.13 1.17 -0.02 -0.41 4.20 -1.79 -1.88 115.11 119.51 2c3y h GLN 128 Ca 0.00 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 2c3y h GLN 128 Cb 1.35 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.87 2c3y h GLN 128 CO 0.26 0.77 -0.12 0.38 -0.67 0.00 0.00 178.83 179.44 2c3y h ASP 129 N 1.20 0.14 -0.10 1.46 -0.00 -1.77 -2.92 116.42 114.43 2c3y h ASP 129 Ca 0.42 -0.70 -0.05 0.00 -0.00 0.00 0.00 57.03 56.70 2c3y h ASP 129 Cb 0.11 -0.04 -0.01 0.00 -0.00 0.00 0.00 39.33 39.39 2c3y h ASP 129 CO -0.16 0.82 -0.07 0.16 -0.00 0.00 0.00 179.24 179.98 2c3y h ILE 130 N -0.53 1.19 0.00 4.15 -0.00 -1.85 -1.15 117.51 119.31 2c3y h ILE 130 Ca -0.01 -0.79 -0.05 0.00 -0.00 0.00 0.00 64.86 64.00 2c3y h ILE 130 Cb 0.82 1.09 -0.01 0.00 -0.00 0.00 0.00 36.82 38.72 2c3y h ILE 130 CO 0.03 0.26 -0.25 1.88 -0.00 0.00 0.00 178.15 180.06 2c3y h TYR 131 N 0.36 0.00 0.00 0.16 0.99 -1.41 -2.45 116.97 114.62 2c3y h TYR 131 Ca 0.07 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.79 2c3y h TYR 131 Cb 0.36 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.09 2c3y h TYR 131 CO 0.01 0.25 -0.08 0.00 -0.00 0.00 0.00 178.16 178.34 2c3y h ALA 132 N 1.75 1.03 -0.38 3.88 0.00 -1.00 -2.88 119.26 121.67 2c3y h ALA 132 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2c3y h ALA 132 Cb 0.64 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2c3y h ALA 132 CO 0.03 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.39 2c3y n ALA 133 N -2.15 2.69 0.29 0.00 0.00 -0.93 -4.64 120.51 115.76 2c3y n ALA 133 Ca 0.00 -1.68 0.17 0.00 0.00 0.00 0.00 53.44 51.93 2c3y n ALA 133 Cb 0.33 -0.66 0.84 0.00 0.00 0.00 0.00 19.45 19.96 2c3y n ALA 133 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2c3y h ARG 134 N 2.38 0.00 -0.01 0.00 0.11 -1.39 -2.51 114.38 112.96 2c3y h ARG 134 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2c3y h ARG 134 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 2c3y h ARG 134 CO 0.14 0.05 -0.14 0.00 0.10 0.00 0.00 179.97 180.12 2c3y n GLN 135 N -3.30 1.44 0.02 0.08 0.00 -1.26 -4.27 117.38 110.08 2c3y n GLN 135 Ca -0.01 -0.95 0.09 0.00 0.00 0.00 0.00 57.00 56.12 2c3y n GLN 135 Cb 0.22 -1.48 0.39 0.00 0.00 0.00 0.00 30.24 29.37 2c3y n GLN 135 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2c3y n THR 136 N 0.05 0.78 -0.39 -0.39 -2.24 -0.94 -4.88 114.28 106.26 2c3y n THR 136 Ca 0.15 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 62.11 2c3y n THR 136 Cb 0.40 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 67.72 2c3y n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3y n GLY 137 N 0.33 0.74 3.79 3.38 0.00 -1.26 -4.22 105.19 107.95 2c3y n GLY 137 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2c3y n GLY 137 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c3y s PHE 138 N -2.48 3.65 0.50 1.61 0.40 -1.26 -4.74 117.98 115.65 2c3y s PHE 138 Ca 0.00 1.68 -0.19 0.00 -0.60 0.00 0.00 56.93 57.81 2c3y s PHE 138 Cb 0.00 -2.85 -0.08 0.00 0.51 0.00 0.00 43.02 40.60 2c3y s PHE 138 CO 0.00 0.21 1.02 0.00 0.70 0.00 0.00 175.22 177.15 2c3y s ALA 139 N -1.64 2.90 -0.15 5.36 0.00 0.32 -4.81 121.76 123.73 2c3y s ALA 139 Ca 0.50 0.51 -0.01 0.00 0.00 0.00 0.00 51.96 52.95 2c3y s ALA 139 Cb -0.17 -3.22 0.04 0.00 0.00 0.00 0.00 23.12 19.76 2c3y s ALA 139 CO 0.22 -0.31 -0.04 -1.64 0.00 0.00 0.00 175.76 173.99 2c3y s MET 140 N -3.42 1.32 -0.21 0.00 1.00 0.10 -0.44 119.30 117.65 2c3y s MET 140 Ca 0.65 -0.42 -0.02 0.00 0.00 0.00 0.00 55.69 55.90 2c3y s MET 140 Cb -0.15 -1.86 0.00 0.00 0.00 0.00 0.00 34.83 32.82 2c3y s MET 140 CO 0.22 -0.41 -0.09 -0.51 0.00 0.00 0.00 175.02 174.23 2c3y s LEU 141 N 1.69 2.65 -0.06 -0.03 1.43 -0.62 -0.44 118.68 123.30 2c3y s LEU 141 Ca 0.02 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.52 2c3y s LEU 141 Cb -0.15 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.37 2c3y s LEU 141 CO -0.08 -0.01 0.30 0.00 0.23 0.00 0.00 176.35 176.79 2c3y s ALA 142 N 1.42 3.75 -0.08 4.21 0.00 0.11 -1.86 121.76 129.32 2c3y s ALA 142 Ca 0.06 -0.39 0.02 0.00 0.00 0.00 0.00 51.96 51.65 2c3y s ALA 142 Cb -0.14 -2.24 -0.02 0.00 0.00 0.00 0.00 23.12 20.72 2c3y s ALA 142 CO -0.06 0.50 -0.14 -1.54 0.00 0.00 0.00 175.76 174.51 2c3y s SER 143 N -0.92 4.00 0.00 0.00 1.04 -0.76 -4.68 113.70 112.37 2c3y s SER 143 Ca 0.20 -0.24 0.13 0.00 0.48 0.00 0.00 55.95 56.51 2c3y s SER 143 Cb -0.15 -1.09 0.32 0.00 0.10 0.00 0.00 66.02 65.20 2c3y s SER 143 CO 0.09 0.29 1.24 -1.54 0.98 0.00 0.00 173.24 174.30 2c3y n SER 144 N 2.71 2.94 -3.72 7.02 3.41 -1.26 -4.42 113.62 120.29 2c3y n SER 144 Ca -0.17 -1.93 -0.09 0.00 -0.26 0.00 0.00 58.87 56.42 2c3y n SER 144 Cb 0.52 -0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 64.22 2c3y n SER 144 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2c3y s SER 145 N -1.01 -0.36 0.19 4.04 1.04 -1.26 -3.86 113.70 112.48 2c3y s SER 145 Ca 0.25 -0.41 -0.12 0.00 0.48 0.00 0.00 55.95 56.15 2c3y s SER 145 Cb 0.14 0.68 0.15 0.00 0.10 0.00 0.00 66.02 67.09 2c3y s SER 145 CO 0.18 -1.22 1.82 0.58 0.98 0.00 0.00 173.24 175.58 2c3y h VAL 146 N 2.01 1.04 -0.68 5.02 2.07 -1.91 -0.12 116.25 123.67 2c3y h VAL 146 Ca -0.24 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 2c3y h VAL 146 Cb 1.27 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2c3y h VAL 146 CO 0.28 0.12 0.36 -0.61 0.02 0.00 0.00 177.57 177.74 2c3y h GLN 147 N 0.67 0.95 0.00 1.57 5.75 -1.96 -2.44 115.11 119.66 2c3y h GLN 147 Ca 0.24 -0.12 -0.07 0.00 -0.15 0.00 0.00 58.65 58.55 2c3y h GLN 147 Cb 0.06 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 2c3y h GLN 147 CO -0.12 0.73 -0.34 0.93 -2.65 0.00 0.00 178.83 177.38 2c3y h GLU 148 N 0.93 0.00 -0.77 1.69 5.08 -1.79 -2.78 114.58 116.93 2c3y h GLU 148 Ca 0.24 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.61 2c3y h GLU 148 Cb 0.07 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 2c3y h GLU 148 CO -0.04 0.34 0.50 0.00 -1.00 0.00 0.00 179.01 178.82 2c3y h ALA 149 N 1.66 1.00 0.22 3.43 0.00 -0.53 0.41 119.26 125.45 2c3y h ALA 149 Ca -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2c3y h ALA 149 Cb 0.61 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2c3y h ALA 149 CO 0.04 0.35 -0.11 1.25 0.00 0.00 0.00 179.25 180.79 2c3y h HIS 150 N 1.01 -0.28 -0.28 0.00 -0.00 -1.45 -0.94 115.15 113.21 2c3y h HIS 150 Ca 0.30 -0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.66 2c3y h HIS 150 Cb -0.06 0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.43 2c3y h HIS 150 CO -0.02 0.03 0.17 -0.44 -0.00 0.00 0.00 177.93 177.66 2c3y h ASP 151 N -0.59 0.33 -0.04 3.26 3.32 -1.25 -2.13 116.42 119.32 2c3y h ASP 151 Ca -0.03 -0.04 -0.11 0.00 0.02 0.00 0.00 57.03 56.86 2c3y h ASP 151 Cb 0.43 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2c3y h ASP 151 CO 0.05 0.28 -0.33 0.24 -1.72 0.00 0.00 179.24 177.75 2c3y h MET 152 N 0.35 0.52 -0.42 3.56 2.86 -0.25 -1.31 114.93 120.24 2c3y h MET 152 Ca 0.10 -0.23 0.04 0.00 -2.06 0.00 0.00 59.70 57.55 2c3y h MET 152 Cb 0.00 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.61 2c3y h MET 152 CO -0.02 0.79 0.19 0.00 1.06 0.00 0.00 176.91 178.93 2c3y h ALA 153 N 1.20 0.52 -0.02 6.32 0.00 -0.92 0.21 119.26 126.56 2c3y h ALA 153 Ca 0.05 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2c3y h ALA 153 Cb 0.79 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2c3y h ALA 153 CO 0.06 -0.18 0.01 1.25 0.00 0.00 0.00 179.25 180.40 2c3y h LEU 154 N 0.39 0.03 -0.78 0.00 6.46 -1.05 -1.96 115.31 118.40 2c3y h LEU 154 Ca 0.19 -0.06 0.05 0.00 -0.12 0.00 0.00 57.88 57.93 2c3y h LEU 154 Cb 0.12 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 39.99 2c3y h LEU 154 CO -0.15 0.08 0.48 0.58 -0.62 0.00 0.00 178.44 178.81 2c3y h VAL 155 N -0.03 1.06 -0.28 1.05 2.07 -0.85 -0.93 116.25 118.34 2c3y h VAL 155 Ca 0.01 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.24 2c3y h VAL 155 Cb 0.06 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.88 2c3y h VAL 155 CO -0.00 0.16 0.12 0.00 0.02 0.00 0.00 177.57 177.87 2c3y h ALA 156 N 1.36 0.33 0.07 1.67 0.00 -0.25 0.21 119.26 122.65 2c3y h ALA 156 Ca 0.33 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 2c3y h ALA 156 Cb 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2c3y h ALA 156 CO -0.15 -0.28 -0.03 0.45 0.00 0.00 0.00 179.25 179.24 2c3y h HIS 157 N 0.26 -0.08 -0.42 0.00 -0.00 -0.97 0.02 115.15 113.96 2c3y h HIS 157 Ca 0.12 -0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.51 2c3y h HIS 157 Cb 0.06 0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 27.47 2c3y h HIS 157 CO -0.11 0.12 0.24 -0.07 -0.00 0.00 0.00 177.93 178.10 2c3y h LEU 158 N -0.27 0.37 -0.93 2.43 3.38 -1.03 -2.21 115.31 117.05 2c3y h LEU 158 Ca -0.01 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2c3y h LEU 158 Cb 0.24 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2c3y h LEU 158 CO 0.01 0.26 -0.21 0.00 0.09 0.00 0.00 178.44 178.60 2c3y h ALA 159 N 1.20 1.09 -0.49 1.53 0.00 -0.52 -2.53 119.26 119.55 2c3y h ALA 159 Ca 0.17 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2c3y h ALA 159 Cb 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2c3y h ALA 159 CO -0.10 0.56 0.08 0.00 0.00 0.00 0.00 179.25 179.80 2c3y h ALA 160 N 1.29 0.65 -0.16 0.00 0.00 -0.66 0.49 119.26 120.87 2c3y h ALA 160 Ca 0.08 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2c3y h ALA 160 Cb 0.63 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2c3y h ALA 160 CO 0.04 0.38 0.09 0.82 0.00 0.00 0.00 179.25 180.59 2c3y h ILE 161 N 0.69 1.09 -0.19 0.00 2.04 -1.25 0.11 117.51 120.01 2c3y h ILE 161 Ca 0.15 -0.25 -0.21 0.00 1.00 0.00 0.00 64.86 65.55 2c3y h ILE 161 Cb 0.39 0.97 0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2c3y h ILE 161 CO 0.01 0.09 -0.72 -0.08 0.00 0.00 0.00 178.15 177.45 2c3y h GLU 162 N 0.16 0.80 0.00 2.37 4.81 -1.39 -3.33 114.58 118.01 2c3y h GLU 162 Ca 0.06 -0.61 -0.08 0.00 -0.13 0.00 0.00 59.36 58.60 2c3y h GLU 162 Cb 0.06 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 2c3y h GLU 162 CO -0.01 1.23 -0.61 0.66 -0.73 0.00 0.00 179.01 179.55 2c3y h SER 163 N 0.57 0.00 -0.27 1.04 4.64 -0.88 -3.48 113.55 115.17 2c3y h SER 163 Ca -0.03 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.17 2c3y h SER 163 Cb 1.34 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.38 2c3y h SER 163 CO 0.15 0.33 -0.10 0.59 -0.87 0.00 0.00 176.83 176.92 2c3y n ASN 164 N -3.06 -4.47 -4.43 4.97 4.13 0.39 -4.93 115.26 107.85 2c3y n ASN 164 Ca 0.00 0.14 -0.35 0.00 1.68 0.00 0.00 54.58 56.05 2c3y n ASN 164 Cb 0.68 -2.46 -0.13 0.00 -1.54 0.00 0.00 39.78 36.33 2c3y n ASN 164 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2c3y s VAL 165 N -1.94 3.84 0.48 2.41 1.01 -1.25 -3.07 120.40 121.88 2c3y s VAL 165 Ca 0.00 -0.35 -0.24 0.00 0.00 0.00 0.00 61.98 61.39 2c3y s VAL 165 Cb 0.00 -2.73 -0.07 0.00 0.00 0.00 0.00 36.38 33.58 2c3y s VAL 165 CO 0.00 0.44 1.38 -2.16 0.00 0.00 0.00 175.10 174.75 2c3y s PRO 166 N 0.98 3.50 0.02 2.72 0.04 -1.13 -4.46 135.00 136.68 2c3y s PRO 166 Ca 0.01 2.30 0.06 0.00 0.04 0.00 0.00 61.00 63.41 2c3y s PRO 166 Cb -0.14 -2.50 -0.03 0.00 0.04 0.00 0.00 34.50 31.86 2c3y s PRO 166 CO 0.01 -0.92 -0.16 -0.06 0.04 0.00 0.00 177.00 175.92 2c3y s PHE 167 N -1.26 2.63 -0.30 0.56 0.40 -0.47 -0.52 117.98 119.02 2c3y s PHE 167 Ca 0.65 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.78 2c3y s PHE 167 Cb -0.41 -1.51 0.07 0.00 0.51 0.00 0.00 43.02 41.68 2c3y s PHE 167 CO 0.51 0.26 -0.03 1.41 0.70 0.00 0.00 175.22 178.07 2c3y s MET 168 N -1.34 2.12 -0.23 0.44 1.75 0.41 -0.38 119.30 122.08 2c3y s MET 168 Ca 0.15 -1.46 -0.14 0.00 -1.25 0.00 0.00 55.69 52.98 2c3y s MET 168 Cb -0.11 -3.07 -0.04 0.00 2.84 0.00 0.00 34.83 34.45 2c3y s MET 168 CO 0.05 -0.69 0.33 -1.58 -0.65 0.00 0.00 175.02 172.49 2c3y s HIS 169 N 1.10 3.32 0.10 4.11 2.46 0.53 -1.60 115.29 125.31 2c3y s HIS 169 Ca -0.03 0.46 0.04 0.00 0.47 0.00 0.00 55.06 56.00 2c3y s HIS 169 Cb -0.20 -2.48 -0.04 0.00 -0.13 0.00 0.00 32.58 29.74 2c3y s HIS 169 CO -0.05 -0.06 -0.10 -0.59 -2.47 0.00 0.00 174.74 171.48 2c3y s PHE 170 N 1.47 1.07 0.04 3.88 -0.12 -0.78 -0.74 117.98 122.80 2c3y s PHE 170 Ca 0.15 -0.64 -0.14 0.00 -0.05 0.00 0.00 56.93 56.25 2c3y s PHE 170 Cb -0.15 -0.58 0.02 0.00 -0.63 0.00 0.00 43.02 41.68 2c3y s PHE 170 CO 0.08 0.00 0.31 -0.59 -0.05 0.00 0.00 175.22 174.97 2c3y s PHE 171 N -2.38 -0.12 0.13 3.49 -0.12 -0.88 -1.83 117.98 116.26 2c3y s PHE 171 Ca 0.05 0.01 -0.33 0.00 -0.05 0.00 0.00 56.93 56.61 2c3y s PHE 171 Cb -0.03 0.10 -0.13 0.00 -0.63 0.00 0.00 43.02 42.34 2c3y s PHE 171 CO 0.00 -0.50 1.70 -0.25 -0.05 0.00 0.00 175.22 176.13 2c3y n ASP 172 N 0.63 3.51 -4.73 1.98 10.43 -1.26 -0.59 116.55 126.52 2c3y n ASP 172 Ca -0.19 1.04 -0.42 0.00 2.57 0.00 0.00 54.79 57.80 2c3y n ASP 172 Cb 0.59 -1.47 -0.03 0.00 1.84 0.00 0.00 41.12 42.05 2c3y n ASP 172 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 2c3y s GLY 173 N 1.81 1.52 0.00 0.44 0.00 -0.20 -1.68 107.32 109.21 2c3y s GLY 173 Ca 0.81 1.52 0.00 0.00 0.00 0.00 0.00 44.72 47.05 2c3y s GLY 173 CO 0.39 2.73 0.00 0.69 0.00 0.00 0.00 173.10 176.90 2c3y n PHE 174 N 3.55 0.00 -0.10 1.90 3.72 -1.26 -3.19 117.46 122.08 2c3y n PHE 174 Ca 0.13 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 57.73 2c3y n PHE 174 Cb 0.37 0.00 0.62 0.00 -0.94 0.00 0.00 39.48 39.53 2c3y n PHE 174 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 2c3y h ARG 175 N 0.00 0.16 0.00 -1.08 9.65 -1.96 -1.61 114.38 119.54 2c3y h ARG 175 Ca 0.00 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.85 2c3y h ARG 175 Cb 0.00 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.54 2c3y h ARG 175 CO 0.00 0.11 -1.09 2.41 2.80 0.00 0.00 179.97 184.20 2c3y n THR 176 N -4.40 0.09 -0.16 0.20 -1.04 -0.67 -4.33 114.28 103.96 2c3y n THR 176 Ca 0.13 -0.03 0.06 0.00 -2.04 0.00 0.00 64.05 62.17 2c3y n THR 176 Cb 0.64 -0.86 0.35 0.00 -1.82 0.00 0.00 70.33 68.65 2c3y n THR 176 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2c3y h SER 177 N -0.02 0.66 -0.01 8.00 4.64 -1.37 -2.39 113.55 123.07 2c3y h SER 177 Ca -0.04 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2c3y h SER 177 Cb 1.05 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2c3y h SER 177 CO -0.01 0.44 -0.08 1.41 -0.87 0.00 0.00 176.83 177.72 2c3y n HIS 178 N -4.47 0.00 -2.58 4.77 8.25 -0.62 -1.95 115.22 118.62 2c3y n HIS 178 Ca 0.09 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.15 2c3y n HIS 178 Cb 0.19 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.25 2c3y n HIS 178 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2c3y s GLU 179 N -1.18 4.65 -0.11 -0.41 2.12 -1.11 -4.75 118.70 117.91 2c3y s GLU 179 Ca 0.13 1.64 -0.06 0.00 0.36 0.00 0.00 54.97 57.04 2c3y s GLU 179 Cb 0.10 -3.29 -0.04 0.00 0.26 0.00 0.00 34.13 31.16 2c3y s GLU 179 CO 0.20 0.16 0.10 -1.50 -0.54 0.00 0.00 175.26 173.69 2c3y s ILE 180 N -0.36 5.20 0.05 -3.70 2.07 0.91 -3.33 121.20 122.03 2c3y s ILE 180 Ca 0.48 0.09 -0.08 0.00 -1.41 0.00 0.00 60.65 59.73 2c3y s ILE 180 Cb -0.28 -3.25 -0.00 0.00 0.13 0.00 0.00 42.46 39.06 2c3y s ILE 180 CO 0.34 0.61 0.16 -1.10 -1.91 0.00 0.00 174.94 173.04 2c3y s GLN 181 N -0.95 0.68 -0.37 3.50 -1.52 -0.66 -0.99 119.66 119.35 2c3y s GLN 181 Ca 0.14 -0.72 -0.23 0.00 -1.95 0.00 0.00 55.36 52.61 2c3y s GLN 181 Cb -0.12 0.28 0.01 0.00 -0.22 0.00 0.00 33.01 32.96 2c3y s GLN 181 CO 0.03 -0.19 0.76 0.21 -0.25 0.00 0.00 175.29 175.85 2c3y s LYS 182 N -2.77 3.72 0.43 2.91 2.20 -1.03 -1.81 119.74 123.40 2c3y s LYS 182 Ca -0.04 0.25 0.04 0.00 -0.36 0.00 0.00 55.97 55.86 2c3y s LYS 182 Cb -0.00 -3.81 -0.01 0.00 -1.51 0.00 0.00 37.83 32.49 2c3y s LYS 182 CO -0.05 -0.84 0.13 0.44 -0.36 0.00 0.00 175.35 174.67 2c3y n ILE 183 N 5.76 0.00 -5.02 5.43 -5.35 0.19 -4.82 119.36 115.55 2c3y n ILE 183 Ca 0.02 -2.45 -0.32 0.00 -0.27 0.00 0.00 62.75 59.73 2c3y n ILE 183 Cb 0.48 0.83 -0.15 0.00 -1.74 0.00 0.00 39.64 39.06 2c3y n ILE 183 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2c3y s GLU 184 N -3.63 3.00 0.32 6.28 2.12 -1.26 -1.49 118.70 124.03 2c3y s GLU 184 Ca 0.19 -0.79 0.10 0.00 0.36 0.00 0.00 54.97 54.83 2c3y s GLU 184 Cb 0.01 -2.40 -0.06 0.00 0.26 0.00 0.00 34.13 31.94 2c3y s GLU 184 CO 0.13 0.29 -0.12 0.14 -0.54 0.00 0.00 175.26 175.16 2c3y s VAL 185 N 0.10 2.25 0.08 3.70 -7.23 0.55 -4.92 120.40 114.93 2c3y s VAL 185 Ca -0.09 -2.25 0.02 0.00 -1.81 0.00 0.00 61.98 57.85 2c3y s VAL 185 Cb -0.15 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 2c3y s VAL 185 CO 0.06 -0.27 0.14 -0.76 -0.31 0.00 0.00 175.10 173.96 2c3y s LEU 186 N -3.56 4.01 0.66 1.32 1.43 -1.26 -0.14 118.68 121.13 2c3y s LEU 186 Ca 0.31 0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 53.34 2c3y s LEU 186 Cb 0.01 -2.65 -0.00 0.00 0.03 0.00 0.00 46.19 43.57 2c3y s LEU 186 CO 0.16 0.16 1.11 -1.81 0.23 0.00 0.00 176.35 176.19 2c3y s ASP 187 N -2.54 5.14 0.31 2.29 1.01 -0.51 -4.92 116.67 117.46 2c3y s ASP 187 Ca 0.32 1.99 -0.01 0.00 0.71 0.00 0.00 52.55 55.56 2c3y s ASP 187 Cb -0.12 -2.55 0.49 0.00 1.01 0.00 0.00 42.92 41.75 2c3y s ASP 187 CO 0.24 -1.61 1.96 1.88 0.21 0.00 0.00 175.17 177.85 2c3y h TYR 188 N 0.04 0.93 -0.93 4.23 -1.99 -1.97 -2.24 116.97 115.05 2c3y h TYR 188 Ca -0.47 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.34 2c3y h TYR 188 Cb 1.24 -0.31 -0.06 0.00 2.00 0.00 0.00 36.73 39.60 2c3y h TYR 188 CO 0.55 0.62 0.60 0.00 -0.00 0.00 0.00 178.16 179.93 2c3y h ALA 189 N 1.49 1.51 -0.57 3.88 0.00 -1.97 -0.69 119.26 122.92 2c3y h ALA 189 Ca 0.26 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2c3y h ALA 189 Cb -0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2c3y h ALA 189 CO -0.05 0.34 0.17 -0.44 0.00 0.00 0.00 179.25 179.27 2c3y h ASP 190 N 1.04 0.83 -0.48 0.00 3.45 -1.77 -2.11 116.42 117.37 2c3y h ASP 190 Ca 0.41 -0.21 -0.04 0.00 0.43 0.00 0.00 57.03 57.62 2c3y h ASP 190 Cb 0.24 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.77 2c3y h ASP 190 CO -0.16 0.83 0.15 0.24 -1.57 0.00 0.00 179.24 178.73 2c3y h MET 191 N 0.80 0.74 -0.88 3.56 2.86 -1.18 -2.69 114.93 118.13 2c3y h MET 191 Ca 0.18 -0.16 0.07 0.00 -2.06 0.00 0.00 59.70 57.74 2c3y h MET 191 Cb 0.30 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.79 2c3y h MET 191 CO -0.00 0.70 0.57 0.00 1.06 0.00 0.00 176.91 179.24 2c3y h ALA 192 N 1.01 1.57 0.00 6.32 0.00 -0.96 -1.12 119.26 126.08 2c3y h ALA 192 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2c3y h ALA 192 Cb 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2c3y h ALA 192 CO -0.01 0.28 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 2c3y n SER 193 N -4.50 0.60 0.02 0.00 3.41 -0.81 -2.25 113.62 110.08 2c3y n SER 193 Ca 0.14 0.70 0.11 0.00 -0.26 0.00 0.00 58.87 59.56 2c3y n SER 193 Cb 0.23 -0.81 -0.01 0.00 -0.26 0.00 0.00 64.21 63.37 2c3y n SER 193 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2c3y n LEU 194 N -2.22 0.62 -4.74 1.04 4.32 -0.43 -4.95 117.00 110.64 2c3y n LEU 194 Ca 0.01 -0.10 -0.41 0.00 -0.02 0.00 0.00 56.01 55.48 2c3y n LEU 194 Cb 0.14 -0.08 -0.02 0.00 -1.62 0.00 0.00 43.42 41.84 2c3y n LEU 194 CO 0.15 0.08 1.07 -0.69 -1.22 0.00 0.00 177.39 176.78 2c3y s VAL 195 N -3.18 2.80 -0.77 4.08 1.01 -0.95 -4.94 120.40 118.44 2c3y s VAL 195 Ca 0.04 0.67 -0.26 0.00 0.00 0.00 0.00 61.98 62.43 2c3y s VAL 195 Cb 0.15 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 33.14 2c3y s VAL 195 CO 0.82 0.11 1.26 0.21 0.00 0.00 0.00 175.10 177.50 2c3y s ASN 196 N 0.32 6.22 0.31 3.32 3.84 -1.26 -4.87 114.94 122.81 2c3y s ASN 196 Ca 0.58 -0.69 0.01 0.00 0.21 0.00 0.00 52.86 52.97 2c3y s ASN 196 Cb -0.40 -2.54 0.54 0.00 -0.55 0.00 0.00 41.25 38.29 2c3y s ASN 196 CO 0.42 -1.73 1.93 1.56 -2.79 0.00 0.00 177.10 176.49 2c3y h GLN 197 N 9.92 0.98 -0.42 0.43 1.08 -1.95 -1.22 115.11 123.93 2c3y h GLN 197 Ca -0.20 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 56.82 2c3y h GLN 197 Cb 1.05 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 28.24 2c3y h GLN 197 CO 1.29 0.65 -0.20 0.87 -0.95 0.00 0.00 178.83 180.49 2c3y h LYS 198 N 1.01 0.81 -0.50 1.46 6.56 -1.99 0.55 116.57 124.47 2c3y h LYS 198 Ca 0.36 -0.32 -0.10 0.00 -1.06 0.00 0.00 60.65 59.54 2c3y h LYS 198 Cb 0.15 -0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 31.75 2c3y h LYS 198 CO -0.13 0.94 -0.06 0.00 -2.06 0.00 0.00 179.45 178.14 2c3y h ALA 199 N 1.06 0.69 -0.14 3.86 0.00 -1.76 -1.31 119.26 121.66 2c3y h ALA 199 Ca 0.10 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2c3y h ALA 199 Cb 0.71 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2c3y h ALA 199 CO 0.05 0.55 0.08 1.25 0.00 0.00 0.00 179.25 181.19 2c3y h LEU 200 N 0.79 0.17 -0.81 0.00 5.85 -0.95 -0.93 115.31 119.44 2c3y h LEU 200 Ca 0.13 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.84 2c3y h LEU 200 Cb 0.61 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 2c3y h LEU 200 CO 0.04 0.18 0.51 0.00 -0.34 0.00 0.00 178.44 178.82 2c3y h ALA 201 N 1.00 1.08 -0.29 1.25 0.00 -0.75 -1.81 119.26 119.74 2c3y h ALA 201 Ca 0.05 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2c3y h ALA 201 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2c3y h ALA 201 CO -0.01 0.29 -0.20 0.93 0.00 0.00 0.00 179.25 180.26 2c3y h GLU 202 N 0.96 0.53 -0.14 0.00 5.08 -0.95 -0.56 114.58 119.51 2c3y h GLU 202 Ca 0.33 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2c3y h GLU 202 Cb 0.07 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2c3y h GLU 202 CO -0.14 0.70 0.09 0.35 -1.00 0.00 0.00 179.01 179.01 2c3y h PHE 203 N 0.48 0.16 -0.12 4.33 3.57 -0.38 -0.90 116.94 124.09 2c3y h PHE 203 Ca 0.08 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2c3y h PHE 203 Cb 0.61 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 2c3y h PHE 203 CO 0.02 0.10 0.06 0.00 -2.23 0.00 0.00 178.31 176.27 2c3y h ARG 204 N 0.18 0.13 -0.99 1.11 2.47 -1.03 -2.74 114.38 113.51 2c3y h ARG 204 Ca 0.05 -0.01 0.09 0.00 -1.26 0.00 0.00 59.98 58.85 2c3y h ARG 204 Cb -0.01 -0.03 -0.08 0.00 -1.65 0.00 0.00 29.97 28.20 2c3y h ARG 204 CO -0.02 0.09 0.62 0.00 0.56 0.00 0.00 179.97 181.23 2c3y h ALA 205 N 1.05 1.42 -0.00 0.04 0.00 -0.73 -2.33 119.26 118.71 2c3y h ALA 205 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2c3y h ALA 205 Cb -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2c3y h ALA 205 CO -0.02 0.32 -0.17 0.36 0.00 0.00 0.00 179.25 179.74 2c3y n LYS 206 N -4.57 0.16 -1.17 0.00 2.85 -0.38 -4.92 118.16 110.12 2c3y n LYS 206 Ca 0.17 -0.05 -0.30 0.00 -1.05 0.00 0.00 58.31 57.08 2c3y n LYS 206 Cb 0.26 -1.50 0.14 0.00 -0.65 0.00 0.00 35.03 33.29 2c3y n LYS 206 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2c3y s SER 207 N -2.87 3.38 0.27 -5.58 0.01 -0.88 -4.96 113.70 103.06 2c3y s SER 207 Ca 0.17 1.51 -0.30 0.00 1.31 0.00 0.00 55.95 58.63 2c3y s SER 207 Cb 0.19 -2.18 -0.11 0.00 0.21 0.00 0.00 66.02 64.12 2c3y s SER 207 CO 0.56 -2.70 1.58 -0.04 0.41 0.00 0.00 173.24 173.06 2c3y s MET 208 N -4.91 4.15 -0.30 12.44 -1.94 0.97 -4.92 119.30 124.79 2c3y s MET 208 Ca 0.64 2.53 -0.16 0.00 -1.71 0.00 0.00 55.69 56.99 2c3y s MET 208 Cb -0.18 -3.05 0.17 0.00 2.01 0.00 0.00 34.83 33.78 2c3y s MET 208 CO 0.57 -0.61 1.09 1.21 -0.01 0.00 0.00 175.02 177.27 2c3y s ASN 209 N 0.57 -0.37 0.20 3.03 3.84 -1.26 -4.72 114.94 116.22 2c3y s ASN 209 Ca 0.64 0.55 0.13 0.00 0.21 0.00 0.00 52.86 54.39 2c3y s ASN 209 Cb -0.47 1.31 0.70 0.00 -0.55 0.00 0.00 41.25 42.23 2c3y s ASN 209 CO 0.45 -0.08 1.39 -0.81 -2.79 0.00 0.00 177.10 175.25 2c3y n PRO 210 N 4.17 0.08 0.14 0.43 -0.04 -1.26 -1.14 135.00 137.39 2c3y n PRO 210 Ca -0.13 0.58 0.01 0.00 -0.04 0.00 0.00 63.50 63.92 2c3y n PRO 210 Cb 0.55 -1.79 0.15 0.00 -0.04 0.00 0.00 33.50 32.37 2c3y n PRO 210 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2c3y h GLU 211 N 0.00 0.00 -0.71 0.54 3.07 -1.99 -3.37 114.58 112.12 2c3y h GLU 211 Ca 0.00 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.52 2c3y h GLU 211 Cb 0.03 0.00 -0.23 0.00 -0.84 0.00 0.00 28.75 27.71 2c3y h GLU 211 CO 0.00 0.57 -0.71 -2.39 -1.40 0.00 0.00 179.01 175.07 2c3y n HIS 212 N -3.48 -2.12 -1.13 4.33 1.44 -0.29 -5.15 115.22 108.82 2c3y n HIS 212 Ca 0.00 -2.51 -0.29 0.00 -2.01 0.00 0.00 57.72 52.90 2c3y n HIS 212 Cb 0.66 0.89 0.16 0.00 0.12 0.00 0.00 29.99 31.82 2c3y n HIS 212 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 2c3y s PRO 213 N -0.23 0.83 0.27 -1.40 0.04 -0.39 -4.56 135.00 129.56 2c3y s PRO 213 Ca 0.31 0.75 -0.20 0.00 0.04 0.00 0.00 61.00 61.90 2c3y s PRO 213 Cb 0.24 -1.76 0.02 0.00 0.04 0.00 0.00 34.50 33.04 2c3y s PRO 213 CO -0.15 -2.52 0.68 -3.38 0.04 0.00 0.00 177.00 171.67 2c3y s HIS 214 N -2.90 -0.14 -0.09 0.56 -3.43 -1.26 -5.03 115.29 102.99 2c3y s HIS 214 Ca 0.64 -0.29 -0.00 0.00 -0.80 0.00 0.00 55.06 54.62 2c3y s HIS 214 Cb -0.19 0.63 -0.03 0.00 -1.43 0.00 0.00 32.58 31.56 2c3y s HIS 214 CO 0.58 -1.18 -0.06 0.54 -2.00 0.00 0.00 174.74 172.62 2c3y s VAL 215 N -3.92 3.76 0.07 -5.38 0.11 -1.26 -5.00 120.40 108.78 2c3y s VAL 215 Ca 0.12 -0.45 0.04 0.00 -2.93 0.00 0.00 61.98 58.76 2c3y s VAL 215 Cb -0.05 -2.56 -0.03 0.00 -1.53 0.00 0.00 36.38 32.21 2c3y s VAL 215 CO 0.06 0.58 -0.13 0.00 -3.33 0.00 0.00 175.10 172.28 2c3y s ARG 216 N -0.59 0.77 -0.18 1.54 1.70 -1.26 -4.86 118.95 116.07 2c3y s ARG 216 Ca 0.09 -0.93 -0.00 0.00 -0.47 0.00 0.00 55.73 54.42 2c3y s ARG 216 Cb -0.12 -0.70 0.00 0.00 -0.57 0.00 0.00 34.95 33.56 2c3y s ARG 216 CO 0.02 0.15 0.15 0.41 -1.08 0.00 0.00 175.30 174.95 2c3y n GLY 217 N 1.26 0.32 3.87 3.88 0.00 -1.26 -5.05 105.19 108.21 2c3y n GLY 217 Ca -0.21 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 2c3y n GLY 217 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c3y s THR 218 N -3.05 1.98 -0.13 2.61 -4.23 -1.26 -5.06 115.64 106.49 2c3y s THR 218 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 2c3y s THR 218 Cb -0.00 -2.92 -0.02 0.00 1.34 0.00 0.00 72.50 70.90 2c3y s THR 218 CO 0.11 0.00 -0.09 0.00 -0.54 0.00 0.00 174.62 174.10 2c3y s ALA 219 N -3.57 2.77 0.00 3.99 0.00 -1.26 -5.12 121.76 118.58 2c3y s ALA 219 Ca 0.66 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.82 2c3y s ALA 219 Cb -0.10 -1.33 -0.02 0.00 0.00 0.00 0.00 23.12 21.68 2c3y s ALA 219 CO 0.51 0.26 -0.19 -0.65 0.00 0.00 0.00 175.76 175.70 2c3y s GLN 220 N 0.27 1.42 0.85 0.00 -0.21 -1.26 -5.14 119.66 115.59 2c3y s GLN 220 Ca -0.07 -0.73 -0.11 0.00 0.02 0.00 0.00 55.36 54.47 2c3y s GLN 220 Cb -0.15 -1.42 0.14 0.00 1.00 0.00 0.00 33.01 32.59 2c3y s GLN 220 CO 0.04 0.38 1.19 -0.80 -2.12 0.00 0.00 175.29 173.99 2c3y s ASN 221 N -0.65 3.84 0.64 5.90 0.02 -1.26 -4.76 114.94 118.67 2c3y s ASN 221 Ca 0.07 0.28 0.39 0.00 -1.02 0.00 0.00 52.86 52.58 2c3y s ASN 221 Cb -0.07 -0.56 2.17 0.00 0.02 0.00 0.00 41.25 42.80 2c3y s ASN 221 CO 0.00 -2.26 2.29 -0.65 0.02 0.00 0.00 177.10 176.51 2c3y h PRO 222 N -1.18 0.00 -0.26 -0.60 0.11 -2.01 -2.50 132.00 125.56 2c3y h PRO 222 Ca -0.43 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.64 2c3y h PRO 222 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2c3y h PRO 222 CO 0.47 0.00 0.00 0.38 -0.21 0.00 0.00 178.00 178.64 2c3y h ASP 223 N 0.00 0.35 0.00 -2.05 2.03 -2.05 -3.37 116.42 111.33 2c3y h ASP 223 Ca 0.01 -0.05 0.00 0.00 -0.73 0.00 0.00 57.03 56.25 2c3y h ASP 223 Cb 0.09 -0.09 0.00 0.00 -0.83 0.00 0.00 39.33 38.49 2c3y h ASP 223 CO -0.00 0.41 0.00 2.30 -1.03 0.00 0.00 179.24 180.92 2c3y n ILE 224 N -4.33 0.00 -0.03 4.15 -5.35 -1.07 -4.89 119.36 107.84 2c3y n ILE 224 Ca 0.01 -0.24 -0.09 0.00 -0.27 0.00 0.00 62.75 62.16 2c3y n ILE 224 Cb 0.21 1.10 -0.03 0.00 -1.74 0.00 0.00 39.64 39.17 2c3y n ILE 224 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 2c3y h TYR 225 N 0.00 -0.11 -0.35 4.28 3.20 -1.62 -1.76 116.97 120.60 2c3y h TYR 225 Ca 0.00 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.92 2c3y h TYR 225 Cb 0.05 0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 2c3y h TYR 225 CO 0.00 -0.09 0.12 0.35 -1.64 0.00 0.00 178.16 176.90 2c3y h PHE 226 N -0.02 0.22 -0.90 -3.82 -0.00 -1.87 -0.59 116.94 109.96 2c3y h PHE 226 Ca 0.09 0.02 0.02 0.00 -0.00 0.00 0.00 57.97 58.10 2c3y h PHE 226 Cb 0.15 -0.05 -0.05 0.00 -0.00 0.00 0.00 35.95 36.00 2c3y h PHE 226 CO -0.21 0.09 0.59 1.96 -0.00 0.00 0.00 178.31 180.75 2c3y h GLN 227 N 0.27 1.14 -0.27 1.11 7.50 -1.86 -2.10 115.11 120.90 2c3y h GLN 227 Ca 0.16 -0.07 -0.06 0.00 0.50 0.00 0.00 58.65 59.18 2c3y h GLN 227 Cb 0.13 -0.26 -0.02 0.00 0.05 0.00 0.00 27.48 27.38 2c3y h GLN 227 CO -0.16 0.75 -0.10 0.78 -1.50 0.00 0.00 178.83 178.61 2c3y h GLY 228 N 1.17 0.47 1.95 3.46 0.00 -0.46 -2.17 103.07 107.49 2c3y h GLY 228 Ca 0.35 -0.31 -0.14 0.00 0.00 0.00 0.00 47.33 47.23 2c3y h GLY 228 CO -0.10 0.29 -0.64 -0.09 0.00 0.00 0.00 176.54 176.00 2c3y h ARG 229 N 0.41 0.05 0.00 4.80 9.65 -0.59 -3.16 114.38 125.54 2c3y h ARG 229 Ca 0.08 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2c3y h ARG 229 Cb 0.43 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.02 2c3y h ARG 229 CO 0.02 0.67 -0.44 0.93 2.80 0.00 0.00 179.97 183.95 2c3y h GLU 230 N 0.04 0.00 0.00 0.20 4.39 -1.06 -3.36 114.58 114.79 2c3y h GLU 230 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2c3y h GLU 230 Cb 1.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 2c3y h GLU 230 CO 0.09 0.00 0.03 0.00 -1.16 0.00 0.00 179.01 177.97 2c3y h ALA 231 N 2.46 1.03 -0.01 3.43 0.00 -1.36 -1.99 119.26 122.82 2c3y h ALA 231 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c3y h ALA 231 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2c3y h ALA 231 CO 0.00 -0.03 -0.20 0.00 0.00 0.00 0.00 179.25 179.02 2c3y n ALA 232 N -1.92 2.96 -0.28 0.00 0.00 -1.26 -4.41 120.51 115.60 2c3y n ALA 232 Ca -0.02 -0.36 0.04 0.00 0.00 0.00 0.00 53.44 53.10 2c3y n ALA 232 Cb 0.09 -1.20 0.14 0.00 0.00 0.00 0.00 19.45 18.47 2c3y n ALA 232 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2c3y h ASN 233 N 1.02 -0.58 -0.93 0.00 -0.26 -1.65 -0.27 115.58 112.92 2c3y h ASN 233 Ca 0.00 0.23 0.16 0.00 -0.56 0.00 0.00 56.30 56.13 2c3y h ASN 233 Cb 0.46 0.44 -0.08 0.00 -1.06 0.00 0.00 38.32 38.08 2c3y h ASN 233 CO 0.00 -0.24 0.59 -0.65 -1.06 0.00 0.00 177.43 176.07 2c3y h PRO 234 N 0.04 0.66 -0.31 0.81 0.11 -1.85 0.41 132.00 131.88 2c3y h PRO 234 Ca 0.41 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.38 2c3y h PRO 234 Cb 0.69 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 2c3y h PRO 234 CO -0.78 0.44 -0.20 1.88 -0.21 0.00 0.00 178.00 179.13 2c3y h TYR 235 N 0.68 0.79 0.00 0.65 0.05 -1.36 -2.99 116.97 114.80 2c3y h TYR 235 Ca 0.48 -0.21 -0.10 0.00 0.05 0.00 0.00 58.73 58.95 2c3y h TYR 235 Cb 0.82 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 38.37 2c3y h TYR 235 CO -0.00 0.93 -0.49 1.88 -1.05 0.00 0.00 178.16 179.42 2c3y h TYR 236 N 0.43 0.00 0.00 4.88 -1.99 -1.06 -2.94 116.97 116.29 2c3y h TYR 236 Ca 0.06 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.73 2c3y h TYR 236 Cb 0.75 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.47 2c3y h TYR 236 CO 0.06 0.49 -0.28 -0.07 -0.00 0.00 0.00 178.16 178.37 2c3y h LEU 237 N 0.00 0.00 -0.37 3.88 3.38 -0.84 -3.02 115.31 118.34 2c3y h LEU 237 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2c3y h LEU 237 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2c3y h LEU 237 CO 0.06 0.28 -0.55 0.29 0.09 0.00 0.00 178.44 178.61 2c3y n LYS 238 N -3.96 0.51 -0.31 1.13 5.02 -1.12 -4.37 118.16 115.06 2c3y n LYS 238 Ca -0.02 -0.37 -0.04 0.00 -2.02 0.00 0.00 58.31 55.86 2c3y n LYS 238 Cb 0.35 -1.49 0.09 0.00 -0.02 0.00 0.00 35.03 33.96 2c3y n LYS 238 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 2c3y h VAL 239 N 0.89 1.26 -0.71 -0.18 3.04 -1.41 -2.11 116.25 117.03 2c3y h VAL 239 Ca 0.00 -0.71 0.03 0.00 -1.01 0.00 0.00 66.70 65.01 2c3y h VAL 239 Cb 0.56 0.15 -0.04 0.00 -2.01 0.00 0.00 31.29 29.95 2c3y h VAL 239 CO 0.00 0.31 0.44 -0.65 -1.01 0.00 0.00 177.57 176.66 2c3y h PRO 240 N 1.21 0.84 -0.21 4.17 0.11 -1.76 -0.49 132.00 135.87 2c3y h PRO 240 Ca 0.30 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.23 2c3y h PRO 240 Cb 0.10 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 2c3y h PRO 240 CO -0.04 0.55 -0.40 0.78 -0.21 0.00 0.00 178.00 178.68 2c3y h GLY 241 N 0.86 0.52 1.16 -0.55 0.00 -1.80 -1.65 103.07 101.62 2c3y h GLY 241 Ca 0.29 -0.51 -0.11 0.00 0.00 0.00 0.00 47.33 47.00 2c3y h GLY 241 CO -0.11 0.46 -0.08 -2.22 0.00 0.00 0.00 176.54 174.59 2c3y h ILE 242 N 0.40 1.27 -0.12 2.60 2.04 -0.80 0.85 117.51 123.73 2c3y h ILE 242 Ca 0.04 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.65 2c3y h ILE 242 Cb 0.88 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.89 2c3y h ILE 242 CO 0.07 0.43 -0.01 0.58 0.00 0.00 0.00 178.15 179.23 2c3y h VAL 243 N 0.89 1.26 -0.63 1.67 2.07 -0.94 -1.08 116.25 119.49 2c3y h VAL 243 Ca 0.14 -0.85 0.03 0.00 0.82 0.00 0.00 66.70 66.84 2c3y h VAL 243 Cb 0.63 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 2c3y h VAL 243 CO 0.04 0.25 0.38 0.00 0.02 0.00 0.00 177.57 178.26 2c3y h ALA 244 N 0.74 0.81 -3.00 1.67 0.00 -1.21 -0.36 119.26 117.92 2c3y h ALA 244 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2c3y h ALA 244 Cb 0.38 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2c3y h ALA 244 CO 0.01 0.12 0.00 0.39 0.00 0.00 0.00 179.25 179.77 2c3y n GLU 245 N -4.73 3.51 0.00 0.00 4.71 0.28 -1.99 120.64 122.42 2c3y n GLU 245 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.21 2c3y n GLU 245 Cb 0.09 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.52 2c3y n GLU 245 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2c3y n TYR 246 N 0.00 0.00 -0.17 -0.32 4.02 -0.43 -1.96 117.16 118.31 2c3y n TYR 246 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 2c3y n TYR 246 Cb 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.37 2c3y n TYR 246 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 176.86 176.37 2c3y h MET 247 N 1.86 0.98 0.07 -0.72 2.86 -0.61 -1.04 114.93 118.34 2c3y h MET 247 Ca 0.00 -0.34 -0.00 0.00 -2.06 0.00 0.00 59.70 57.29 2c3y h MET 247 Cb 0.00 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.59 2c3y h MET 247 CO 0.00 1.02 -0.03 1.96 1.06 0.00 0.00 176.91 180.91 2c3y h GLN 248 N 0.88 -0.09 -0.06 1.72 7.50 -0.97 0.41 115.11 124.50 2c3y h GLN 248 Ca 0.14 0.01 0.02 0.00 0.50 0.00 0.00 58.65 59.32 2c3y h GLN 248 Cb 0.63 0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.17 2c3y h GLN 248 CO 0.04 0.11 -0.05 0.87 -1.50 0.00 0.00 178.83 178.31 2c3y h LYS 249 N -0.29 -0.06 -0.74 1.46 1.57 -1.30 0.22 116.57 117.44 2c3y h LYS 249 Ca -0.01 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 2c3y h LYS 249 Cb 0.25 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2c3y h LYS 249 CO 0.02 -0.04 0.47 0.28 -0.57 0.00 0.00 179.45 179.61 2c3y h VAL 250 N -0.06 1.11 -0.96 0.50 2.07 -1.17 -2.04 116.25 115.70 2c3y h VAL 250 Ca 0.04 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.29 2c3y h VAL 250 Cb 0.12 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 29.95 2c3y h VAL 250 CO -0.09 0.17 0.63 0.00 0.02 0.00 0.00 177.57 178.29 2c3y h ALA 251 N 1.31 1.40 0.00 1.67 0.00 -0.18 0.44 119.26 123.90 2c3y h ALA 251 Ca 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2c3y h ALA 251 Cb 0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 2c3y h ALA 251 CO -0.11 0.50 -0.03 0.66 0.00 0.00 0.00 179.25 180.28 2c3y h SER 252 N 1.19 0.00 0.14 0.00 4.64 -0.24 1.22 113.55 120.50 2c3y h SER 252 Ca 0.39 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.34 2c3y h SER 252 Cb 0.04 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.09 2c3y h SER 252 CO -0.12 0.03 -2.12 0.18 -0.87 0.00 0.00 176.83 173.93 2c3y n LEU 253 N -3.22 2.25 -0.04 5.97 4.77 -0.36 -4.60 117.00 121.77 2c3y n LEU 253 Ca -0.01 0.13 0.02 0.00 -0.03 0.00 0.00 56.01 56.11 2c3y n LEU 253 Cb 0.19 -0.74 -0.16 0.00 -2.33 0.00 0.00 43.42 40.38 2c3y n LEU 253 CO 0.25 0.78 -0.90 0.35 -1.33 0.00 0.00 177.39 176.54 2c3y n THR 254 N -3.30 0.62 -0.64 -5.08 -2.24 0.00 -4.95 114.28 98.70 2c3y n THR 254 Ca -0.34 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 60.79 2c3y n THR 254 Cb 1.04 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 2c3y n THR 254 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3y n GLY 255 N 1.47 0.76 3.35 3.38 0.00 0.42 -5.02 105.19 109.55 2c3y n GLY 255 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 2c3y n GLY 255 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c3y s ARG 256 N -0.36 3.07 0.14 1.61 0.52 -1.24 -5.02 118.95 117.66 2c3y s ARG 256 Ca 0.00 -0.88 -0.07 0.00 -0.52 0.00 0.00 55.73 54.27 2c3y s ARG 256 Cb 0.00 -3.43 -0.06 0.00 0.52 0.00 0.00 34.95 31.98 2c3y s ARG 256 CO 0.00 -0.47 0.41 -1.12 0.02 0.00 0.00 175.30 174.14 2c3y s SER 257 N 1.51 6.54 0.06 0.23 0.01 -1.26 -4.06 113.70 116.73 2c3y s SER 257 Ca 0.02 0.69 -0.08 0.00 1.31 0.00 0.00 55.95 57.89 2c3y s SER 257 Cb -0.17 -2.13 -0.00 0.00 0.21 0.00 0.00 66.02 63.92 2c3y s SER 257 CO 0.03 0.06 0.17 -0.31 0.41 0.00 0.00 173.24 173.60 2c3y s TYR 258 N -1.63 0.13 0.21 2.43 1.51 -1.26 -5.11 117.35 113.62 2c3y s TYR 258 Ca 0.40 -0.44 0.01 0.00 -1.01 0.00 0.00 57.07 56.03 2c3y s TYR 258 Cb -0.12 -0.07 -0.05 0.00 -0.11 0.00 0.00 41.96 41.61 2c3y s TYR 258 CO 0.23 -0.46 0.06 0.15 -1.11 0.00 0.00 175.55 174.42 2c3y s LYS 259 N -3.05 1.24 0.36 -0.62 1.02 -1.26 -4.72 119.74 112.70 2c3y s LYS 259 Ca -0.01 -1.64 0.09 0.00 0.02 0.00 0.00 55.97 54.43 2c3y s LYS 259 Cb 0.01 -0.17 0.81 0.00 -0.52 0.00 0.00 37.83 37.96 2c3y s LYS 259 CO -0.07 -0.24 1.89 -0.07 -0.92 0.00 0.00 175.35 175.95 2c3y h LEU 260 N 2.56 0.64 -7.64 3.17 4.07 -1.94 -3.40 115.31 112.79 2c3y h LEU 260 Ca -0.37 0.03 -0.32 0.00 0.08 0.00 0.00 57.88 57.30 2c3y h LEU 260 Cb 1.23 -0.10 -0.33 0.00 1.08 0.00 0.00 40.66 42.54 2c3y h LEU 260 CO 0.61 0.35 -0.74 -0.36 -1.08 0.00 0.00 178.44 177.22 2c3y s PHE 261 N -5.66 0.25 -0.04 1.13 0.08 -1.26 -0.84 117.98 111.63 2c3y s PHE 261 Ca -0.10 0.01 0.06 0.00 0.12 0.00 0.00 56.93 57.03 2c3y s PHE 261 Cb 0.21 -0.33 -0.01 0.00 -0.57 0.00 0.00 43.02 42.32 2c3y s PHE 261 CO 0.78 -0.10 -0.23 -0.51 -0.10 0.00 0.00 175.22 175.06 2c3y s ASP 262 N 0.80 2.82 -0.00 1.36 -0.00 -0.16 -4.82 116.67 116.68 2c3y s ASP 262 Ca -0.08 -0.46 0.01 0.00 -0.00 0.00 0.00 52.55 52.03 2c3y s ASP 262 Cb -0.11 -0.60 -0.04 0.00 -0.00 0.00 0.00 42.92 42.18 2c3y s ASP 262 CO -0.02 0.25 0.01 -0.47 -0.00 0.00 0.00 175.17 174.94 2c3y s TYR 263 N -0.29 3.10 -0.01 4.23 6.14 -1.26 0.92 117.35 130.18 2c3y s TYR 263 Ca 0.01 0.09 -0.01 0.00 0.64 0.00 0.00 57.07 57.81 2c3y s TYR 263 Cb -0.12 -1.68 -0.00 0.00 0.42 0.00 0.00 41.96 40.59 2c3y s TYR 263 CO 0.02 0.47 0.03 0.08 0.64 0.00 0.00 175.55 176.78 2c3y s VAL 264 N -1.09 0.02 -1.24 3.14 1.01 0.18 -4.99 120.40 117.43 2c3y s VAL 264 Ca 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2c3y s VAL 264 Cb -0.12 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.16 2c3y s VAL 264 CO 0.10 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.72 2c3y n GLY 265 N 2.75 0.42 3.72 4.51 0.00 -1.26 0.44 105.19 115.77 2c3y n GLY 265 Ca -0.15 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.24 2c3y n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y s ALA 266 N -1.74 3.84 0.62 4.61 0.00 -0.39 -4.87 121.76 123.83 2c3y s ALA 266 Ca 0.00 1.45 0.38 0.00 0.00 0.00 0.00 51.96 53.79 2c3y s ALA 266 Cb 0.00 -3.65 2.13 0.00 0.00 0.00 0.00 23.12 21.61 2c3y s ALA 266 CO 0.00 -0.83 2.31 -1.35 0.00 0.00 0.00 175.76 175.89 2c3y h PRO 267 N 6.76 0.00 -0.29 0.00 0.11 -1.96 -1.46 132.00 135.15 2c3y h PRO 267 Ca -0.43 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.53 2c3y h PRO 267 Cb 1.20 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.22 2c3y h PRO 267 CO 0.93 0.00 -0.16 -0.40 -0.21 0.00 0.00 178.00 178.16 2c3y n ASP 268 N -3.41 2.32 -4.77 -2.05 5.75 -1.26 -4.76 116.55 108.36 2c3y n ASP 268 Ca -0.03 -3.82 -0.40 0.00 -0.01 0.00 0.00 54.79 50.54 2c3y n ASP 268 Cb 0.09 -0.62 0.01 0.00 -1.03 0.00 0.00 41.12 39.57 2c3y n ASP 268 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2c3y s ALA 269 N -3.25 3.23 -0.08 2.12 0.00 -0.55 -4.88 121.76 118.35 2c3y s ALA 269 Ca 0.44 1.37 0.15 0.00 0.00 0.00 0.00 51.96 53.92 2c3y s ALA 269 Cb 0.40 -3.55 -0.23 0.00 0.00 0.00 0.00 23.12 19.74 2c3y s ALA 269 CO -0.02 -1.06 0.23 0.39 0.00 0.00 0.00 175.76 175.30 2c3y n GLU 270 N -0.12 0.93 -4.04 0.00 1.02 -0.84 -2.39 120.64 115.19 2c3y n GLU 270 Ca 0.05 -0.09 -0.34 0.00 -0.02 0.00 0.00 57.16 56.76 2c3y n GLU 270 Cb 0.43 -1.39 -0.15 0.00 -0.02 0.00 0.00 31.44 30.30 2c3y n GLU 270 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2c3y s ARG 271 N -2.81 2.94 0.06 3.49 0.52 -1.21 0.91 118.95 122.86 2c3y s ARG 271 Ca -0.07 -0.88 0.07 0.00 -0.52 0.00 0.00 55.73 54.33 2c3y s ARG 271 Cb 0.08 -2.77 -0.03 0.00 0.52 0.00 0.00 34.95 32.75 2c3y s ARG 271 CO 0.66 -0.29 -0.18 0.08 0.02 0.00 0.00 175.30 175.59 2c3y s VAL 272 N 1.31 1.49 0.05 3.52 1.01 -0.40 -1.60 120.40 125.78 2c3y s VAL 272 Ca 0.03 -1.27 0.05 0.00 0.00 0.00 0.00 61.98 60.79 2c3y s VAL 272 Cb -0.15 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 2c3y s VAL 272 CO -0.09 0.03 -0.09 -0.63 0.00 0.00 0.00 175.10 174.32 2c3y s ILE 273 N -0.98 3.43 -0.17 2.22 1.01 -0.28 -1.37 121.20 125.06 2c3y s ILE 273 Ca 0.05 -1.04 0.01 0.00 0.00 0.00 0.00 60.65 59.67 2c3y s ILE 273 Cb -0.09 -2.54 0.02 0.00 0.01 0.00 0.00 42.46 39.86 2c3y s ILE 273 CO 0.02 0.26 -0.20 -0.69 0.00 0.00 0.00 174.94 174.33 2c3y s VAL 274 N -1.09 2.03 0.21 2.92 1.01 -0.43 -0.50 120.40 124.56 2c3y s VAL 274 Ca 0.19 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 61.18 2c3y s VAL 274 Cb -0.11 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 2c3y s VAL 274 CO 0.10 0.54 0.24 -0.55 0.00 0.00 0.00 175.10 175.43 2c3y s SER 275 N 1.15 0.08 -0.01 3.32 0.15 -0.98 -1.38 113.70 116.02 2c3y s SER 275 Ca 0.01 -1.22 -0.01 0.00 0.70 0.00 0.00 55.95 55.43 2c3y s SER 275 Cb -0.14 0.44 0.01 0.00 -1.71 0.00 0.00 66.02 64.62 2c3y s SER 275 CO -0.09 -0.93 0.02 -0.32 1.20 0.00 0.00 173.24 173.12 2c3y s MET 276 N -4.11 0.01 0.48 5.44 1.75 -1.26 -2.03 119.30 119.58 2c3y s MET 276 Ca 0.33 0.06 0.00 0.00 -1.25 0.00 0.00 55.69 54.83 2c3y s MET 276 Cb 0.04 -0.04 0.00 0.00 2.84 0.00 0.00 34.83 37.67 2c3y s MET 276 CO 0.10 -0.04 0.00 0.41 -0.65 0.00 0.00 175.02 174.85 2c3y n GLY 277 N 3.30 -1.80 0.38 2.11 0.00 -1.26 -4.44 105.19 103.48 2c3y n GLY 277 Ca -0.15 -1.82 0.20 0.00 0.00 0.00 0.00 46.02 44.24 2c3y n GLY 277 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2c3y h SER 278 N 0.00 0.00 -0.40 1.61 4.64 -1.77 -1.28 113.55 116.35 2c3y h SER 278 Ca 0.00 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.41 2c3y h SER 278 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2c3y h SER 278 CO 0.00 0.00 0.28 0.77 -0.87 0.00 0.00 176.83 177.01 2c3y h SER 279 N 0.00 0.12 -0.67 4.97 4.64 -1.86 -2.05 113.55 118.70 2c3y h SER 279 Ca 0.20 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.55 2c3y h SER 279 Cb 0.94 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.97 2c3y h SER 279 CO -0.00 0.08 0.44 0.00 -0.87 0.00 0.00 176.83 176.48 2c3y h GLU 281 N 0.79 0.23 -0.50 0.00 4.39 -1.56 -1.64 114.58 116.28 2c3y h GLU 281 Ca 0.27 -0.04 -0.11 0.00 0.34 0.00 0.00 59.36 59.82 2c3y h GLU 281 Cb 0.10 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 2c3y h GLU 281 CO -0.08 0.33 -0.11 1.15 -1.16 0.00 0.00 179.01 179.15 2c3y h THR 282 N 0.07 1.26 -0.65 1.13 2.02 -1.26 -2.22 112.91 113.27 2c3y h THR 282 Ca 0.05 -1.23 -0.02 0.00 0.77 0.00 0.00 66.41 65.98 2c3y h THR 282 Cb 0.19 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 2c3y h THR 282 CO -0.00 0.43 0.32 0.40 0.37 0.00 0.00 175.52 177.04 2c3y h ILE 283 N 0.83 1.22 -0.64 3.11 2.04 -1.09 -1.90 117.51 121.08 2c3y h ILE 283 Ca 0.13 -0.62 -0.07 0.00 1.00 0.00 0.00 64.86 65.31 2c3y h ILE 283 Cb 0.64 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2c3y h ILE 283 CO 0.04 0.25 0.14 -0.08 0.00 0.00 0.00 178.15 178.51 2c3y h GLU 284 N 0.90 1.02 -0.75 2.37 4.81 -1.13 -0.75 114.58 121.06 2c3y h GLU 284 Ca 0.23 -0.24 0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2c3y h GLU 284 Cb 0.11 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.31 2c3y h GLU 284 CO -0.03 0.92 0.49 1.49 -0.73 0.00 0.00 179.01 181.15 2c3y h GLU 285 N 0.97 0.96 -0.41 1.92 4.81 -0.98 -0.94 114.58 120.91 2c3y h GLU 285 Ca 0.20 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.25 2c3y h GLU 285 Cb 0.36 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 2c3y h GLU 285 CO 0.00 0.63 -0.25 0.28 -0.73 0.00 0.00 179.01 178.95 2c3y h VAL 286 N 0.99 1.27 0.07 0.32 2.07 -0.93 -2.72 116.25 117.32 2c3y h VAL 286 Ca 0.28 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.42 2c3y h VAL 286 Cb -0.07 1.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2c3y h VAL 286 CO -0.08 0.47 -0.06 0.40 0.02 0.00 0.00 177.57 178.32 2c3y h ILE 287 N 0.73 0.87 -0.57 4.57 2.04 -0.52 0.15 117.51 124.78 2c3y h ILE 287 Ca 0.09 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.07 2c3y h ILE 287 Cb 0.79 0.87 -0.09 0.00 -0.74 0.00 0.00 36.82 37.65 2c3y h ILE 287 CO 0.07 0.00 0.04 0.78 0.00 0.00 0.00 178.15 179.03 2c3y h ASN 288 N -0.14 -0.17 -0.38 1.72 -0.26 -1.13 0.61 115.58 115.83 2c3y h ASN 288 Ca -0.00 0.13 -0.03 0.00 -0.56 0.00 0.00 56.30 55.84 2c3y h ASN 288 Cb 0.13 0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.59 2c3y h ASN 288 CO -0.01 -0.07 0.13 -0.74 -1.06 0.00 0.00 177.43 175.68 2c3y h HIS 289 N 0.16 0.61 0.01 1.19 2.76 -1.12 -2.57 115.15 116.19 2c3y h HIS 289 Ca 0.30 -0.06 -0.20 0.00 -2.20 0.00 0.00 60.37 58.21 2c3y h HIS 289 Cb 0.46 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.23 2c3y h HIS 289 CO -0.31 0.57 -0.92 -0.07 -1.30 0.00 0.00 177.93 175.90 2c3y h LEU 290 N 0.47 0.14 -0.69 0.26 4.07 -0.06 -3.26 115.31 116.23 2c3y h LEU 290 Ca 0.12 -0.13 -0.10 0.00 0.08 0.00 0.00 57.88 57.86 2c3y h LEU 290 Cb 0.24 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 41.92 2c3y h LEU 290 CO -0.01 0.99 -0.07 0.00 -1.08 0.00 0.00 178.44 178.27 2c3y h ALA 291 N 1.00 0.89 -0.02 1.53 0.00 0.21 -1.68 119.26 121.20 2c3y h ALA 291 Ca -0.04 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.56 2c3y h ALA 291 Cb 1.59 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 2c3y h ALA 291 CO 0.13 0.64 0.05 0.00 0.00 0.00 0.00 179.25 180.07 2c3y h ALA 292 N 1.06 1.25 -0.44 0.00 0.00 -1.50 0.57 119.26 120.19 2c3y h ALA 292 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2c3y h ALA 292 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2c3y h ALA 292 CO 0.04 -0.06 0.00 1.63 0.00 0.00 0.00 179.25 180.86 2c3y n LYS 293 N -3.34 2.13 -0.61 0.00 5.02 -0.68 -4.92 118.16 115.76 2c3y n LYS 293 Ca -0.02 -1.74 0.00 0.00 -2.02 0.00 0.00 58.31 54.53 2c3y n LYS 293 Cb 0.12 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 2c3y n LYS 293 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c3y n GLY 294 N 1.29 0.67 3.69 0.72 0.00 0.20 -5.05 105.19 106.71 2c3y n GLY 294 Ca 0.17 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 2c3y n GLY 294 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c3y s GLU 295 N -0.65 4.39 -1.09 1.61 2.02 -0.93 -4.98 118.70 119.05 2c3y s GLU 295 Ca 0.00 1.04 -0.20 0.00 0.02 0.00 0.00 54.97 55.83 2c3y s GLU 295 Cb 0.00 -3.51 0.09 0.00 0.10 0.00 0.00 34.13 30.80 2c3y s GLU 295 CO 0.00 -0.15 1.46 0.15 0.02 0.00 0.00 175.26 176.73 2c3y s LYS 296 N 1.51 3.75 0.06 1.61 -0.14 -1.26 -4.23 119.74 121.04 2c3y s LYS 296 Ca 0.40 -1.65 0.03 0.00 -1.36 0.00 0.00 55.97 53.39 2c3y s LYS 296 Cb -0.18 -5.28 -0.03 0.00 -1.68 0.00 0.00 37.83 30.66 2c3y s LYS 296 CO 0.17 -2.08 -0.09 0.96 -0.76 0.00 0.00 175.35 173.55 2c3y s ILE 297 N 3.92 0.67 0.25 2.17 -4.36 -1.26 -1.99 121.20 120.61 2c3y s ILE 297 Ca 0.45 -1.29 -0.04 0.00 -0.26 0.00 0.00 60.65 59.50 2c3y s ILE 297 Cb -0.00 -0.90 -0.02 0.00 1.25 0.00 0.00 42.46 42.78 2c3y s ILE 297 CO -0.04 -0.46 0.32 -0.83 0.24 0.00 0.00 174.94 174.17 2c3y s GLY 298 N -1.91 1.25 -0.05 6.27 0.00 -0.63 -1.26 107.32 110.99 2c3y s GLY 298 Ca -0.04 -1.45 -0.03 0.00 0.00 0.00 0.00 44.72 43.20 2c3y s GLY 298 CO -0.00 -1.09 0.12 -2.27 0.00 0.00 0.00 173.10 169.86 2c3y s LEU 299 N -3.15 1.23 -0.26 0.66 2.96 0.17 -1.13 118.68 119.16 2c3y s LEU 299 Ca 0.32 0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 54.42 2c3y s LEU 299 Cb 0.03 0.34 -0.00 0.00 0.50 0.00 0.00 46.19 47.06 2c3y s LEU 299 CO 0.14 -0.08 0.03 -0.63 -1.32 0.00 0.00 176.35 174.49 2c3y s ILE 300 N 0.54 3.80 -0.14 6.68 1.01 0.35 -0.64 121.20 132.78 2c3y s ILE 300 Ca -0.04 -0.56 -0.18 0.00 0.00 0.00 0.00 60.65 59.87 2c3y s ILE 300 Cb -0.06 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 2c3y s ILE 300 CO -0.02 0.23 0.46 -0.54 0.00 0.00 0.00 174.94 175.07 2c3y s LYS 301 N 1.50 4.30 -0.24 2.79 1.02 0.26 -2.32 119.74 127.06 2c3y s LYS 301 Ca 0.04 0.39 -0.15 0.00 0.02 0.00 0.00 55.97 56.27 2c3y s LYS 301 Cb -0.16 -3.46 -0.04 0.00 -0.52 0.00 0.00 37.83 33.65 2c3y s LYS 301 CO 0.01 0.10 0.36 0.14 -0.92 0.00 0.00 175.35 175.04 2c3y s VAL 302 N 0.81 5.20 -0.16 3.17 -7.23 -0.86 -0.98 120.40 120.35 2c3y s VAL 302 Ca 0.24 0.58 -0.16 0.00 -1.81 0.00 0.00 61.98 60.83 2c3y s VAL 302 Cb -0.15 -3.69 -0.05 0.00 0.56 0.00 0.00 36.38 33.05 2c3y s VAL 302 CO 0.09 0.21 -0.31 0.54 -0.31 0.00 0.00 175.10 175.32 2c3y n ARG 303 N 4.89 0.48 -3.08 4.82 3.00 -0.02 -4.57 116.66 122.17 2c3y n ARG 303 Ca -0.09 0.19 -0.44 0.00 -0.01 0.00 0.00 57.85 57.50 2c3y n ARG 303 Cb 0.51 -1.33 -0.05 0.00 0.00 0.00 0.00 32.46 31.58 2c3y n ARG 303 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2c3y s LEU 304 N -7.61 4.88 0.07 0.55 2.96 -0.82 0.07 118.68 118.78 2c3y s LEU 304 Ca -0.26 -0.95 0.02 0.00 -0.22 0.00 0.00 54.13 52.72 2c3y s LEU 304 Cb 0.04 -2.47 -0.25 0.00 0.50 0.00 0.00 46.19 44.01 2c3y s LEU 304 CO 0.39 -1.03 1.09 0.22 -1.32 0.00 0.00 176.35 175.70 2c3y h TYR 305 N 9.12 0.25 -3.21 5.38 3.20 -1.08 -3.43 116.97 127.20 2c3y h TYR 305 Ca -0.28 -0.18 -0.26 0.00 3.14 0.00 0.00 58.73 61.15 2c3y h TYR 305 Cb 1.09 -0.01 -0.33 0.00 1.54 0.00 0.00 36.73 39.02 2c3y h TYR 305 CO 0.81 1.17 -0.62 1.03 -1.64 0.00 0.00 178.16 178.91 2c3y s ARG 306 N -2.66 0.07 0.55 1.82 1.81 -1.12 -3.25 118.95 116.16 2c3y s ARG 306 Ca -0.03 0.43 -0.20 0.00 -1.72 0.00 0.00 55.73 54.21 2c3y s ARG 306 Cb 0.08 -0.22 -0.05 0.00 -0.45 0.00 0.00 34.95 34.31 2c3y s ARG 306 CO 0.85 -0.21 1.20 -2.14 -0.68 0.00 0.00 175.30 174.31 2c3y s PRO 307 N 1.55 3.25 -0.50 3.54 0.02 -1.26 0.00 135.00 141.60 2c3y s PRO 307 Ca -0.05 1.81 -0.21 0.00 0.02 0.00 0.00 61.00 62.57 2c3y s PRO 307 Cb -0.12 -2.08 0.04 0.00 0.02 0.00 0.00 34.50 32.37 2c3y s PRO 307 CO -0.06 -0.98 0.71 0.12 -0.33 0.00 0.00 177.00 176.46 2c3y s PHE 308 N -1.59 2.99 -0.53 6.54 5.36 -1.20 -4.94 117.98 124.61 2c3y s PHE 308 Ca 0.73 -0.28 -0.20 0.00 -0.96 0.00 0.00 56.93 56.22 2c3y s PHE 308 Cb -0.29 -3.62 0.07 0.00 -0.34 0.00 0.00 43.02 38.83 2c3y s PHE 308 CO 0.33 -1.07 0.69 0.08 -1.46 0.00 0.00 175.22 173.79 2c3y s VAL 309 N 3.00 4.79 0.32 3.12 1.01 -1.26 -4.93 120.40 126.45 2c3y s VAL 309 Ca 0.21 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.71 2c3y s VAL 309 Cb -0.16 -4.38 0.29 0.00 0.00 0.00 0.00 36.38 32.13 2c3y s VAL 309 CO 0.16 -0.93 1.93 0.28 0.00 0.00 0.00 175.10 176.54 2c3y h SER 310 N 9.09 0.81 -0.25 3.32 0.02 -1.99 -1.82 113.55 122.72 2c3y h SER 310 Ca -0.28 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 60.72 2c3y h SER 310 Cb 1.09 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.43 2c3y h SER 310 CO 1.01 0.52 0.02 -0.08 -1.14 0.00 0.00 176.83 177.16 2c3y h GLU 311 N 0.92 0.11 -0.34 3.45 4.81 -1.99 -0.96 114.58 120.57 2c3y h GLU 311 Ca 0.37 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.50 2c3y h GLU 311 Cb 0.25 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2c3y h GLU 311 CO -0.13 0.07 -0.15 0.00 -0.73 0.00 0.00 179.01 178.07 2c3y h ALA 312 N 1.20 1.10 -0.02 2.92 0.00 -1.83 -1.74 119.26 120.90 2c3y h ALA 312 Ca 0.12 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2c3y h ALA 312 Cb 0.14 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2c3y h ALA 312 CO -0.18 0.56 0.01 0.35 0.00 0.00 0.00 179.25 179.98 2c3y h PHE 313 N 0.56 0.02 0.00 0.00 3.57 -0.63 -2.79 116.94 117.66 2c3y h PHE 313 Ca 0.09 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 2c3y h PHE 313 Cb 0.58 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 2c3y h PHE 313 CO 0.02 0.09 -0.24 0.74 -2.23 0.00 0.00 178.31 176.69 2c3y h PHE 314 N -0.05 0.00 0.00 0.41 -1.00 -1.07 -2.00 116.94 113.24 2c3y h PHE 314 Ca 0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.79 2c3y h PHE 314 Cb 0.07 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.63 2c3y h PHE 314 CO -0.05 0.24 0.00 0.00 -1.61 0.00 0.00 178.31 176.89 2c3y h ALA 315 N 1.76 1.00 -0.01 2.45 0.00 -1.04 -1.80 119.26 121.62 2c3y h ALA 315 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c3y h ALA 315 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2c3y h ALA 315 CO 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.22 2c3y n ALA 316 N -1.80 2.59 -2.65 0.00 0.00 -0.77 -4.97 120.51 112.90 2c3y n ALA 316 Ca 0.01 -0.56 -0.39 0.00 0.00 0.00 0.00 53.44 52.49 2c3y n ALA 316 Cb 0.16 -0.40 -0.07 0.00 0.00 0.00 0.00 19.45 19.14 2c3y n ALA 316 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2c3y s LEU 317 N -1.18 4.12 0.20 0.00 0.20 -0.68 -4.62 118.68 116.73 2c3y s LEU 317 Ca 0.13 0.60 -0.30 0.00 0.69 0.00 0.00 54.13 55.25 2c3y s LEU 317 Cb 0.10 -2.66 -0.09 0.00 -0.43 0.00 0.00 46.19 43.11 2c3y s LEU 317 CO 0.18 -0.20 1.33 -2.84 -0.29 0.00 0.00 176.35 174.53 2c3y s PRO 318 N 1.79 4.37 0.59 0.98 0.02 -1.26 -4.89 135.00 136.59 2c3y s PRO 318 Ca 0.22 2.08 0.33 0.00 0.02 0.00 0.00 61.00 63.65 2c3y s PRO 318 Cb -0.15 -3.19 1.84 0.00 0.02 0.00 0.00 34.50 33.02 2c3y s PRO 318 CO 0.09 -0.28 2.22 0.00 -0.33 0.00 0.00 177.00 178.70 2c3y h ALA 319 N 5.38 1.31 -0.00 -1.55 0.00 -1.91 -1.81 119.26 120.68 2c3y h ALA 319 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2c3y h ALA 319 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2c3y h ALA 319 CO 0.78 0.04 -0.04 -1.13 0.00 0.00 0.00 179.25 178.90 2c3y n SER 320 N -3.58 0.14 -4.65 0.00 3.41 -1.26 -4.86 113.62 102.82 2c3y n SER 320 Ca -0.02 -0.33 -0.42 0.00 -0.26 0.00 0.00 58.87 57.83 2c3y n SER 320 Cb 0.13 -0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 63.86 2c3y n SER 320 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c3y s ALA 321 N -2.50 3.45 -0.18 7.33 0.00 -0.68 -4.14 121.76 125.03 2c3y s ALA 321 Ca 0.30 0.99 0.08 0.00 0.00 0.00 0.00 51.96 53.32 2c3y s ALA 321 Cb 0.20 -3.84 -0.22 0.00 0.00 0.00 0.00 23.12 19.27 2c3y s ALA 321 CO 0.46 -1.71 0.10 1.63 0.00 0.00 0.00 175.76 176.24 2c3y n LYS 322 N 7.55 0.68 -4.35 0.00 5.02 0.26 -4.80 118.16 122.52 2c3y n LYS 322 Ca 0.20 0.14 -0.20 0.00 -2.02 0.00 0.00 58.31 56.42 2c3y n LYS 322 Cb 0.43 -1.59 -0.16 0.00 -0.02 0.00 0.00 35.03 33.69 2c3y n LYS 322 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2c3y s VAL 323 N -2.53 0.74 -0.06 -0.18 1.01 -0.07 -1.38 120.40 117.93 2c3y s VAL 323 Ca -0.20 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2c3y s VAL 323 Cb 0.07 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.79 2c3y s VAL 323 CO 0.74 0.24 -0.12 -0.51 0.00 0.00 0.00 175.10 175.45 2c3y s ILE 324 N 0.37 1.10 -0.16 2.22 1.10 0.23 -1.27 121.20 124.79 2c3y s ILE 324 Ca -0.06 -0.46 -0.00 0.00 -0.51 0.00 0.00 60.65 59.61 2c3y s ILE 324 Cb -0.10 -1.00 -0.01 0.00 0.15 0.00 0.00 42.46 41.50 2c3y s ILE 324 CO 0.01 0.35 -0.13 0.42 -2.11 0.00 0.00 174.94 173.47 2c3y s THR 325 N 0.62 2.89 -0.33 4.00 -4.23 -0.47 0.09 115.64 118.22 2c3y s THR 325 Ca -0.13 -0.69 -0.12 0.00 -1.18 0.00 0.00 61.69 59.56 2c3y s THR 325 Cb -0.15 -2.23 -0.01 0.00 1.34 0.00 0.00 72.50 71.44 2c3y s THR 325 CO 0.03 0.51 0.21 -0.69 -0.54 0.00 0.00 174.62 174.14 2c3y s VAL 326 N 0.76 5.06 -0.18 2.29 1.01 0.12 -1.31 120.40 128.15 2c3y s VAL 326 Ca -0.05 -0.28 -0.18 0.00 0.00 0.00 0.00 61.98 61.46 2c3y s VAL 326 Cb -0.15 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2c3y s VAL 326 CO 0.01 0.01 0.50 -0.76 0.00 0.00 0.00 175.10 174.86 2c3y s LEU 327 N 1.69 4.18 -0.10 3.92 1.02 -0.48 -1.97 118.68 126.93 2c3y s LEU 327 Ca 0.06 0.69 0.02 0.00 0.02 0.00 0.00 54.13 54.91 2c3y s LEU 327 Cb -0.17 -2.68 -0.01 0.00 0.02 0.00 0.00 46.19 43.34 2c3y s LEU 327 CO 0.09 -0.13 -0.16 -1.81 0.02 0.00 0.00 176.35 174.36 2c3y s ASP 328 N 1.03 3.76 -0.90 2.29 1.01 -0.46 -4.56 116.67 118.83 2c3y s ASP 328 Ca 0.24 -0.35 -0.02 0.00 0.71 0.00 0.00 52.55 53.12 2c3y s ASP 328 Cb -0.15 -1.31 0.31 0.00 1.01 0.00 0.00 42.92 42.77 2c3y s ASP 328 CO 0.10 0.22 2.04 -1.14 0.21 0.00 0.00 175.17 176.59 2c3y n ARG 329 N 3.18 3.74 -2.77 8.23 0.63 -1.26 -2.67 116.66 125.74 2c3y n ARG 329 Ca -0.18 -3.82 -0.06 0.00 -0.92 0.00 0.00 57.85 52.87 2c3y n ARG 329 Cb 0.53 -2.35 0.02 0.00 0.45 0.00 0.00 32.46 31.11 2c3y n ARG 329 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 2c3y n THR 330 N -0.16 0.00 -3.61 5.15 5.66 -1.26 -0.45 114.28 119.61 2c3y n THR 330 Ca 0.52 -0.63 -0.08 0.00 -3.05 0.00 0.00 64.05 60.80 2c3y n THR 330 Cb 0.27 0.63 -0.09 0.00 -1.55 0.00 0.00 70.33 69.58 2c3y n THR 330 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 2c3y s LYS 331 N -2.06 0.33 -0.53 1.09 2.20 -1.26 -4.83 119.74 114.68 2c3y s LYS 331 Ca 0.10 0.96 0.00 0.00 -0.36 0.00 0.00 55.97 56.68 2c3y s LYS 331 Cb -0.03 0.22 0.14 0.00 -1.51 0.00 0.00 37.83 36.65 2c3y s LYS 331 CO 0.08 -0.31 0.30 -1.21 -0.36 0.00 0.00 175.35 173.85 2c3y s GLU 332 N 2.60 2.15 0.10 4.03 2.02 -1.26 -5.07 118.70 123.27 2c3y s GLU 332 Ca 0.01 -2.40 -0.36 0.00 0.02 0.00 0.00 54.97 52.24 2c3y s GLU 332 Cb -0.13 -3.50 -0.17 0.00 0.10 0.00 0.00 34.13 30.43 2c3y s GLU 332 CO -0.13 -1.11 1.18 -2.30 0.02 0.00 0.00 175.26 172.92 2c3y n PRO 333 N 3.58 0.82 0.00 0.39 -0.02 -1.26 -1.28 135.00 137.23 2c3y n PRO 333 Ca 0.05 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2c3y n PRO 333 Cb 0.37 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 2c3y n PRO 333 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c3y n GLY 334 N 2.11 2.94 3.76 -1.23 0.00 -1.26 -5.01 105.19 106.50 2c3y n GLY 334 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2c3y n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y s ALA 335 N -2.24 2.50 -1.10 4.61 0.00 -0.40 -4.88 121.76 120.25 2c3y s ALA 335 Ca 0.00 0.75 0.21 0.00 0.00 0.00 0.00 51.96 52.92 2c3y s ALA 335 Cb 0.00 -3.37 0.94 0.00 0.00 0.00 0.00 23.12 20.68 2c3y s ALA 335 CO 0.00 -1.20 1.68 -0.35 0.00 0.00 0.00 175.76 175.89 2c3y n PRO 336 N -2.00 0.07 0.00 0.00 -0.04 -1.26 -4.86 135.00 126.90 2c3y n PRO 336 Ca 0.12 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2c3y n PRO 336 Cb 0.51 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2c3y n PRO 336 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2c3y n GLY 337 N 0.63 0.81 3.89 0.55 0.00 -1.26 -5.08 105.19 104.73 2c3y n GLY 337 Ca 0.06 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 45.02 2c3y n GLY 337 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c3y s ASP 338 N 0.00 5.93 0.17 1.61 1.01 -1.26 -4.83 116.67 119.31 2c3y s ASP 338 Ca 0.00 1.09 -0.22 0.00 0.71 0.00 0.00 52.55 54.13 2c3y s ASP 338 Cb 0.00 -2.14 0.07 0.00 1.01 0.00 0.00 42.92 41.86 2c3y s ASP 338 CO 0.00 -0.94 1.36 -2.65 0.21 0.00 0.00 175.17 173.14 2c3y n PRO 339 N -2.65 -0.30 -0.19 8.23 -0.02 -1.26 -1.76 135.00 137.05 2c3y n PRO 339 Ca 0.05 1.34 -0.09 0.00 -2.02 0.00 0.00 63.50 62.78 2c3y n PRO 339 Cb 0.56 -1.98 0.01 0.00 -0.02 0.00 0.00 33.50 32.07 2c3y n PRO 339 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2c3y h LEU 340 N 0.00 0.84 -0.32 2.45 5.85 -1.94 -1.84 115.31 120.35 2c3y h LEU 340 Ca 0.22 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.71 2c3y h LEU 340 Cb 0.44 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 2c3y h LEU 340 CO -0.85 0.88 0.16 0.22 -0.34 0.00 0.00 178.44 178.51 2c3y h TYR 341 N 0.77 0.29 -0.69 1.25 3.20 -1.76 -0.13 116.97 119.89 2c3y h TYR 341 Ca 0.16 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.02 2c3y h TYR 341 Cb 0.40 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.55 2c3y h TYR 341 CO 0.03 0.15 0.31 -0.07 -1.64 0.00 0.00 178.16 176.95 2c3y h LEU 342 N 0.33 0.90 -0.25 2.82 4.07 -1.21 0.11 115.31 122.07 2c3y h LEU 342 Ca 0.13 -0.11 -0.05 0.00 0.08 0.00 0.00 57.88 57.94 2c3y h LEU 342 Cb 0.05 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.55 2c3y h LEU 342 CO -0.10 0.78 -0.04 0.44 -1.08 0.00 0.00 178.44 178.44 2c3y h ASP 343 N 0.98 0.47 -0.70 -0.43 3.32 -0.77 -1.72 116.42 117.57 2c3y h ASP 343 Ca 0.24 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 2c3y h ASP 343 Cb 0.13 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2c3y h ASP 343 CO -0.03 0.71 0.32 0.58 -1.72 0.00 0.00 179.24 179.10 2c3y h VAL 344 N 0.23 1.24 -0.69 -1.35 2.07 -0.75 -1.82 116.25 115.18 2c3y h VAL 344 Ca 0.07 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2c3y h VAL 344 Cb 0.49 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2c3y h VAL 344 CO 0.02 0.28 0.45 0.00 0.02 0.00 0.00 177.57 178.34 2c3y h SER 346 N 0.94 0.78 -0.27 0.00 4.64 -0.88 -1.67 113.55 117.09 2c3y h SER 346 Ca 0.25 -0.10 0.02 0.00 -0.47 0.00 0.00 61.79 61.48 2c3y h SER 346 Cb -0.09 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 61.77 2c3y h SER 346 CO -0.05 0.71 0.13 0.00 -0.87 0.00 0.00 176.83 176.75 2c3y h ALA 347 N 1.41 0.32 -0.50 5.18 0.00 -0.67 -1.41 119.26 123.59 2c3y h ALA 347 Ca 0.20 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 2c3y h ALA 347 Cb 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2c3y h ALA 347 CO -0.02 -0.26 -0.06 0.74 0.00 0.00 0.00 179.25 179.65 2c3y h PHE 348 N 0.28 1.02 -0.71 0.00 -1.00 -1.08 -1.92 116.94 113.54 2c3y h PHE 348 Ca 0.11 -0.20 -0.05 0.00 2.81 0.00 0.00 57.97 60.64 2c3y h PHE 348 Cb 0.03 -0.26 -0.03 0.00 3.61 0.00 0.00 35.95 39.30 2c3y h PHE 348 CO -0.09 0.97 0.26 -0.39 -1.61 0.00 0.00 178.31 177.45 2c3y h VAL 349 N 0.78 1.25 -0.14 -0.55 -1.51 -1.14 -2.80 116.25 112.14 2c3y h VAL 349 Ca 0.13 -0.81 -0.11 0.00 -1.23 0.00 0.00 66.70 64.68 2c3y h VAL 349 Cb 0.60 0.45 -0.01 0.00 -2.13 0.00 0.00 31.29 30.20 2c3y h VAL 349 CO 0.04 0.32 -0.41 -0.33 -1.23 0.00 0.00 177.57 175.96 2c3y h GLU 350 N 1.02 0.32 -0.63 5.19 5.08 -1.18 -2.59 114.58 121.80 2c3y h GLU 350 Ca 0.23 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2c3y h GLU 350 Cb 0.24 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 2c3y h GLU 350 CO -0.02 0.68 0.40 -0.09 -1.00 0.00 0.00 179.01 178.99 2c3y h ARG 351 N 0.27 0.83 -2.58 2.33 2.43 -1.09 -3.46 114.38 113.11 2c3y h ARG 351 Ca 0.02 -0.06 -0.33 0.00 -0.81 0.00 0.00 59.98 58.81 2c3y h ARG 351 Cb 0.84 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 2c3y h ARG 351 CO 0.07 0.56 -0.43 0.41 -1.51 0.00 0.00 179.97 179.07 2c3y n GLY 352 N -1.40 -0.31 0.00 2.80 0.00 -0.98 -4.97 105.19 100.33 2c3y n GLY 352 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2c3y n GLY 352 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3y n GLU 353 N -2.72 0.59 -1.83 1.61 1.02 -1.26 -5.08 120.64 112.98 2c3y n GLU 353 Ca -0.18 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.54 2c3y n GLU 353 Cb 0.64 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.03 2c3y n GLU 353 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2c3y s ALA 354 N -2.00 3.82 -0.74 0.62 0.00 -1.26 -4.97 121.76 117.23 2c3y s ALA 354 Ca 0.00 1.50 -0.04 0.00 0.00 0.00 0.00 51.96 53.42 2c3y s ALA 354 Cb 0.00 -3.65 0.19 0.00 0.00 0.00 0.00 23.12 19.66 2c3y s ALA 354 CO 0.00 -0.88 0.60 -1.64 0.00 0.00 0.00 175.76 173.84 2c3y s MET 355 N 0.66 2.94 0.87 0.00 -1.94 -1.26 -5.04 119.30 115.53 2c3y s MET 355 Ca 0.69 -2.78 -0.11 0.00 -1.71 0.00 0.00 55.69 51.78 2c3y s MET 355 Cb -0.47 -3.90 0.11 0.00 2.01 0.00 0.00 34.83 32.59 2c3y s MET 355 CO 0.36 -1.22 1.09 -1.25 -0.01 0.00 0.00 175.02 174.00 2c3y s PRO 356 N -0.48 1.48 0.06 2.03 0.04 -1.26 -4.91 135.00 131.96 2c3y s PRO 356 Ca 0.21 0.98 -0.31 0.00 0.04 0.00 0.00 61.00 61.92 2c3y s PRO 356 Cb -0.15 -1.82 -0.07 0.00 0.04 0.00 0.00 34.50 32.50 2c3y s PRO 356 CO -0.07 -2.13 1.53 0.21 0.04 0.00 0.00 177.00 176.58 2c3y s LYS 357 N -4.89 4.24 -0.17 4.56 2.47 -0.48 -4.88 119.74 120.60 2c3y s LYS 357 Ca 0.63 2.18 -0.03 0.00 -1.56 0.00 0.00 55.97 57.19 2c3y s LYS 357 Cb -0.18 -3.52 -0.02 0.00 -1.46 0.00 0.00 37.83 32.65 2c3y s LYS 357 CO 0.57 -0.64 -0.07 0.42 0.16 0.00 0.00 175.35 175.80 2c3y s ILE 358 N 2.27 3.49 0.09 5.43 1.01 -1.26 -0.60 121.20 131.63 2c3y s ILE 358 Ca 0.69 -0.49 0.09 0.00 0.00 0.00 0.00 60.65 60.94 2c3y s ILE 358 Cb -0.37 -2.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.53 2c3y s ILE 358 CO 0.30 0.48 -0.20 -0.76 0.00 0.00 0.00 174.94 174.76 2c3y s LEU 359 N 0.70 2.58 -0.11 2.97 1.02 0.11 -4.98 118.68 120.98 2c3y s LEU 359 Ca -0.03 -0.54 0.01 0.00 0.02 0.00 0.00 54.13 53.59 2c3y s LEU 359 Cb -0.15 -1.48 -0.01 0.00 0.02 0.00 0.00 46.19 44.57 2c3y s LEU 359 CO 0.02 0.21 -0.15 0.00 0.02 0.00 0.00 176.35 176.45 2c3y s ALA 360 N -1.04 2.56 0.02 4.21 0.00 -1.26 0.12 121.76 126.38 2c3y s ALA 360 Ca 0.16 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.22 2c3y s ALA 360 Cb -0.10 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 2c3y s ALA 360 CO 0.07 0.31 -0.06 0.20 0.00 0.00 0.00 175.76 176.29 2c3y s GLY 361 N 0.16 0.34 -0.08 0.00 0.00 -0.83 -0.77 107.32 106.14 2c3y s GLY 361 Ca -0.08 -0.50 0.02 0.00 0.00 0.00 0.00 44.72 44.16 2c3y s GLY 361 CO 0.05 -0.53 -0.14 -1.60 0.00 0.00 0.00 173.10 170.89 2c3y s ARG 362 N -0.97 2.80 0.31 2.90 3.52 0.90 -1.36 118.95 127.05 2c3y s ARG 362 Ca -0.06 -0.69 -0.07 0.00 -0.13 0.00 0.00 55.73 54.79 2c3y s ARG 362 Cb -0.07 -2.47 0.00 0.00 -1.56 0.00 0.00 34.95 30.86 2c3y s ARG 362 CO -0.00 0.49 0.49 1.52 -0.81 0.00 0.00 175.30 177.00 2c3y s TYR 363 N -0.39 0.78 -0.85 5.12 1.13 -1.09 -1.73 117.35 120.32 2c3y s TYR 363 Ca 0.04 -1.09 0.00 0.00 -1.41 0.00 0.00 57.07 54.61 2c3y s TYR 363 Cb -0.12 0.06 0.00 0.00 -1.10 0.00 0.00 41.96 40.80 2c3y s TYR 363 CO 0.02 -1.12 0.00 0.41 -2.51 0.00 0.00 175.55 172.35 2c3y n GLY 364 N -0.50 0.76 3.71 5.49 0.00 -1.26 -4.37 105.19 109.03 2c3y n GLY 364 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2c3y n GLY 364 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c3y n LEU 365 N -1.40 3.85 -3.68 0.99 4.32 -1.26 -2.47 117.00 117.35 2c3y n LEU 365 Ca -0.08 1.11 -0.21 0.00 -0.02 0.00 0.00 56.01 56.80 2c3y n LEU 365 Cb 0.29 -1.54 0.04 0.00 -1.62 0.00 0.00 43.42 40.60 2c3y n LEU 365 CO 0.12 -0.01 -0.03 0.61 -1.22 0.00 0.00 177.39 176.86 2c3y n GLY 366 N 2.92 -0.32 2.56 -0.72 0.00 -1.19 -1.85 105.19 106.59 2c3y n GLY 366 Ca 0.13 0.13 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 2c3y n GLY 366 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2c3y n SER 367 N -3.05 -5.59 -4.71 1.61 7.64 0.43 -4.59 113.62 105.36 2c3y n SER 367 Ca -0.27 0.40 -0.43 0.00 1.01 0.00 0.00 58.87 59.58 2c3y n SER 367 Cb 0.66 -4.85 -0.02 0.00 -1.01 0.00 0.00 64.21 58.99 2c3y n SER 367 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2c3y n LYS 368 N -2.53 2.43 -1.68 1.43 3.00 -0.77 -4.87 118.16 115.18 2c3y n LYS 368 Ca -0.22 0.86 -0.43 0.00 -0.00 0.00 0.00 58.31 58.53 2c3y n LYS 368 Cb 0.68 -2.60 -0.01 0.00 0.00 0.00 0.00 35.03 33.11 2c3y n LYS 368 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2c3y n GLU 369 N 2.13 1.95 -3.68 1.64 -0.58 -1.26 -4.17 120.64 116.67 2c3y n GLU 369 Ca 0.10 0.69 -0.29 0.00 -0.42 0.00 0.00 57.16 57.24 2c3y n GLU 369 Cb 0.34 -2.24 -0.12 0.00 -0.57 0.00 0.00 31.44 28.85 2c3y n GLU 369 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 2c3y s PHE 370 N -1.11 2.11 0.70 -0.32 2.19 -1.26 -4.65 117.98 115.64 2c3y s PHE 370 Ca 0.57 -2.59 -0.04 0.00 0.33 0.00 0.00 56.93 55.20 2c3y s PHE 370 Cb -0.58 -1.84 0.09 0.00 -1.31 0.00 0.00 43.02 39.38 2c3y s PHE 370 CO 0.61 -0.74 0.98 -1.54 1.83 0.00 0.00 175.22 176.36 2c3y s SER 371 N -0.09 4.60 0.24 6.13 1.04 -1.26 -4.78 113.70 119.59 2c3y s SER 371 Ca 0.22 0.06 -0.06 0.00 0.48 0.00 0.00 55.95 56.66 2c3y s SER 371 Cb -0.14 -0.62 0.29 0.00 0.10 0.00 0.00 66.02 65.65 2c3y s SER 371 CO -0.08 -1.69 1.89 -0.65 0.98 0.00 0.00 173.24 173.69 2c3y h PRO 372 N -0.52 1.11 -0.61 4.02 0.11 -1.97 -1.49 132.00 132.64 2c3y h PRO 372 Ca -0.41 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 65.67 2c3y h PRO 372 Cb 1.29 -0.25 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 2c3y h PRO 372 CO 0.50 0.73 0.41 0.00 -0.21 0.00 0.00 178.00 179.43 2c3y h ALA 373 N 1.38 1.70 -0.24 -0.75 0.00 -1.92 -0.08 119.26 119.34 2c3y h ALA 373 Ca 0.36 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 55.06 2c3y h ALA 373 Cb 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2c3y h ALA 373 CO -0.12 0.22 -0.58 0.52 0.00 0.00 0.00 179.25 179.29 2c3y h MET 374 N 0.69 0.77 -0.75 0.00 2.86 -1.66 -1.72 114.93 115.12 2c3y h MET 374 Ca 0.25 -0.50 -0.02 0.00 -2.06 0.00 0.00 59.70 57.36 2c3y h MET 374 Cb 0.13 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 2c3y h MET 374 CO -0.07 1.13 0.38 0.28 1.06 0.00 0.00 176.91 179.69 2c3y h VAL 375 N 0.58 1.23 -0.41 -2.22 2.07 -0.57 -1.25 116.25 115.69 2c3y h VAL 375 Ca 0.01 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 66.91 2c3y h VAL 375 Cb 1.17 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 2c3y h VAL 375 CO 0.12 0.27 0.25 0.50 0.02 0.00 0.00 177.57 178.73 2c3y h LYS 376 N 1.04 0.49 -0.34 1.57 1.63 -0.91 -1.50 116.57 118.55 2c3y h LYS 376 Ca 0.26 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 60.03 2c3y h LYS 376 Cb 0.08 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.58 2c3y h LYS 376 CO -0.04 0.32 0.20 1.03 -3.45 0.00 0.00 179.45 177.52 2c3y h SER 377 N 0.51 0.40 -0.28 4.20 0.87 -0.70 0.88 113.55 119.43 2c3y h SER 377 Ca 0.16 -0.02 -0.17 0.00 -1.23 0.00 0.00 61.79 60.53 2c3y h SER 377 Cb -0.01 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 61.85 2c3y h SER 377 CO -0.07 0.32 -0.49 0.58 -0.53 0.00 0.00 176.83 176.64 2c3y h VAL 378 N 0.47 1.28 -0.16 2.23 2.07 -0.30 -1.76 116.25 120.09 2c3y h VAL 378 Ca 0.12 -1.67 -0.16 0.00 0.82 0.00 0.00 66.70 65.81 2c3y h VAL 378 Cb -0.01 1.55 0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2c3y h VAL 378 CO -0.02 0.55 -0.52 1.88 0.02 0.00 0.00 177.57 179.47 2c3y h TYR 379 N 0.67 0.83 -0.00 1.57 -1.99 -0.71 -3.04 116.97 114.30 2c3y h TYR 379 Ca 0.03 -0.34 -0.03 0.00 2.00 0.00 0.00 58.73 60.39 2c3y h TYR 379 Cb 1.08 -0.14 -0.00 0.00 2.00 0.00 0.00 36.73 39.67 2c3y h TYR 379 CO 0.07 1.12 -0.14 -0.44 -0.00 0.00 0.00 178.16 178.77 2c3y h ASP 380 N 0.29 0.00 -0.57 3.88 3.32 -0.85 -1.54 116.42 120.95 2c3y h ASP 380 Ca -0.02 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 2c3y h ASP 380 Cb 1.15 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 2c3y h ASP 380 CO 0.11 0.14 0.02 -1.13 -1.72 0.00 0.00 179.24 176.66 2c3y h ASN 381 N 0.00 0.99 0.70 6.45 -1.24 -1.26 0.52 115.58 121.74 2c3y h ASN 381 Ca -0.00 -0.27 -0.01 0.00 0.71 0.00 0.00 56.30 56.73 2c3y h ASN 381 Cb 0.24 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 39.03 2c3y h ASN 381 CO 0.02 1.03 -0.05 0.24 -1.29 0.00 0.00 177.43 177.38 2c3y h MET 382 N 0.94 0.00 0.00 6.67 2.86 -1.18 0.15 114.93 124.37 2c3y h MET 382 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2c3y h MET 382 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 2c3y h MET 382 CO 0.02 0.05 -1.24 -1.13 1.06 0.00 0.00 176.91 175.67 2c3y n SER 383 N -3.22 0.71 0.00 1.22 3.41 -0.85 -4.83 113.62 110.07 2c3y n SER 383 Ca -0.01 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 2c3y n SER 383 Cb 0.26 1.22 0.00 0.00 -0.26 0.00 0.00 64.21 65.44 2c3y n SER 383 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c3y n GLY 384 N 1.43 1.37 0.33 5.00 0.00 0.12 -4.95 105.19 108.48 2c3y n GLY 384 Ca 0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.20 2c3y n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y h ALA 385 N 0.65 2.08 -6.12 4.61 0.00 -1.80 -3.46 119.26 115.21 2c3y h ALA 385 Ca 0.00 -0.01 -0.43 0.00 0.00 0.00 0.00 54.91 54.47 2c3y h ALA 385 Cb 0.00 0.02 0.04 0.00 0.00 0.00 0.00 17.79 17.84 2c3y h ALA 385 CO 0.00 -0.33 -0.80 1.63 0.00 0.00 0.00 179.25 179.75 2c3y n LYS 386 N -4.19 -5.34 -2.05 0.00 5.02 0.47 -4.91 118.16 107.17 2c3y n LYS 386 Ca 0.03 0.63 -0.41 0.00 -2.02 0.00 0.00 58.31 56.55 2c3y n LYS 386 Cb 0.35 -5.34 -0.02 0.00 -0.02 0.00 0.00 35.03 30.01 2c3y n LYS 386 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2c3y s LYS 387 N -6.17 4.27 0.27 1.97 2.20 -1.26 -5.02 119.74 115.99 2c3y s LYS 387 Ca 0.24 2.28 0.09 0.00 -0.36 0.00 0.00 55.97 58.22 2c3y s LYS 387 Cb -0.12 -3.02 -0.04 0.00 -1.51 0.00 0.00 37.83 33.15 2c3y s LYS 387 CO 0.81 -0.29 0.04 1.21 -0.36 0.00 0.00 175.35 176.76 2c3y s ASN 388 N -0.45 4.70 -1.42 1.43 2.47 -1.26 -4.64 114.94 115.77 2c3y s ASN 388 Ca 0.50 -0.59 -0.03 0.00 0.42 0.00 0.00 52.86 53.16 2c3y s ASN 388 Cb -0.41 -0.93 0.02 0.00 -1.45 0.00 0.00 41.25 38.49 2c3y s ASN 388 CO 0.54 -0.02 0.57 1.41 -3.72 0.00 0.00 177.10 175.88 2c3y n HIS 389 N -0.95 -1.78 -2.66 0.43 8.25 0.05 -4.93 115.22 113.62 2c3y n HIS 389 Ca -0.06 0.79 -0.21 0.00 -0.26 0.00 0.00 57.72 57.98 2c3y n HIS 389 Cb 0.59 -3.84 0.03 0.00 1.12 0.00 0.00 29.99 27.90 2c3y n HIS 389 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2c3y s PHE 390 N -3.77 2.86 0.11 4.41 -0.12 -0.62 -4.92 117.98 115.94 2c3y s PHE 390 Ca 0.14 -0.04 0.08 0.00 -0.05 0.00 0.00 56.93 57.06 2c3y s PHE 390 Cb -0.07 -2.73 -0.04 0.00 -0.63 0.00 0.00 43.02 39.55 2c3y s PHE 390 CO 0.87 -0.84 -0.19 0.95 -0.05 0.00 0.00 175.22 175.95 2c3y s THR 391 N -2.73 1.64 -0.04 -4.49 -4.23 0.02 -0.07 115.64 105.74 2c3y s THR 391 Ca 0.57 -1.59 -0.02 0.00 -1.18 0.00 0.00 61.69 59.48 2c3y s THR 391 Cb -0.10 -1.55 0.03 0.00 1.34 0.00 0.00 72.50 72.22 2c3y s THR 391 CO 0.38 -0.14 0.09 -0.69 -0.54 0.00 0.00 174.62 173.72 2c3y s VAL 392 N -1.37 -0.04 0.00 2.29 1.01 -0.71 -1.13 120.40 120.46 2c3y s VAL 392 Ca 0.07 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2c3y s VAL 392 Cb -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.14 2c3y s VAL 392 CO 0.04 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.81 2c3y n GLY 393 N 3.88 1.34 3.24 4.51 0.00 -1.26 -4.50 105.19 112.39 2c3y n GLY 393 Ca -0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.66 2c3y n GLY 393 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2c3y s ILE 394 N -2.00 0.42 -0.39 -0.61 -4.36 -1.26 -4.95 121.20 108.04 2c3y s ILE 394 Ca 0.00 -1.97 -0.07 0.00 -0.26 0.00 0.00 60.65 58.35 2c3y s ILE 394 Cb 0.00 -2.30 0.07 0.00 1.25 0.00 0.00 42.46 41.48 2c3y s ILE 394 CO 0.00 -0.27 0.21 -0.70 0.24 0.00 0.00 174.94 174.41 2c3y s GLU 395 N -4.01 2.50 -0.98 0.37 2.12 -1.26 -4.67 118.70 112.77 2c3y s GLU 395 Ca 0.30 -1.46 -0.16 0.00 0.36 0.00 0.00 54.97 54.01 2c3y s GLU 395 Cb 0.07 -3.65 0.17 0.00 0.26 0.00 0.00 34.13 30.97 2c3y s GLU 395 CO 0.07 -0.90 1.11 0.34 -0.54 0.00 0.00 175.26 175.35 2c3y s ASP 396 N 1.89 6.79 -0.04 -1.70 3.68 -1.26 -2.14 116.67 123.88 2c3y s ASP 396 Ca 0.02 -2.46 0.10 0.00 2.13 0.00 0.00 52.55 52.35 2c3y s ASP 396 Cb -0.22 -2.35 0.36 0.00 -1.45 0.00 0.00 42.92 39.25 2c3y s ASP 396 CO 0.01 -0.86 1.22 -0.90 0.13 0.00 0.00 175.17 174.77 2c3y n ASP 397 N 5.62 2.47 -0.07 -0.34 5.75 -1.26 -1.73 116.55 126.98 2c3y n ASP 397 Ca 0.24 -2.16 -0.12 0.00 -0.01 0.00 0.00 54.79 52.74 2c3y n ASP 397 Cb 0.47 -0.37 -0.05 0.00 -1.03 0.00 0.00 41.12 40.13 2c3y n ASP 397 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 2c3y n VAL 398 N 0.49 0.76 -0.11 2.12 0.24 -1.26 -4.72 118.33 115.84 2c3y n VAL 398 Ca 0.13 -0.24 0.02 0.00 -2.04 0.00 0.00 64.34 62.21 2c3y n VAL 398 Cb 0.46 -1.35 0.06 0.00 -1.47 0.00 0.00 33.84 31.53 2c3y n VAL 398 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2c3y n THR 399 N -3.28 1.06 -4.31 3.34 -2.24 -1.26 -5.02 114.28 102.56 2c3y n THR 399 Ca -0.26 -1.06 -0.35 0.00 -2.27 0.00 0.00 64.05 60.11 2c3y n THR 399 Cb 0.72 0.46 -0.06 0.00 -2.10 0.00 0.00 70.33 69.35 2c3y n THR 399 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3y n GLY 400 N -0.21 -0.30 0.06 3.38 0.00 -0.71 -4.87 105.19 102.54 2c3y n GLY 400 Ca 0.05 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2c3y n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c3y n THR 401 N -4.34 0.00 -3.00 2.61 -2.24 -1.25 -4.98 114.28 101.08 2c3y n THR 401 Ca -0.09 -0.03 -0.33 0.00 -2.27 0.00 0.00 64.05 61.34 2c3y n THR 401 Cb 0.57 0.69 -0.06 0.00 -2.10 0.00 0.00 70.33 69.42 2c3y n THR 401 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2c3y s SER 402 N -2.92 6.83 0.14 3.42 1.04 -1.26 -0.80 113.70 120.16 2c3y s SER 402 Ca 0.11 1.44 -0.12 0.00 0.48 0.00 0.00 55.95 57.87 2c3y s SER 402 Cb 0.17 -2.44 -0.07 0.00 0.10 0.00 0.00 66.02 63.78 2c3y s SER 402 CO 0.75 -0.28 0.50 -0.76 0.98 0.00 0.00 173.24 174.44 2c3y s LEU 403 N -3.09 4.31 0.38 2.42 1.02 -0.28 -4.86 118.68 118.58 2c3y s LEU 403 Ca 0.57 0.96 -0.25 0.00 0.02 0.00 0.00 54.13 55.43 2c3y s LEU 403 Cb -0.10 -3.25 -0.09 0.00 0.02 0.00 0.00 46.19 42.77 2c3y s LEU 403 CO 0.16 0.09 1.09 -2.16 0.02 0.00 0.00 176.35 175.55 2c3y s PRO 404 N -2.10 4.21 -0.12 1.29 0.04 -1.26 -4.77 135.00 132.29 2c3y s PRO 404 Ca 0.38 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.07 2c3y s PRO 404 Cb -0.14 -2.69 0.02 0.00 0.04 0.00 0.00 34.50 31.74 2c3y s PRO 404 CO 0.19 -0.13 -0.11 0.08 0.04 0.00 0.00 177.00 177.07 2c3y s VAL 405 N -1.51 1.30 -0.56 -0.36 1.01 -1.26 -4.78 120.40 114.24 2c3y s VAL 405 Ca 0.55 -0.48 -0.20 0.00 0.00 0.00 0.00 61.98 61.86 2c3y s VAL 405 Cb -0.26 -1.25 0.08 0.00 0.00 0.00 0.00 36.38 34.95 2c3y s VAL 405 CO 0.33 0.41 0.71 -0.62 0.00 0.00 0.00 175.10 175.93 2c3y s ASP 406 N 1.45 6.20 0.00 3.32 3.68 -1.26 -4.91 116.67 125.15 2c3y s ASP 406 Ca 0.02 -1.15 0.02 0.00 2.13 0.00 0.00 52.55 53.57 2c3y s ASP 406 Cb -0.13 -2.31 0.10 0.00 -1.45 0.00 0.00 42.92 39.13 2c3y s ASP 406 CO -0.07 -1.07 0.80 0.59 0.13 0.00 0.00 175.17 175.55 2c3y n ASN 407 N 6.45 0.00 -0.14 -0.34 3.02 -1.26 -2.48 115.26 120.51 2c3y n ASN 407 Ca -0.07 -1.39 0.13 0.00 -0.03 0.00 0.00 54.58 53.22 2c3y n ASN 407 Cb 0.44 0.00 0.49 0.00 -0.61 0.00 0.00 39.78 40.10 2c3y n ASN 407 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c3y n ALA 408 N -0.54 2.94 -1.59 5.41 0.00 -1.26 -4.90 120.51 120.56 2c3y n ALA 408 Ca 0.01 -0.31 -0.47 0.00 0.00 0.00 0.00 53.44 52.67 2c3y n ALA 408 Cb 0.01 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.17 2c3y n ALA 408 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2c3y n PHE 409 N -0.96 1.39 -0.94 0.00 -0.00 -1.04 -4.91 117.46 111.00 2c3y n PHE 409 Ca 0.12 0.66 -0.31 0.00 -0.00 0.00 0.00 57.45 57.92 2c3y n PHE 409 Cb 0.31 -2.29 0.13 0.00 -0.00 0.00 0.00 39.48 37.63 2c3y n PHE 409 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2c3y s ALA 410 N -0.40 1.81 0.32 3.13 0.00 -1.26 -4.95 121.76 120.41 2c3y s ALA 410 Ca 0.69 0.46 -0.29 0.00 0.00 0.00 0.00 51.96 52.82 2c3y s ALA 410 Cb -0.79 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 18.85 2c3y s ALA 410 CO 0.54 -2.34 1.33 0.34 0.00 0.00 0.00 175.76 175.63 2c3y s ASP 411 N -2.97 6.74 0.00 0.00 -1.08 -1.26 -4.93 116.67 113.17 2c3y s ASP 411 Ca 0.64 2.70 0.08 0.00 -0.52 0.00 0.00 52.55 55.46 2c3y s ASP 411 Cb -0.20 -2.65 0.14 0.00 -1.46 0.00 0.00 42.92 38.75 2c3y s ASP 411 CO 0.57 -0.57 0.96 0.35 0.52 0.00 0.00 175.17 177.00 2c3y n THR 412 N 0.95 0.46 -1.88 1.71 -2.24 -1.26 -5.03 114.28 107.00 2c3y n THR 412 Ca 0.01 -0.73 -0.36 0.00 -2.27 0.00 0.00 64.05 60.70 2c3y n THR 412 Cb 0.42 0.86 0.05 0.00 -2.10 0.00 0.00 70.33 69.55 2c3y n THR 412 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2c3y s THR 413 N -0.84 2.53 0.55 4.28 -4.23 -1.26 -4.81 115.64 111.87 2c3y s THR 413 Ca 0.13 0.32 -0.21 0.00 -1.18 0.00 0.00 61.69 60.75 2c3y s THR 413 Cb 0.08 -3.07 -0.06 0.00 1.34 0.00 0.00 72.50 70.79 2c3y s THR 413 CO 0.11 -0.09 1.13 -2.65 -0.54 0.00 0.00 174.62 172.58 2c3y n PRO 414 N -1.83 1.28 -1.66 3.99 -0.02 -1.26 -4.88 135.00 130.62 2c3y n PRO 414 Ca 0.14 0.48 -0.44 0.00 -2.02 0.00 0.00 63.50 61.65 2c3y n PRO 414 Cb 0.50 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2c3y n PRO 414 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2c3y n LYS 415 N -0.83 1.84 0.00 -0.52 4.76 -1.26 -1.88 118.16 120.27 2c3y n LYS 415 Ca 0.12 0.65 0.00 0.00 -2.87 0.00 0.00 58.31 56.21 2c3y n LYS 415 Cb 0.45 -2.18 0.00 0.00 -1.84 0.00 0.00 35.03 31.45 2c3y n LYS 415 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2c3y n GLY 416 N 1.29 3.28 3.71 0.72 0.00 -1.26 -4.78 105.19 108.14 2c3y n GLY 416 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2c3y n GLY 416 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2c3y n THR 417 N -1.77 0.07 -3.92 2.61 -1.04 -0.79 -4.78 114.28 104.67 2c3y n THR 417 Ca 0.00 -0.01 -0.35 0.00 -2.04 0.00 0.00 64.05 61.65 2c3y n THR 417 Cb 0.00 -1.96 -0.10 0.00 -1.82 0.00 0.00 70.33 66.45 2c3y n THR 417 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2c3y s ILE 418 N 1.44 4.84 -0.10 12.58 -1.09 0.92 -4.95 121.20 134.84 2c3y s ILE 418 Ca 0.77 -0.01 0.02 0.00 -2.23 0.00 0.00 60.65 59.20 2c3y s ILE 418 Cb -0.52 -3.20 -0.01 0.00 -1.58 0.00 0.00 42.46 37.14 2c3y s ILE 418 CO 0.34 0.43 -0.17 -1.10 -1.23 0.00 0.00 174.94 173.20 2c3y s GLN 419 N 0.63 3.03 0.06 2.79 -0.21 -1.26 -1.58 119.66 123.11 2c3y s GLN 419 Ca 0.04 -0.76 0.06 0.00 0.02 0.00 0.00 55.36 54.73 2c3y s GLN 419 Cb -0.13 -2.45 -0.03 0.00 1.00 0.00 0.00 33.01 31.41 2c3y s GLN 419 CO 0.01 0.31 -0.18 0.00 -2.12 0.00 0.00 175.29 173.32 2c3y s GLN 421 N -1.44 1.43 -0.09 0.00 -0.21 0.21 -1.05 119.66 118.52 2c3y s GLN 421 Ca 0.04 -0.49 0.01 0.00 0.02 0.00 0.00 55.36 54.94 2c3y s GLN 421 Cb -0.09 -1.28 0.02 0.00 1.00 0.00 0.00 33.01 32.66 2c3y s GLN 421 CO 0.02 0.20 -0.11 -0.06 -2.12 0.00 0.00 175.29 173.23 2c3y s PHE 422 N 0.07 1.56 -0.39 0.91 0.40 -0.31 -0.44 117.98 119.79 2c3y s PHE 422 Ca -0.03 -0.70 -0.14 0.00 -0.60 0.00 0.00 56.93 55.46 2c3y s PHE 422 Cb -0.10 -1.20 0.01 0.00 0.51 0.00 0.00 43.02 42.24 2c3y s PHE 422 CO 0.01 -0.42 0.27 -1.58 0.70 0.00 0.00 175.22 174.20 2c3y s TRP 423 N 1.18 3.24 0.43 0.36 0.52 0.90 -0.29 118.94 125.28 2c3y s TRP 423 Ca -0.04 -0.55 0.06 0.00 0.02 0.00 0.00 56.10 55.58 2c3y s TRP 423 Cb -0.14 -2.54 -0.07 0.00 -1.15 0.00 0.00 33.47 29.57 2c3y s TRP 423 CO -0.03 -0.54 0.02 0.20 0.02 0.00 0.00 176.95 176.62 2c3y s GLY 424 N 1.67 2.58 -0.12 0.98 0.00 0.19 -0.05 107.32 112.57 2c3y s GLY 424 Ca 0.05 -2.01 -0.02 0.00 0.00 0.00 0.00 44.72 42.74 2c3y s GLY 424 CO 0.10 -2.11 -0.06 -2.27 0.00 0.00 0.00 173.10 168.76 2c3y s LEU 425 N -3.75 3.15 0.18 0.66 2.96 -1.26 -0.81 118.68 119.82 2c3y s LEU 425 Ca 0.31 -0.12 -0.32 0.00 -0.22 0.00 0.00 54.13 53.78 2c3y s LEU 425 Cb 0.08 -1.73 -0.16 0.00 0.50 0.00 0.00 46.19 44.89 2c3y s LEU 425 CO 0.16 0.23 1.12 0.61 -1.32 0.00 0.00 176.35 177.15 2c3y n GLY 426 N 3.09 -0.06 2.55 7.98 0.00 0.11 -1.13 105.19 117.73 2c3y n GLY 426 Ca -0.18 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2c3y n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y n ALA 427 N 1.32 0.00 1.35 4.61 0.00 -1.26 -4.71 120.51 121.82 2c3y n ALA 427 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.71 2c3y n ALA 427 Cb 0.25 -0.20 0.45 0.00 0.00 0.00 0.00 19.45 19.94 2c3y n ALA 427 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2c3y n ASP 428 N -0.09 1.67 0.00 0.00 5.68 -0.28 -4.94 116.55 118.59 2c3y n ASP 428 Ca 0.00 -1.61 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 2c3y n ASP 428 Cb 0.05 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2c3y n ASP 428 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2c3y n GLY 429 N 1.18 0.67 0.09 6.12 0.00 -1.26 -4.07 105.19 107.92 2c3y n GLY 429 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 2c3y n GLY 429 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2c3y h THR 430 N 0.00 1.04 -0.30 2.61 2.02 -1.92 -0.74 112.91 115.62 2c3y h THR 430 Ca 0.00 -0.08 0.02 0.00 0.77 0.00 0.00 66.41 67.11 2c3y h THR 430 Cb 0.00 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 2c3y h THR 430 CO 0.00 0.04 0.17 0.58 0.37 0.00 0.00 175.52 176.68 2c3y h VAL 431 N 0.21 1.02 -0.81 3.16 2.07 -1.95 0.32 116.25 120.26 2c3y h VAL 431 Ca 0.06 -0.12 0.06 0.00 0.82 0.00 0.00 66.70 67.51 2c3y h VAL 431 Cb -0.02 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 2c3y h VAL 431 CO -0.01 0.06 0.50 1.23 0.02 0.00 0.00 177.57 179.37 2c3y h GLY 432 N 0.35 1.21 0.99 2.17 0.00 -1.92 -0.61 103.07 105.26 2c3y h GLY 432 Ca 0.12 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 47.03 2c3y h GLY 432 CO -0.07 0.26 0.10 0.00 0.00 0.00 0.00 176.54 176.83 2c3y h ALA 433 N 1.38 0.69 -0.61 3.60 0.00 -0.56 -1.89 119.26 121.87 2c3y h ALA 433 Ca 0.35 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2c3y h ALA 433 Cb 0.14 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2c3y h ALA 433 CO -0.16 0.41 0.31 -0.91 0.00 0.00 0.00 179.25 178.90 2c3y h ASN 434 N 0.74 0.79 -0.35 0.00 2.35 -0.29 -0.03 115.58 118.79 2c3y h ASN 434 Ca 0.16 -0.12 -0.05 0.00 -0.55 0.00 0.00 56.30 55.74 2c3y h ASN 434 Cb 0.37 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 2c3y h ASN 434 CO 0.01 0.69 0.07 0.11 -1.65 0.00 0.00 177.43 176.65 2c3y h LYS 435 N 0.84 0.66 -0.35 0.81 1.57 -0.98 -1.18 116.57 117.94 2c3y h LYS 435 Ca 0.21 -0.13 -0.15 0.00 -1.87 0.00 0.00 60.65 58.71 2c3y h LYS 435 Cb 0.09 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2c3y h LYS 435 CO -0.03 0.63 -0.37 1.96 -0.57 0.00 0.00 179.45 181.07 2c3y h GLN 436 N 0.64 0.83 -0.67 3.15 1.08 -0.82 -2.09 115.11 117.22 2c3y h GLN 436 Ca 0.14 -0.42 -0.05 0.00 -1.45 0.00 0.00 58.65 56.87 2c3y h GLN 436 Cb 0.30 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.71 2c3y h GLN 436 CO 0.00 1.06 0.22 0.00 -0.95 0.00 0.00 178.83 179.16 2c3y h ALA 437 N 0.89 1.11 -0.33 3.87 0.00 -0.46 -0.11 119.26 124.22 2c3y h ALA 437 Ca 0.06 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2c3y h ALA 437 Cb 0.94 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2c3y h ALA 437 CO 0.09 0.61 0.08 0.82 0.00 0.00 0.00 179.25 180.85 2c3y h ILE 438 N 0.99 1.22 0.18 0.00 2.04 -1.07 -1.71 117.51 119.16 2c3y h ILE 438 Ca 0.22 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 2c3y h ILE 438 Cb 0.27 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2c3y h ILE 438 CO -0.01 0.25 -0.09 0.11 0.00 0.00 0.00 178.15 178.42 2c3y h LYS 439 N 0.38 -0.23 0.06 2.37 6.56 -0.96 0.07 116.57 124.83 2c3y h LYS 439 Ca 0.10 0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.73 2c3y h LYS 439 Cb 0.30 0.05 -0.03 0.00 -0.57 0.00 0.00 32.23 31.99 2c3y h LYS 439 CO 0.00 -0.14 -0.17 0.82 -2.06 0.00 0.00 179.45 177.90 2c3y h ILE 440 N -0.26 0.60 -0.46 1.86 2.04 -1.00 0.15 117.51 120.44 2c3y h ILE 440 Ca -0.02 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 2c3y h ILE 440 Cb 0.20 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 2c3y h ILE 440 CO 0.04 0.00 0.08 0.40 0.00 0.00 0.00 178.15 178.68 2c3y h ILE 441 N -0.31 1.24 -0.28 -0.67 2.04 -1.31 -2.25 117.51 115.97 2c3y h ILE 441 Ca 0.03 -0.88 -0.04 0.00 1.00 0.00 0.00 64.86 64.97 2c3y h ILE 441 Cb 0.35 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 2c3y h ILE 441 CO -0.12 0.31 -0.01 1.23 0.00 0.00 0.00 178.15 179.56 2c3y h GLY 442 N 0.62 0.46 1.40 5.37 0.00 -0.79 -1.84 103.07 108.29 2c3y h GLY 442 Ca 0.14 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.21 2c3y h GLY 442 CO 0.01 0.25 -0.32 1.22 0.00 0.00 0.00 176.54 177.70 2c3y n ASP 443 N -4.30 0.35 0.00 0.19 10.43 0.03 -4.16 116.55 119.07 2c3y n ASP 443 Ca 0.01 0.07 0.00 0.00 2.57 0.00 0.00 54.79 57.44 2c3y n ASP 443 Cb 0.23 -0.06 0.00 0.00 1.84 0.00 0.00 41.12 43.13 2c3y n ASP 443 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2c3y n ASN 444 N -1.57 1.33 -3.79 -2.24 3.02 -0.86 -5.07 115.26 106.08 2c3y n ASN 444 Ca 0.06 -1.56 -0.15 0.00 -0.03 0.00 0.00 54.58 52.90 2c3y n ASN 444 Cb 0.35 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.43 2c3y n ASN 444 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2c3y s THR 445 N -0.56 0.00 -2.04 3.41 -4.23 -0.72 -5.03 115.64 106.48 2c3y s THR 445 Ca 0.00 -1.98 0.23 0.00 -1.18 0.00 0.00 61.69 58.75 2c3y s THR 445 Cb 0.00 -2.50 0.63 0.00 1.34 0.00 0.00 72.50 71.97 2c3y s THR 445 CO 0.00 0.00 1.53 0.47 -0.54 0.00 0.00 174.62 176.08 2c3y n ASP 446 N -0.89 3.90 -4.80 3.99 10.43 -1.26 -4.83 116.55 123.09 2c3y n ASP 446 Ca 0.04 -2.00 -0.33 0.00 2.57 0.00 0.00 54.79 55.07 2c3y n ASP 446 Cb 0.64 -0.47 -0.01 0.00 1.84 0.00 0.00 41.12 43.13 2c3y n ASP 446 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2c3y s LEU 447 N -1.04 3.61 0.23 0.64 1.43 -1.26 -4.92 118.68 117.37 2c3y s LEU 447 Ca 0.48 1.84 -0.09 0.00 -1.03 0.00 0.00 54.13 55.33 2c3y s LEU 447 Cb 0.25 -4.54 -0.07 0.00 0.03 0.00 0.00 46.19 41.86 2c3y s LEU 447 CO 0.33 -1.02 0.55 -0.36 0.23 0.00 0.00 176.35 176.08 2c3y s PHE 448 N -2.31 3.43 0.00 0.29 0.40 0.92 -4.79 117.98 115.91 2c3y s PHE 448 Ca 0.65 0.85 -0.00 0.00 -0.60 0.00 0.00 56.93 57.82 2c3y s PHE 448 Cb -0.16 -2.24 -0.00 0.00 0.51 0.00 0.00 43.02 41.12 2c3y s PHE 448 CO 0.31 0.26 -0.00 0.00 0.70 0.00 0.00 175.22 176.50 2c3y s ALA 449 N -1.84 0.02 0.01 5.36 0.00 -1.26 -2.04 121.76 122.00 2c3y s ALA 449 Ca 0.47 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.28 2c3y s ALA 449 Cb -0.11 0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 2c3y s ALA 449 CO 0.22 -0.05 -0.02 -1.14 0.00 0.00 0.00 175.76 174.77 2c3y s GLN 450 N -0.41 0.16 -0.04 0.00 0.74 -0.28 -2.47 119.66 117.37 2c3y s GLN 450 Ca -0.04 -0.27 -0.03 0.00 0.05 0.00 0.00 55.36 55.07 2c3y s GLN 450 Cb -0.03 0.00 0.02 0.00 1.10 0.00 0.00 33.01 34.10 2c3y s GLN 450 CO -0.00 -0.01 0.09 0.20 -0.55 0.00 0.00 175.29 175.01 2c3y s GLY 451 N -0.61 -0.04 -0.06 2.59 0.00 -0.16 -1.44 107.32 107.60 2c3y s GLY 451 Ca -0.06 0.31 -0.03 0.00 0.00 0.00 0.00 44.72 44.94 2c3y s GLY 451 CO -0.00 0.39 0.13 -0.47 0.00 0.00 0.00 173.10 173.15 2c3y s TYR 452 N 0.35 -0.15 -0.06 1.90 5.04 -0.36 -0.06 117.35 124.01 2c3y s TYR 452 Ca -0.03 0.42 0.05 0.00 -2.44 0.00 0.00 57.07 55.07 2c3y s TYR 452 Cb -0.04 -0.04 -0.01 0.00 0.35 0.00 0.00 41.96 42.23 2c3y s TYR 452 CO -0.01 -0.13 -0.22 -0.06 -1.34 0.00 0.00 175.55 173.79 2c3y s PHE 453 N 0.75 2.15 -0.11 4.97 0.40 -1.26 -0.55 117.98 124.34 2c3y s PHE 453 Ca -0.06 -0.67 -0.03 0.00 -0.60 0.00 0.00 56.93 55.58 2c3y s PHE 453 Cb -0.08 -1.43 -0.03 0.00 0.51 0.00 0.00 43.02 41.99 2c3y s PHE 453 CO -0.04 -0.22 -0.00 0.45 0.70 0.00 0.00 175.22 176.11 2c3y s SER 454 N -0.01 5.17 0.00 1.36 0.15 0.05 -4.99 113.70 115.44 2c3y s SER 454 Ca -0.06 0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.67 2c3y s SER 454 Cb -0.13 -1.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.59 2c3y s SER 454 CO 0.04 0.31 0.00 -1.22 1.20 0.00 0.00 173.24 173.57 2c3y n TYR 455 N 2.60 -0.50 -4.45 3.44 4.02 -1.26 -1.21 117.16 119.80 2c3y n TYR 455 Ca -0.18 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.47 2c3y n TYR 455 Cb 0.53 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.76 2c3y n TYR 455 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2c3y s ASP 456 N -0.31 3.79 0.29 7.72 3.68 -1.14 -4.86 116.67 125.84 2c3y s ASP 456 Ca 0.00 -1.00 0.22 0.00 2.13 0.00 0.00 52.55 53.90 2c3y s ASP 456 Cb 0.00 -0.40 0.13 0.00 -1.45 0.00 0.00 42.92 41.20 2c3y s ASP 456 CO 0.00 -0.02 1.29 0.28 0.13 0.00 0.00 175.17 176.85 2c3y h SER 457 N 2.15 0.00 -3.16 -0.34 0.02 -1.96 -3.45 113.55 106.81 2c3y h SER 457 Ca -0.41 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.01 2c3y h SER 457 Cb 1.26 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.81 2c3y h SER 457 CO 0.62 0.09 0.63 -0.54 -1.14 0.00 0.00 176.83 176.49 2c3y s LYS 458 N -3.23 4.39 0.38 3.45 -0.14 -1.26 -4.93 119.74 118.40 2c3y s LYS 458 Ca 0.03 1.91 0.20 0.00 -1.36 0.00 0.00 55.97 56.75 2c3y s LYS 458 Cb 0.07 -3.29 0.35 0.00 -1.68 0.00 0.00 37.83 33.29 2c3y s LYS 458 CO 0.74 -0.31 1.59 0.87 -0.76 0.00 0.00 175.35 177.48 2c3y h LYS 459 N 6.55 0.00 -5.29 1.68 1.57 -1.63 -3.39 116.57 116.06 2c3y h LYS 459 Ca -0.42 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.89 2c3y h LYS 459 Cb 1.21 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.25 2c3y h LYS 459 CO 0.82 0.23 -0.80 0.45 -0.57 0.00 0.00 179.45 179.58 2c3y s SER 460 N -6.28 1.64 -1.64 0.86 0.15 -1.26 -4.75 113.70 102.42 2c3y s SER 460 Ca 0.05 -0.33 -0.03 0.00 0.70 0.00 0.00 55.95 56.34 2c3y s SER 460 Cb 0.07 -0.15 0.01 0.00 -1.71 0.00 0.00 66.02 64.23 2c3y s SER 460 CO 0.69 0.12 0.35 0.61 1.20 0.00 0.00 173.24 176.21 2c3y n GLY 461 N 2.43 -0.51 3.86 9.45 0.00 -1.26 -4.96 105.19 114.20 2c3y n GLY 461 Ca -0.16 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 2c3y n GLY 461 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c3y s GLY 462 N -2.42 1.62 -0.11 -0.02 0.00 -1.26 -4.75 107.32 100.37 2c3y s GLY 462 Ca 0.18 -0.38 -0.07 0.00 0.00 0.00 0.00 44.72 44.45 2c3y s GLY 462 CO 0.22 0.04 0.16 -1.50 0.00 0.00 0.00 173.10 172.01 2c3y s ILE 463 N -3.35 5.48 -0.02 0.90 2.07 -1.26 0.05 121.20 125.07 2c3y s ILE 463 Ca 0.60 0.22 0.04 0.00 -1.41 0.00 0.00 60.65 60.10 2c3y s ILE 463 Cb -0.12 -3.42 -0.01 0.00 0.13 0.00 0.00 42.46 39.04 2c3y s ILE 463 CO 0.52 0.60 -0.15 -0.89 -1.91 0.00 0.00 174.94 173.11 2c3y s THR 464 N -1.05 1.25 -0.13 4.00 2.01 0.01 -2.90 115.64 118.84 2c3y s THR 464 Ca 0.16 -0.65 0.00 0.00 0.31 0.00 0.00 61.69 61.51 2c3y s THR 464 Cb -0.12 -1.06 0.02 0.00 0.01 0.00 0.00 72.50 71.35 2c3y s THR 464 CO 0.05 0.36 -0.12 -0.51 -0.69 0.00 0.00 174.62 173.71 2c3y s ILE 465 N -0.17 1.35 -0.11 1.82 1.10 -0.35 0.57 121.20 125.40 2c3y s ILE 465 Ca 0.02 -0.50 -0.05 0.00 -0.51 0.00 0.00 60.65 59.60 2c3y s ILE 465 Cb -0.08 -1.29 -0.04 0.00 0.15 0.00 0.00 42.46 41.20 2c3y s ILE 465 CO 0.00 0.42 0.09 -0.44 -2.11 0.00 0.00 174.94 172.91 2c3y s SER 466 N 1.48 5.99 -0.23 4.50 0.01 0.60 -0.77 113.70 125.29 2c3y s SER 466 Ca 0.03 0.35 0.02 0.00 1.31 0.00 0.00 55.95 57.66 2c3y s SER 466 Cb -0.13 -1.87 0.05 0.00 0.21 0.00 0.00 66.02 64.28 2c3y s SER 466 CO -0.08 0.39 -0.11 -1.00 0.41 0.00 0.00 173.24 172.85 2c3y s HIS 467 N -0.92 2.76 0.04 2.43 3.76 0.29 -1.16 115.29 122.50 2c3y s HIS 467 Ca 0.14 -1.90 0.09 0.00 -0.15 0.00 0.00 55.06 53.24 2c3y s HIS 467 Cb -0.12 -1.76 -0.03 0.00 1.11 0.00 0.00 32.58 31.78 2c3y s HIS 467 CO 0.03 -0.81 -0.25 -0.51 -0.85 0.00 0.00 174.74 172.36 2c3y s LEU 468 N 1.28 2.17 0.03 0.89 1.43 -0.21 -1.22 118.68 123.04 2c3y s LEU 468 Ca -0.04 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 52.51 2c3y s LEU 468 Cb -0.18 -1.21 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 2c3y s LEU 468 CO -0.07 0.23 -0.07 -0.13 0.23 0.00 0.00 176.35 176.54 2c3y s ARG 469 N -1.22 0.50 -0.07 1.70 0.52 -0.52 -0.13 118.95 119.73 2c3y s ARG 469 Ca 0.11 -0.58 -0.06 0.00 -0.52 0.00 0.00 55.73 54.68 2c3y s ARG 469 Cb -0.10 -0.33 0.02 0.00 0.52 0.00 0.00 34.95 35.06 2c3y s ARG 469 CO 0.02 0.07 0.18 -0.06 0.02 0.00 0.00 175.30 175.53 2c3y s PHE 470 N -0.98 -0.20 0.13 -0.53 0.40 -0.61 -1.12 117.98 115.06 2c3y s PHE 470 Ca -0.06 0.50 -0.25 0.00 -0.60 0.00 0.00 56.93 56.52 2c3y s PHE 470 Cb -0.07 0.05 0.07 0.00 0.51 0.00 0.00 43.02 43.58 2c3y s PHE 470 CO 0.00 -0.11 0.89 0.20 0.70 0.00 0.00 175.22 176.91 2c3y s GLY 471 N 0.28 -0.30 0.34 4.36 0.00 -0.87 -0.05 107.32 111.09 2c3y s GLY 471 Ca -0.02 0.31 0.18 0.00 0.00 0.00 0.00 44.72 45.19 2c3y s GLY 471 CO -0.01 0.08 1.58 0.83 0.00 0.00 0.00 173.10 175.57 2c3y h GLU 472 N 2.00 0.00 -6.17 2.90 5.08 -1.86 0.26 114.58 116.79 2c3y h GLU 472 Ca -0.24 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.61 2c3y h GLU 472 Cb 1.24 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.45 2c3y h GLU 472 CO 0.27 0.37 -0.50 0.15 -1.00 0.00 0.00 179.01 178.29 2c3y s LYS 473 N -3.20 3.12 0.35 2.33 -0.14 -1.26 -4.72 119.74 116.22 2c3y s LYS 473 Ca 0.03 -0.87 -0.27 0.00 -1.36 0.00 0.00 55.97 53.50 2c3y s LYS 473 Cb 0.08 -2.72 -0.12 0.00 -1.68 0.00 0.00 37.83 33.39 2c3y s LYS 473 CO 0.71 0.45 1.24 -2.30 -0.76 0.00 0.00 175.35 174.68 2c3y n PRO 474 N -0.94 1.97 -3.41 -1.68 -0.02 -1.26 -4.67 135.00 125.00 2c3y n PRO 474 Ca -0.08 0.69 -0.43 0.00 -2.02 0.00 0.00 63.50 61.66 2c3y n PRO 474 Cb 0.56 -2.27 -0.09 0.00 -0.02 0.00 0.00 33.50 31.68 2c3y n PRO 474 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2c3y s ILE 475 N -1.12 5.21 -0.77 4.25 1.01 -1.26 -4.90 121.20 123.63 2c3y s ILE 475 Ca 0.57 -0.71 0.15 0.00 0.00 0.00 0.00 60.65 60.66 2c3y s ILE 475 Cb -0.57 -4.01 0.52 0.00 0.01 0.00 0.00 42.46 38.41 2c3y s ILE 475 CO 0.61 -0.42 1.44 0.00 0.00 0.00 0.00 174.94 176.58 2c3y n GLN 476 N 5.28 3.21 -2.23 2.79 6.02 -1.26 -4.89 117.38 126.30 2c3y n GLN 476 Ca -0.11 -2.59 -0.40 0.00 -0.01 0.00 0.00 57.00 53.89 2c3y n GLN 476 Cb 0.46 -1.67 -0.02 0.00 1.02 0.00 0.00 30.24 30.04 2c3y n GLN 476 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2c3y n SER 477 N 0.43 4.19 -2.78 1.08 7.64 -1.26 -2.68 113.62 120.24 2c3y n SER 477 Ca 0.20 -2.84 -0.29 0.00 1.01 0.00 0.00 58.87 56.95 2c3y n SER 477 Cb 0.74 -1.69 -0.07 0.00 -1.01 0.00 0.00 64.21 62.17 2c3y n SER 477 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2c3y n THR 478 N 6.45 3.91 -3.66 0.44 -2.24 -1.26 -4.77 114.28 113.15 2c3y n THR 478 Ca 0.49 -2.70 -0.10 0.00 -2.27 0.00 0.00 64.05 59.46 2c3y n THR 478 Cb 0.45 -2.11 -0.04 0.00 -2.10 0.00 0.00 70.33 66.52 2c3y n THR 478 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2c3y s TYR 479 N 0.33 -0.17 0.76 4.78 -0.85 -1.26 -4.79 117.35 116.15 2c3y s TYR 479 Ca 0.64 -0.15 -0.13 0.00 -0.52 0.00 0.00 57.07 56.90 2c3y s TYR 479 Cb 0.27 0.29 0.06 0.00 0.38 0.00 0.00 41.96 42.95 2c3y s TYR 479 CO -0.08 -0.76 1.17 -0.51 -1.52 0.00 0.00 175.55 173.84 2c3y s LEU 480 N -2.83 3.20 0.16 -3.49 1.43 -1.26 -4.95 118.68 110.95 2c3y s LEU 480 Ca 0.05 2.20 -0.30 0.00 -1.03 0.00 0.00 54.13 55.05 2c3y s LEU 480 Cb 0.01 -4.57 -0.08 0.00 0.03 0.00 0.00 46.19 41.58 2c3y s LEU 480 CO -0.09 -2.30 1.28 -0.69 0.23 0.00 0.00 176.35 174.78 2c3y s VAL 481 N -2.28 3.43 0.00 -1.59 1.01 -1.26 -4.90 120.40 114.80 2c3y s VAL 481 Ca 0.70 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.81 2c3y s VAL 481 Cb -0.25 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.41 2c3y s VAL 481 CO 0.48 0.15 0.00 -0.46 0.00 0.00 0.00 175.10 175.27 2c3y n ASN 482 N 3.01 0.91 -3.51 3.32 0.23 -1.26 -4.88 115.26 113.07 2c3y n ASN 482 Ca 0.07 -0.30 -0.28 0.00 -0.53 0.00 0.00 54.58 53.54 2c3y n ASN 482 Cb 0.44 0.78 -0.11 0.00 -2.08 0.00 0.00 39.78 38.80 2c3y n ASN 482 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2c3y s ARG 483 N -0.96 1.04 0.35 -3.83 0.52 -1.26 -4.17 118.95 110.64 2c3y s ARG 483 Ca 0.00 -2.04 -0.17 0.00 -0.52 0.00 0.00 55.73 53.00 2c3y s ARG 483 Cb 0.00 -1.74 -0.10 0.00 0.52 0.00 0.00 34.95 33.64 2c3y s ARG 483 CO 0.00 -1.30 0.80 0.00 0.02 0.00 0.00 175.30 174.82 2c3y s ALA 484 N 0.18 3.24 -0.08 2.13 0.00 -1.24 -4.68 121.76 121.31 2c3y s ALA 484 Ca 0.26 0.17 0.14 0.00 0.00 0.00 0.00 51.96 52.53 2c3y s ALA 484 Cb -0.08 -2.90 -0.21 0.00 0.00 0.00 0.00 23.12 19.94 2c3y s ALA 484 CO -0.12 0.27 0.64 -0.25 0.00 0.00 0.00 175.76 176.31 2c3y n ASP 485 N -0.37 0.78 -3.88 0.00 9.92 0.60 -1.11 116.55 122.48 2c3y n ASP 485 Ca 0.04 0.36 -0.22 0.00 -0.53 0.00 0.00 54.79 54.45 2c3y n ASP 485 Cb 0.53 0.11 -0.17 0.00 -0.64 0.00 0.00 41.12 40.96 2c3y n ASP 485 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 2c3y s TYR 486 N -2.68 0.87 -0.09 1.24 5.04 -0.98 -0.66 117.35 120.09 2c3y s TYR 486 Ca -0.05 -0.28 0.00 0.00 -2.44 0.00 0.00 57.07 54.30 2c3y s TYR 486 Cb 0.08 -0.79 0.02 0.00 0.35 0.00 0.00 41.96 41.63 2c3y s TYR 486 CO 0.82 -0.26 -0.08 0.08 -1.34 0.00 0.00 175.55 174.78 2c3y s VAL 487 N 1.19 0.94 -0.09 3.14 1.01 -0.40 -0.62 120.40 125.57 2c3y s VAL 487 Ca -0.07 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.67 2c3y s VAL 487 Cb -0.14 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 2c3y s VAL 487 CO -0.01 0.34 -0.20 0.00 0.00 0.00 0.00 175.10 175.22 2c3y s ALA 488 N 1.39 2.34 -0.34 5.51 0.00 0.41 -1.08 121.76 129.99 2c3y s ALA 488 Ca -0.02 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 50.94 2c3y s ALA 488 Cb -0.14 -0.89 0.06 0.00 0.00 0.00 0.00 23.12 22.16 2c3y s ALA 488 CO -0.04 0.35 0.08 0.00 0.00 0.00 0.00 175.76 176.15 2c3y n HIS 490 N 4.66 0.00 -3.80 0.00 8.25 0.92 -1.67 115.22 123.58 2c3y n HIS 490 Ca -0.10 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.08 2c3y n HIS 490 Cb 0.43 -0.15 -0.16 0.00 1.12 0.00 0.00 29.99 31.22 2c3y n HIS 490 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2c3y s ASN 491 N -2.43 3.03 0.55 0.41 3.04 -1.25 -4.78 114.94 113.51 2c3y s ASN 491 Ca 0.30 -0.84 0.26 0.00 0.04 0.00 0.00 52.86 52.61 2c3y s ASN 491 Cb 0.20 -0.76 1.45 0.00 -1.54 0.00 0.00 41.25 40.60 2c3y s ASN 491 CO 0.47 -0.27 2.02 1.55 -3.04 0.00 0.00 177.10 177.83 2c3y h PRO 492 N 8.17 0.00 0.00 0.43 0.13 -1.82 -1.78 132.00 137.13 2c3y h PRO 492 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 2c3y h PRO 492 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2c3y h PRO 492 CO 0.36 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.13 2c3y h ALA 493 N 1.73 1.00 0.00 -0.56 0.00 -1.95 -2.32 119.26 117.15 2c3y h ALA 493 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2c3y h ALA 493 Cb 0.85 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2c3y h ALA 493 CO -0.00 0.00 -0.58 1.88 0.00 0.00 0.00 179.25 180.55 2c3y h TYR 494 N 0.00 0.00 -0.94 0.00 0.99 -1.75 -3.34 116.97 111.94 2c3y h TYR 494 Ca 0.00 0.00 0.26 0.00 2.00 0.00 0.00 58.73 60.99 2c3y h TYR 494 Cb 0.10 0.00 -0.17 0.00 1.00 0.00 0.00 36.73 37.66 2c3y h TYR 494 CO 0.00 0.58 0.08 0.28 -0.00 0.00 0.00 178.16 179.10 2c3y h VAL 495 N 0.00 0.12 -0.57 -2.88 2.07 -1.60 -1.32 116.25 112.07 2c3y h VAL 495 Ca -0.01 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2c3y h VAL 495 Cb 1.09 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2c3y h VAL 495 CO 0.07 0.01 0.00 0.61 0.02 0.00 0.00 177.57 178.29 2c3y n GLY 496 N -1.45 2.27 0.00 2.17 0.00 -1.25 -4.51 105.19 102.41 2c3y n GLY 496 Ca 0.22 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2c3y n GLY 496 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2c3y n ILE 497 N 1.01 0.00 -4.30 -0.61 -5.35 -0.55 -5.09 119.36 104.47 2c3y n ILE 497 Ca 0.22 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.41 2c3y n ILE 497 Cb 0.74 -0.20 -0.11 0.00 -1.74 0.00 0.00 39.64 38.34 2c3y n ILE 497 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2c3y s TYR 498 N -1.19 2.56 -1.34 4.28 1.51 -0.91 -4.93 117.35 117.34 2c3y s TYR 498 Ca 0.00 -0.25 -0.16 0.00 -1.01 0.00 0.00 57.07 55.65 2c3y s TYR 498 Cb 0.00 -1.32 0.03 0.00 -0.11 0.00 0.00 41.96 40.56 2c3y s TYR 498 CO 0.00 0.44 2.03 -3.47 -1.11 0.00 0.00 175.55 173.44 2c3y n ASP 499 N 0.53 4.06 -0.22 2.29 -0.08 -1.26 -4.76 116.55 117.10 2c3y n ASP 499 Ca -0.14 -2.85 0.06 0.00 -1.51 0.00 0.00 54.79 50.35 2c3y n ASP 499 Cb 0.54 -1.65 0.31 0.00 2.34 0.00 0.00 41.12 42.67 2c3y n ASP 499 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2c3y h ILE 500 N 4.64 1.04 -0.62 5.18 1.08 -1.90 -3.01 117.51 123.91 2c3y h ILE 500 Ca 0.50 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.68 2c3y h ILE 500 Cb 0.73 0.12 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 2c3y h ILE 500 CO 1.73 0.15 0.00 0.18 -0.69 0.00 0.00 178.15 179.52 2c3y n LEU 501 N -4.48 4.77 -4.68 1.44 4.32 -1.26 -4.98 117.00 112.13 2c3y n LEU 501 Ca 0.12 -2.41 -0.47 0.00 -0.02 0.00 0.00 56.01 53.23 2c3y n LEU 501 Cb 0.21 -0.59 -0.04 0.00 -1.62 0.00 0.00 43.42 41.38 2c3y n LEU 501 CO 0.33 0.76 1.39 1.21 -1.22 0.00 0.00 177.39 179.87 2c3y n GLU 502 N 1.04 2.23 -0.52 3.23 2.13 -1.14 -2.37 120.64 125.24 2c3y n GLU 502 Ca 0.25 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.89 2c3y n GLU 502 Cb 0.91 -2.64 0.00 0.00 0.27 0.00 0.00 31.44 29.98 2c3y n GLU 502 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2c3y n GLY 503 N 4.05 1.62 3.67 8.31 0.00 -1.26 -4.79 105.19 116.79 2c3y n GLY 503 Ca 0.20 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 2c3y n GLY 503 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2c3y n ILE 504 N -2.00 1.39 -1.71 -0.61 3.06 -1.00 -3.73 119.36 114.76 2c3y n ILE 504 Ca 0.00 -0.35 -0.34 0.00 -2.50 0.00 0.00 62.75 59.56 2c3y n ILE 504 Cb 0.00 -1.42 0.06 0.00 0.54 0.00 0.00 39.64 38.82 2c3y n ILE 504 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 2c3y s LYS 505 N -0.99 2.59 0.38 9.51 1.02 -0.27 -4.86 119.74 127.12 2c3y s LYS 505 Ca 0.63 1.66 -0.27 0.00 0.02 0.00 0.00 55.97 58.01 2c3y s LYS 505 Cb -0.64 -1.90 -0.09 0.00 -0.52 0.00 0.00 37.83 34.68 2c3y s LYS 505 CO 0.55 -1.47 1.34 -0.51 -0.92 0.00 0.00 175.35 174.34 2c3y s ASP 506 N -2.07 6.42 0.00 2.83 -0.00 -1.26 -0.99 116.67 121.60 2c3y s ASP 506 Ca 0.73 2.74 0.00 0.00 -0.00 0.00 0.00 52.55 56.02 2c3y s ASP 506 Cb -0.27 -2.65 0.00 0.00 -0.00 0.00 0.00 42.92 40.01 2c3y s ASP 506 CO 0.40 -0.78 0.00 0.61 -0.00 0.00 0.00 175.17 175.40 2c3y n GLY 507 N 0.67 0.36 3.73 0.21 0.00 0.30 -4.98 105.19 105.47 2c3y n GLY 507 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2c3y n GLY 507 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c3y s GLY 508 N -2.00 1.61 -0.14 -0.02 0.00 -0.16 -4.45 107.32 102.16 2c3y s GLY 508 Ca 0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 44.72 44.54 2c3y s GLY 508 CO 0.00 0.37 0.08 -1.08 0.00 0.00 0.00 173.10 172.47 2c3y s THR 509 N -2.97 4.95 -0.15 0.90 -1.32 0.17 -1.06 115.64 116.16 2c3y s THR 509 Ca 0.63 0.01 -0.00 0.00 -1.21 0.00 0.00 61.69 61.12 2c3y s THR 509 Cb -0.17 -3.17 0.04 0.00 -1.51 0.00 0.00 72.50 67.68 2c3y s THR 509 CO 0.57 0.55 -0.06 0.12 -2.21 0.00 0.00 174.62 173.59 2c3y s PHE 510 N -0.46 1.65 -0.14 9.09 5.36 -0.49 -1.28 117.98 131.71 2c3y s PHE 510 Ca 0.10 -0.98 -0.03 0.00 -0.96 0.00 0.00 56.93 55.07 2c3y s PHE 510 Cb -0.12 -1.30 -0.03 0.00 -0.34 0.00 0.00 43.02 41.24 2c3y s PHE 510 CO 0.02 -0.58 -0.06 0.54 -1.46 0.00 0.00 175.22 173.68 2c3y s VAL 511 N 1.65 3.74 -0.05 3.12 0.11 -0.24 -0.57 120.40 128.15 2c3y s VAL 511 Ca 0.02 -0.42 0.06 0.00 -2.93 0.00 0.00 61.98 58.71 2c3y s VAL 511 Cb -0.14 -2.62 -0.01 0.00 -1.53 0.00 0.00 36.38 32.08 2c3y s VAL 511 CO -0.08 0.51 -0.23 -0.22 -3.33 0.00 0.00 175.10 171.75 2c3y s LEU 512 N 0.26 2.03 -0.34 2.54 2.96 0.68 -1.07 118.68 125.74 2c3y s LEU 512 Ca -0.04 -0.47 -0.16 0.00 -0.22 0.00 0.00 54.13 53.23 2c3y s LEU 512 Cb -0.14 -1.26 -0.01 0.00 0.50 0.00 0.00 46.19 45.28 2c3y s LEU 512 CO 0.03 0.22 0.43 0.21 -1.32 0.00 0.00 176.35 175.92 2c3y s ASN 513 N -0.10 6.25 0.08 3.68 3.04 -0.67 -0.90 114.94 126.31 2c3y s ASN 513 Ca -0.04 -0.12 -0.27 0.00 0.04 0.00 0.00 52.86 52.48 2c3y s ASN 513 Cb -0.13 -2.23 0.08 0.00 -1.54 0.00 0.00 41.25 37.43 2c3y s ASN 513 CO 0.03 -0.40 0.87 -0.94 -3.04 0.00 0.00 177.10 173.63 2c3y s SER 514 N 1.74 -0.32 0.00 -4.21 1.04 -0.81 -3.22 113.70 107.92 2c3y s SER 514 Ca 0.15 -0.16 0.20 0.00 0.48 0.00 0.00 55.95 56.63 2c3y s SER 514 Cb -0.16 0.46 0.53 0.00 0.10 0.00 0.00 66.02 66.95 2c3y s SER 514 CO 0.12 -0.78 1.44 -0.81 0.98 0.00 0.00 173.24 174.19 2c3y n PRO 515 N -0.34 2.22 -2.19 4.02 -0.04 -1.26 -3.09 135.00 134.32 2c3y n PRO 515 Ca -0.09 -1.86 -0.43 0.00 -0.04 0.00 0.00 63.50 61.09 2c3y n PRO 515 Cb 0.62 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 2c3y n PRO 515 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2c3y n TRP 516 N 1.04 3.81 -0.01 0.54 8.01 -1.26 -4.77 117.44 124.79 2c3y n TRP 516 Ca 0.18 -2.95 -0.14 0.00 -1.31 0.00 0.00 57.50 53.28 2c3y n TRP 516 Cb 0.48 -2.40 -0.03 0.00 -2.01 0.00 0.00 31.31 27.35 2c3y n TRP 516 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 2c3y h SER 517 N 6.41 0.81 -3.89 -0.99 0.02 -1.95 -3.38 113.55 110.59 2c3y h SER 517 Ca 0.48 -0.51 -0.49 0.00 -0.84 0.00 0.00 61.79 60.43 2c3y h SER 517 Cb 0.71 -0.24 0.02 0.00 0.14 0.00 0.00 62.40 63.04 2c3y h SER 517 CO 1.67 1.29 0.22 -0.94 -1.14 0.00 0.00 176.83 177.92 2c3y s SER 518 N -7.04 6.44 0.51 3.07 1.04 -1.26 -4.93 113.70 111.52 2c3y s SER 518 Ca -0.09 1.23 0.20 0.00 0.48 0.00 0.00 55.95 57.77 2c3y s SER 518 Cb 0.10 -2.37 1.32 0.00 0.10 0.00 0.00 66.02 65.16 2c3y s SER 518 CO 0.88 -0.56 2.11 0.25 0.98 0.00 0.00 173.24 176.90 2c3y h LEU 519 N 0.69 0.00 0.27 2.42 5.85 -1.95 -1.17 115.31 121.42 2c3y h LEU 519 Ca -0.46 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 2c3y h LEU 519 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2c3y h LEU 519 CO 0.63 0.08 -0.13 -0.08 -0.34 0.00 0.00 178.44 178.60 2c3y h GLU 520 N 0.00 -0.35 -0.41 1.25 4.81 -1.96 0.18 114.58 118.11 2c3y h GLU 520 Ca -0.00 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 2c3y h GLU 520 Cb 0.16 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2c3y h GLU 520 CO 0.01 -0.07 -0.15 -0.44 -0.73 0.00 0.00 179.01 177.63 2c3y h ASP 521 N -0.61 0.76 -0.46 1.04 3.45 -1.83 -2.42 116.42 116.34 2c3y h ASP 521 Ca -0.04 -0.24 -0.06 0.00 0.43 0.00 0.00 57.03 57.12 2c3y h ASP 521 Cb 0.44 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.99 2c3y h ASP 521 CO 0.06 0.92 0.06 -0.03 -1.57 0.00 0.00 179.24 178.68 2c3y h MET 522 N 0.68 0.77 -0.44 3.56 4.05 -1.22 -1.80 114.93 120.54 2c3y h MET 522 Ca 0.11 -0.22 0.00 0.00 -0.28 0.00 0.00 59.70 59.31 2c3y h MET 522 Cb 0.64 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.33 2c3y h MET 522 CO 0.04 0.80 0.28 -0.44 0.23 0.00 0.00 176.91 177.82 2c3y h ASP 523 N 0.63 0.51 1.29 1.39 3.45 -0.76 0.99 116.42 123.92 2c3y h ASP 523 Ca 0.14 -0.02 -0.11 0.00 0.43 0.00 0.00 57.03 57.47 2c3y h ASP 523 Cb 0.41 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 39.04 2c3y h ASP 523 CO 0.01 0.38 -0.52 0.50 -1.57 0.00 0.00 179.24 178.04 2c3y h LYS 524 N 0.59 0.00 0.00 3.56 3.64 -1.02 -3.37 116.57 119.98 2c3y h LYS 524 Ca 0.16 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.41 2c3y h LYS 524 Cb -0.05 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 2c3y h LYS 524 CO -0.03 0.52 -1.79 0.72 -2.27 0.00 0.00 179.45 176.60 2c3y n HIS 525 N -3.31 0.00 -2.76 1.91 8.25 -0.71 -4.98 115.22 113.62 2c3y n HIS 525 Ca 0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.06 2c3y n HIS 525 Cb 0.70 -0.50 -0.04 0.00 1.12 0.00 0.00 29.99 31.27 2c3y n HIS 525 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2c3y s LEU 526 N -4.51 4.40 0.55 2.41 2.96 0.31 -4.84 118.68 119.96 2c3y s LEU 526 Ca -0.06 1.63 -0.19 0.00 -0.22 0.00 0.00 54.13 55.29 2c3y s LEU 526 Cb 0.06 -3.51 -0.06 0.00 0.50 0.00 0.00 46.19 43.19 2c3y s LEU 526 CO 0.57 -0.19 1.14 -2.84 -1.32 0.00 0.00 176.35 173.70 2c3y s PRO 527 N 0.72 3.33 0.29 0.98 0.02 -1.26 -4.86 135.00 134.22 2c3y s PRO 527 Ca 0.49 1.63 0.01 0.00 0.02 0.00 0.00 61.00 63.15 2c3y s PRO 527 Cb -0.21 -2.00 0.54 0.00 0.02 0.00 0.00 34.50 32.85 2c3y s PRO 527 CO 0.27 -0.87 1.86 0.66 -0.33 0.00 0.00 177.00 178.59 2c3y h SER 528 N 1.18 0.93 -0.78 2.53 4.64 -1.90 -1.32 113.55 118.83 2c3y h SER 528 Ca -0.50 0.03 0.03 0.00 -0.47 0.00 0.00 61.79 60.88 2c3y h SER 528 Cb 1.26 -0.16 -0.05 0.00 -0.31 0.00 0.00 62.40 63.15 2c3y h SER 528 CO 0.57 0.54 0.50 1.23 -0.87 0.00 0.00 176.83 178.79 2c3y h GLY 529 N 1.02 1.13 1.22 -0.77 0.00 -1.90 0.38 103.07 104.14 2c3y h GLY 529 Ca 0.46 -0.38 -0.18 0.00 0.00 0.00 0.00 47.33 47.23 2c3y h GLY 529 CO -0.22 0.32 -0.56 -2.22 0.00 0.00 0.00 176.54 173.87 2c3y h ILE 530 N 0.97 1.28 -0.59 2.60 2.04 -1.74 -2.20 117.51 119.88 2c3y h ILE 530 Ca 0.31 -1.76 0.01 0.00 1.00 0.00 0.00 64.86 64.42 2c3y h ILE 530 Cb 0.00 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 2c3y h ILE 530 CO -0.11 0.57 0.39 0.11 0.00 0.00 0.00 178.15 179.11 2c3y h LYS 531 N 0.62 0.78 -0.50 2.37 1.57 -0.76 -1.64 116.57 119.00 2c3y h LYS 531 Ca 0.01 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 2c3y h LYS 531 Cb 1.16 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 2c3y h LYS 531 CO 0.12 0.52 -0.09 0.00 -0.57 0.00 0.00 179.45 179.43 2c3y h ARG 532 N 0.80 0.95 -0.19 3.15 3.08 -0.89 -2.40 114.38 118.89 2c3y h ARG 532 Ca 0.22 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 2c3y h ARG 532 Cb -0.09 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 2c3y h ARG 532 CO -0.05 1.02 0.09 1.15 -1.07 0.00 0.00 179.97 181.11 2c3y h THR 533 N 0.81 1.14 -0.49 2.04 2.02 -1.19 0.19 112.91 117.43 2c3y h THR 533 Ca 0.13 -0.39 0.06 0.00 0.77 0.00 0.00 66.41 66.98 2c3y h THR 533 Cb 0.65 1.04 -0.05 0.00 -1.74 0.00 0.00 68.15 68.05 2c3y h THR 533 CO 0.04 0.13 0.18 0.40 0.37 0.00 0.00 175.52 176.64 2c3y h ILE 534 N 0.18 0.84 -0.01 3.11 2.04 -1.24 0.13 117.51 122.56 2c3y h ILE 534 Ca 0.07 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.79 2c3y h ILE 534 Cb 0.12 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 2c3y h ILE 534 CO -0.01 0.06 -0.05 0.00 0.00 0.00 0.00 178.15 178.15 2c3y h ALA 535 N 1.32 0.03 -0.64 1.87 0.00 -1.25 -0.36 119.26 120.23 2c3y h ALA 535 Ca 0.23 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2c3y h ALA 535 Cb 0.24 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2c3y h ALA 535 CO -0.23 -0.11 0.31 -0.91 0.00 0.00 0.00 179.25 178.30 2c3y h ASN 536 N -0.55 0.84 -0.08 0.00 -0.26 -0.55 -1.86 115.58 113.12 2c3y h ASN 536 Ca -0.00 -0.13 0.00 0.00 -0.56 0.00 0.00 56.30 55.61 2c3y h ASN 536 Cb 0.70 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.74 2c3y h ASN 536 CO 0.01 0.73 0.00 0.29 -1.06 0.00 0.00 177.43 177.40 2c3y n LYS 537 N -4.49 1.30 -4.07 0.81 5.02 0.46 -4.92 118.16 112.28 2c3y n LYS 537 Ca 0.04 -0.46 -0.27 0.00 -2.02 0.00 0.00 58.31 55.60 2c3y n LYS 537 Cb 0.13 -1.31 -0.05 0.00 -0.02 0.00 0.00 35.03 33.78 2c3y n LYS 537 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2c3y n LYS 538 N -0.30 -2.48 -2.24 1.97 5.02 -0.70 -0.54 118.16 118.89 2c3y n LYS 538 Ca 0.14 0.30 -0.33 0.00 -2.02 0.00 0.00 58.31 56.40 2c3y n LYS 538 Cb 0.17 -4.20 -0.01 0.00 -0.02 0.00 0.00 35.03 30.97 2c3y n LYS 538 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2c3y s LEU 539 N -7.10 3.59 -0.58 -0.35 1.43 -0.20 -3.65 118.68 111.82 2c3y s LEU 539 Ca 0.01 1.75 -0.21 0.00 -1.03 0.00 0.00 54.13 54.65 2c3y s LEU 539 Cb -0.01 -4.53 0.07 0.00 0.03 0.00 0.00 46.19 41.76 2c3y s LEU 539 CO 0.92 -0.91 0.81 -0.54 0.23 0.00 0.00 176.35 176.87 2c3y s LYS 540 N -3.94 3.14 -0.18 1.70 1.02 -0.22 -4.94 119.74 116.32 2c3y s LYS 540 Ca 0.62 -0.86 -0.15 0.00 0.02 0.00 0.00 55.97 55.61 2c3y s LYS 540 Cb -0.14 -4.17 -0.04 0.00 -0.52 0.00 0.00 37.83 32.96 2c3y s LYS 540 CO 0.32 -1.54 0.34 0.12 -0.92 0.00 0.00 175.35 173.67 2c3y s PHE 541 N 3.36 3.42 -0.06 3.18 5.36 -1.26 -1.39 117.98 130.59 2c3y s PHE 541 Ca 0.19 0.60 0.04 0.00 -0.96 0.00 0.00 56.93 56.80 2c3y s PHE 541 Cb -0.18 -2.42 0.00 0.00 -0.34 0.00 0.00 43.02 40.08 2c3y s PHE 541 CO 0.11 0.13 -0.18 0.71 -1.46 0.00 0.00 175.22 174.54 2c3y s TYR 542 N 0.83 1.82 -0.08 10.12 1.51 0.26 0.69 117.35 132.51 2c3y s TYR 542 Ca 0.17 -0.59 0.05 0.00 -1.01 0.00 0.00 57.07 55.69 2c3y s TYR 542 Cb -0.14 -1.24 -0.01 0.00 -0.11 0.00 0.00 41.96 40.46 2c3y s TYR 542 CO 0.06 -0.23 -0.24 1.21 -1.11 0.00 0.00 175.55 175.24 2c3y s ASN 543 N 0.20 3.14 -0.03 2.29 2.47 -1.26 -0.23 114.94 121.52 2c3y s ASN 543 Ca -0.08 -0.51 0.00 0.00 0.42 0.00 0.00 52.86 52.69 2c3y s ASN 543 Cb -0.13 -1.08 0.03 0.00 -1.45 0.00 0.00 41.25 38.61 2c3y s ASN 543 CO 0.04 0.21 -0.00 -0.51 -3.72 0.00 0.00 177.10 173.12 2c3y s ILE 544 N 0.03 0.19 -1.34 -5.21 2.07 -0.08 -4.83 121.20 112.03 2c3y s ILE 544 Ca -0.09 0.08 -0.13 0.00 -1.41 0.00 0.00 60.65 59.10 2c3y s ILE 544 Cb -0.15 -0.28 0.11 0.00 0.13 0.00 0.00 42.46 42.26 2c3y s ILE 544 CO 0.06 0.15 1.92 -0.67 -1.91 0.00 0.00 174.94 174.48 2c3y n ASP 545 N 4.15 4.65 -0.24 4.50 -0.08 -1.18 -1.92 116.55 126.43 2c3y n ASP 545 Ca -0.26 -2.96 0.12 0.00 -1.51 0.00 0.00 54.79 50.17 2c3y n ASP 545 Cb 0.50 -1.60 0.40 0.00 2.34 0.00 0.00 41.12 42.76 2c3y n ASP 545 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2c3y h ALA 546 N 6.35 1.86 -0.50 -1.67 0.00 -1.92 -2.05 119.26 121.34 2c3y h ALA 546 Ca 0.46 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.34 2c3y h ALA 546 Cb 0.71 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2c3y h ALA 546 CO 1.64 -0.07 0.19 0.28 0.00 0.00 0.00 179.25 181.29 2c3y h VAL 547 N 0.66 1.21 -0.32 0.00 2.07 -1.86 -1.05 116.25 116.96 2c3y h VAL 547 Ca 0.41 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 2c3y h VAL 547 Cb 0.66 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2c3y h VAL 547 CO -0.17 0.25 0.09 0.50 0.02 0.00 0.00 177.57 178.26 2c3y h LYS 548 N 0.66 0.50 -0.30 1.57 3.64 -1.75 -1.33 116.57 119.56 2c3y h LYS 548 Ca 0.16 -0.11 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 2c3y h LYS 548 Cb 0.21 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2c3y h LYS 548 CO -0.01 0.55 0.16 0.82 -2.27 0.00 0.00 179.45 178.70 2c3y h ILE 549 N 0.35 1.01 -0.89 2.00 2.04 -1.27 0.00 117.51 120.75 2c3y h ILE 549 Ca 0.10 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2c3y h ILE 549 Cb 0.27 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 2c3y h ILE 549 CO -0.00 0.06 0.56 0.00 0.00 0.00 0.00 178.15 178.77 2c3y h ALA 550 N 1.14 1.32 -0.36 1.87 0.00 -1.08 -1.74 119.26 120.41 2c3y h ALA 550 Ca 0.12 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2c3y h ALA 550 Cb 0.02 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 2c3y h ALA 550 CO -0.07 0.61 -0.18 1.15 0.00 0.00 0.00 179.25 180.75 2c3y h THR 551 N 1.21 1.28 -0.46 0.00 2.02 -0.77 0.43 112.91 116.62 2c3y h THR 551 Ca 0.32 -1.30 -0.06 0.00 0.77 0.00 0.00 66.41 66.14 2c3y h THR 551 Cb -0.10 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 2c3y h THR 551 CO -0.07 0.43 0.04 0.44 0.37 0.00 0.00 175.52 176.73 2c3y h ASP 552 N 0.55 0.69 0.21 4.18 3.32 -0.56 -2.74 116.42 122.08 2c3y h ASP 552 Ca 0.08 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2c3y h ASP 552 Cb 0.72 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2c3y h ASP 552 CO 0.05 0.74 -0.09 1.33 -1.72 0.00 0.00 179.24 179.56 2c3y n VAL 553 N -4.25 0.00 -0.10 -1.35 0.24 -0.69 -4.92 118.33 107.26 2c3y n VAL 553 Ca 0.03 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 2c3y n VAL 553 Cb 0.27 0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.67 2c3y n VAL 553 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2c3y n GLY 554 N 1.22 0.95 1.11 7.63 0.00 -1.03 -4.72 105.19 110.35 2c3y n GLY 554 Ca 0.17 -0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.21 2c3y n GLY 554 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c3y n LEU 555 N 0.00 3.23 -2.49 0.99 4.77 0.15 -4.94 117.00 118.71 2c3y n LEU 555 Ca 0.00 -1.63 -0.15 0.00 -0.03 0.00 0.00 56.01 54.21 2c3y n LEU 555 Cb 0.00 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 40.63 2c3y n LEU 555 CO 0.00 0.58 -0.17 0.61 -1.33 0.00 0.00 177.39 177.08 2c3y n GLY 556 N 0.90 -0.50 0.67 -0.72 0.00 -1.21 -2.08 105.19 102.25 2c3y n GLY 556 Ca 0.17 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2c3y n GLY 556 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c3y n GLY 557 N -0.88 1.90 3.65 -0.02 0.00 -1.26 -4.88 105.19 103.72 2c3y n GLY 557 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 2c3y n GLY 557 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c3y n ARG 558 N -2.00 2.73 0.01 1.61 5.12 -0.88 -4.59 116.66 118.65 2c3y n ARG 558 Ca 0.00 0.98 0.12 0.00 -1.93 0.00 0.00 57.85 57.02 2c3y n ARG 558 Cb 0.00 -3.02 0.22 0.00 -1.16 0.00 0.00 32.46 28.50 2c3y n ARG 558 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 2c3y n ILE 559 N 5.81 0.04 -0.25 0.55 -5.35 -1.26 -4.54 119.36 114.35 2c3y n ILE 559 Ca 0.21 -0.03 0.06 0.00 -0.27 0.00 0.00 62.75 62.72 2c3y n ILE 559 Cb 0.41 0.24 0.19 0.00 -1.74 0.00 0.00 39.64 38.74 2c3y n ILE 559 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2c3y h ASN 560 N 0.00 0.04 0.39 7.28 7.08 -1.90 -1.06 115.58 127.41 2c3y h ASN 560 Ca 0.00 0.15 -0.11 0.00 -3.08 0.00 0.00 56.30 53.26 2c3y h ASN 560 Cb 0.53 0.19 -0.01 0.00 -2.08 0.00 0.00 38.32 36.95 2c3y h ASN 560 CO 0.00 -0.03 -0.48 -0.03 -2.08 0.00 0.00 177.43 174.81 2c3y h MET 561 N 0.28 0.10 -0.10 4.14 4.05 -1.94 -1.54 114.93 119.93 2c3y h MET 561 Ca 0.43 -0.05 -0.05 0.00 -0.28 0.00 0.00 59.70 59.75 2c3y h MET 561 Cb 0.74 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.54 2c3y h MET 561 CO -0.51 0.56 -0.12 0.82 0.23 0.00 0.00 176.91 177.88 2c3y h ILE 562 N 0.08 1.38 0.00 1.77 5.03 -1.53 -2.36 117.51 121.88 2c3y h ILE 562 Ca 0.00 -1.33 -0.05 0.00 -0.12 0.00 0.00 64.86 63.36 2c3y h ILE 562 Cb 0.87 2.04 -0.01 0.00 -3.03 0.00 0.00 36.82 36.69 2c3y h ILE 562 CO 0.07 0.38 -0.25 0.24 -0.68 0.00 0.00 178.15 177.91 2c3y h MET 563 N -0.17 0.00 -0.37 2.37 2.86 -1.27 -1.94 114.93 116.40 2c3y h MET 563 Ca 0.01 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.54 2c3y h MET 563 Cb 0.67 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 2c3y h MET 563 CO 0.03 0.25 -0.22 0.37 1.06 0.00 0.00 176.91 178.40 2c3y h GLN 564 N 0.00 0.81 -0.66 1.72 5.75 -1.21 -2.62 115.11 118.88 2c3y h GLN 564 Ca -0.00 -0.37 -0.02 0.00 -0.15 0.00 0.00 58.65 58.11 2c3y h GLN 564 Cb 0.65 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.16 2c3y h GLN 564 CO 0.03 1.00 0.33 1.15 -2.65 0.00 0.00 178.83 178.70 2c3y h THR 565 N 0.60 1.22 -0.46 2.39 2.02 -0.86 -2.08 112.91 115.75 2c3y h THR 565 Ca 0.08 -0.60 0.08 0.00 0.77 0.00 0.00 66.41 66.74 2c3y h THR 565 Cb 0.78 0.39 -0.07 0.00 -1.74 0.00 0.00 68.15 67.51 2c3y h THR 565 CO 0.06 0.25 0.07 0.00 0.37 0.00 0.00 175.52 176.27 2c3y h ALA 566 N 1.16 0.48 0.27 6.16 0.00 -1.21 0.53 119.26 126.65 2c3y h ALA 566 Ca 0.23 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2c3y h ALA 566 Cb 0.09 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2c3y h ALA 566 CO -0.03 -0.34 -0.15 0.35 0.00 0.00 0.00 179.25 179.08 2c3y h PHE 567 N 0.19 -0.39 -0.72 0.00 3.57 -1.10 0.19 116.94 118.69 2c3y h PHE 567 Ca 0.23 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.74 2c3y h PHE 567 Cb 0.31 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 2c3y h PHE 567 CO -0.24 -0.24 0.47 0.74 -2.23 0.00 0.00 178.31 176.82 2c3y h PHE 568 N -0.40 0.88 0.05 0.41 0.04 -0.92 0.12 116.94 117.12 2c3y h PHE 568 Ca -0.03 0.02 -0.27 0.00 2.80 0.00 0.00 57.97 60.49 2c3y h PHE 568 Cb 0.32 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 2c3y h PHE 568 CO -0.08 0.54 -1.35 -0.22 -0.60 0.00 0.00 178.31 176.61 2c3y h LYS 569 N 0.94 0.11 0.00 1.51 3.64 -0.76 -3.42 116.57 118.59 2c3y h LYS 569 Ca 0.27 -0.19 -0.10 0.00 -1.27 0.00 0.00 60.65 59.36 2c3y h LYS 569 Cb -0.06 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2c3y h LYS 569 CO -0.06 0.95 -1.70 1.28 -2.27 0.00 0.00 179.45 177.65 2c3y n LEU 570 N -3.34 0.00 0.26 5.20 4.32 0.64 -4.63 117.00 119.44 2c3y n LEU 570 Ca -0.10 0.00 0.17 0.00 -0.02 0.00 0.00 56.01 56.06 2c3y n LEU 570 Cb 1.01 0.14 0.91 0.00 -1.62 0.00 0.00 43.42 43.85 2c3y n LEU 570 CO 0.48 0.14 1.02 0.00 -1.22 0.00 0.00 177.39 177.81 2c3y h ALA 571 N 0.89 1.00 -0.23 -1.18 0.00 -0.90 -3.46 119.26 115.38 2c3y h ALA 571 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 2c3y h ALA 571 Cb 1.14 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2c3y h ALA 571 CO 0.01 0.00 -0.09 0.41 0.00 0.00 0.00 179.25 179.58 2c3y n GLY 572 N -1.05 0.76 0.08 0.00 0.00 -1.26 -4.87 105.19 98.83 2c3y n GLY 572 Ca -0.02 -0.70 -0.07 0.00 0.00 0.00 0.00 46.02 45.23 2c3y n GLY 572 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2c3y h VAL 573 N 0.00 1.04 -3.35 1.61 -1.51 -1.88 -3.47 116.25 108.69 2c3y h VAL 573 Ca -0.10 -2.82 -0.41 0.00 -1.23 0.00 0.00 66.70 62.14 2c3y h VAL 573 Cb 0.35 2.50 -0.16 0.00 -2.13 0.00 0.00 31.29 31.85 2c3y h VAL 573 CO 0.15 0.59 -0.74 -0.76 -1.23 0.00 0.00 177.57 175.58 2c3y s LEU 574 N -6.23 2.47 0.43 4.19 1.43 -1.26 -5.13 118.68 114.58 2c3y s LEU 574 Ca -0.03 -0.91 -0.24 0.00 -1.03 0.00 0.00 54.13 51.92 2c3y s LEU 574 Cb 0.09 -0.54 -0.08 0.00 0.03 0.00 0.00 46.19 45.68 2c3y s LEU 574 CO 0.82 -0.19 1.14 -2.84 0.23 0.00 0.00 176.35 175.51 2c3y s PRO 575 N -3.17 3.95 0.19 1.29 0.02 -1.26 -4.77 135.00 131.25 2c3y s PRO 575 Ca 0.14 1.73 -0.21 0.00 0.02 0.00 0.00 61.00 62.68 2c3y s PRO 575 Cb -0.02 -2.53 0.12 0.00 0.02 0.00 0.00 34.50 32.09 2c3y s PRO 575 CO 0.03 -0.38 1.59 0.35 -0.33 0.00 0.00 177.00 178.27 2c3y h PHE 576 N 2.35 -0.93 -0.62 6.54 3.04 -1.92 0.14 116.94 125.54 2c3y h PHE 576 Ca -0.49 0.07 0.03 0.00 3.98 0.00 0.00 57.97 61.56 2c3y h PHE 576 Cb 1.24 0.49 -0.04 0.00 2.56 0.00 0.00 35.95 40.20 2c3y h PHE 576 CO 0.55 -0.38 0.38 0.93 -2.02 0.00 0.00 178.31 177.76 2c3y h GLU 577 N -0.16 0.72 -0.49 1.11 5.08 -1.99 -1.66 114.58 117.18 2c3y h GLU 577 Ca 0.23 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.42 2c3y h GLU 577 Cb 0.55 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2c3y h GLU 577 CO -0.68 0.47 -0.17 -0.22 -1.00 0.00 0.00 179.01 177.42 2c3y h LYS 578 N 0.74 0.99 0.24 2.33 3.64 -1.76 -2.29 116.57 120.46 2c3y h LYS 578 Ca 0.25 -0.40 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2c3y h LYS 578 Cb 0.03 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2c3y h LYS 578 CO -0.11 1.08 -0.25 0.00 -2.27 0.00 0.00 179.45 177.91 2c3y h ALA 579 N 0.88 -0.51 -0.93 5.00 0.00 -0.31 -0.62 119.26 122.78 2c3y h ALA 579 Ca 0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2c3y h ALA 579 Cb 0.74 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 2c3y h ALA 579 CO 0.06 -0.82 0.54 0.28 0.00 0.00 0.00 179.25 179.31 2c3y h VAL 580 N -0.52 1.26 0.68 0.00 2.07 -1.34 -1.11 116.25 117.29 2c3y h VAL 580 Ca -0.00 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 2c3y h VAL 580 Cb 0.49 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2c3y h VAL 580 CO -0.06 0.28 -0.44 -0.78 0.02 0.00 0.00 177.57 176.60 2c3y h ASP 581 N 1.29 -1.11 -0.96 0.57 -0.00 -1.07 -1.80 116.42 113.34 2c3y h ASP 581 Ca 0.33 0.07 0.07 0.00 -0.00 0.00 0.00 57.03 57.50 2c3y h ASP 581 Cb -0.02 0.33 -0.07 0.00 -0.00 0.00 0.00 39.33 39.57 2c3y h ASP 581 CO -0.06 -0.67 0.62 -0.07 -0.00 0.00 0.00 179.24 179.06 2c3y h LEU 582 N -1.06 0.96 0.33 2.28 4.07 -0.99 -1.24 115.31 119.66 2c3y h LEU 582 Ca -0.09 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 2c3y h LEU 582 Cb 0.86 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.41 2c3y h LEU 582 CO 0.07 0.60 -0.16 0.25 -1.08 0.00 0.00 178.44 178.12 2c3y h LEU 583 N 1.07 -0.38 -1.18 1.67 6.46 -0.97 -1.68 115.31 120.30 2c3y h LEU 583 Ca 0.42 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 58.13 2c3y h LEU 583 Cb 0.23 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.24 2c3y h LEU 583 CO -0.17 -0.25 0.09 0.11 -0.62 0.00 0.00 178.44 177.60 2c3y h LYS 584 N -0.48 0.66 -0.20 1.25 1.57 -1.04 -2.10 116.57 116.23 2c3y h LYS 584 Ca -0.05 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2c3y h LYS 584 Cb 0.36 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2c3y h LYS 584 CO 0.08 0.62 0.12 0.87 -0.57 0.00 0.00 179.45 180.56 2c3y h LYS 585 N 0.64 0.27 -0.81 3.15 1.57 -1.06 -2.16 116.57 118.17 2c3y h LYS 585 Ca 0.14 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.93 2c3y h LYS 585 Cb 0.27 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 2c3y h LYS 585 CO -0.00 0.23 0.53 0.66 -0.57 0.00 0.00 179.45 180.30 2c3y h SER 586 N 0.23 0.87 -0.97 0.86 4.64 -0.99 0.77 113.55 118.95 2c3y h SER 586 Ca 0.07 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.39 2c3y h SER 586 Cb 0.04 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 61.87 2c3y h SER 586 CO -0.01 0.61 0.64 0.40 -0.87 0.00 0.00 176.83 177.60 2c3y h ILE 587 N 1.02 1.23 -0.11 0.95 2.04 -0.81 0.39 117.51 122.22 2c3y h ILE 587 Ca 0.32 -0.45 -0.17 0.00 1.00 0.00 0.00 64.86 65.56 2c3y h ILE 587 Cb 0.01 -0.18 0.01 0.00 -0.74 0.00 0.00 36.82 35.91 2c3y h ILE 587 CO -0.09 0.24 -0.58 0.45 0.00 0.00 0.00 178.15 178.17 2c3y h HIS 588 N 1.30 0.79 0.18 1.37 3.86 -0.66 -3.25 115.15 118.74 2c3y h HIS 588 Ca 0.36 -0.35 0.01 0.00 -1.16 0.00 0.00 60.37 59.23 2c3y h HIS 588 Cb -0.12 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.21 2c3y h HIS 588 CO -0.00 1.15 -0.24 -0.22 0.86 0.00 0.00 177.93 179.47 2c3y h LYS 589 N 0.21 -0.47 0.00 2.45 3.64 -0.46 -3.42 116.57 118.52 2c3y h LYS 589 Ca -0.04 0.03 -0.22 0.00 -1.27 0.00 0.00 60.65 59.15 2c3y h LYS 589 Cb 1.23 0.11 0.08 0.00 -0.41 0.00 0.00 32.23 33.24 2c3y h LYS 589 CO 0.12 -0.31 0.19 0.00 -2.27 0.00 0.00 179.45 177.18 2c3y n ALA 590 N -2.54 -0.66 -0.35 5.00 0.00 0.13 -4.90 120.51 117.20 2c3y n ALA 590 Ca -0.08 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.47 2c3y n ALA 590 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.71 2c3y n ALA 590 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2c3y n TYR 591 N -2.82 -0.69 -1.65 0.00 4.01 -1.25 -4.73 117.16 110.03 2c3y n TYR 591 Ca 0.08 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.66 2c3y n TYR 591 Cb 0.29 0.08 -0.06 0.00 -0.31 0.00 0.00 39.34 39.35 2c3y n TYR 591 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2c3y n GLY 592 N 0.00 1.15 0.11 2.72 0.00 -1.25 -4.79 105.19 103.14 2c3y n GLY 592 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2c3y n GLY 592 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2c3y h LYS 593 N 0.00 0.00 0.00 1.61 5.09 -1.93 -3.38 116.57 117.97 2c3y h LYS 593 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.40 2c3y h LYS 593 Cb 1.09 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.42 2c3y h LYS 593 CO 0.48 0.00 -0.61 1.17 -2.09 0.00 0.00 179.45 178.39 2c3y n LYS 594 N -2.64 2.39 0.00 0.07 3.00 -1.26 -5.12 118.16 114.60 2c3y n LYS 594 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2c3y n LYS 594 Cb 0.54 -0.79 0.00 0.00 0.00 0.00 0.00 35.03 34.78 2c3y n LYS 594 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2c3y n GLY 595 N 1.80 0.43 0.09 3.14 0.00 -1.26 -4.99 105.19 104.40 2c3y n GLY 595 Ca 0.00 -1.02 0.12 0.00 0.00 0.00 0.00 46.02 45.12 2c3y n GLY 595 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3y n GLU 596 N -0.47 0.26 -0.12 1.61 -0.58 -1.26 -3.78 120.64 116.30 2c3y n GLU 596 Ca 0.00 -0.18 -0.12 0.00 -0.42 0.00 0.00 57.16 56.45 2c3y n GLU 596 Cb 0.00 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.35 2c3y n GLU 596 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2c3y h LYS 597 N 0.43 0.74 -0.44 3.49 3.64 -1.99 -1.27 116.57 121.16 2c3y h LYS 597 Ca 0.00 -0.31 -0.03 0.00 -1.27 0.00 0.00 60.65 59.03 2c3y h LYS 597 Cb 0.52 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 2c3y h LYS 597 CO 0.00 0.92 0.14 0.82 -2.27 0.00 0.00 179.45 179.06 2c3y h ILE 598 N 0.53 1.22 -0.68 2.00 1.08 -1.98 -2.17 117.51 117.51 2c3y h ILE 598 Ca 0.08 -0.72 0.05 0.00 -0.39 0.00 0.00 64.86 63.89 2c3y h ILE 598 Cb 0.68 0.85 -0.05 0.00 -3.07 0.00 0.00 36.82 35.23 2c3y h ILE 598 CO 0.05 0.26 0.39 0.58 -0.69 0.00 0.00 178.15 178.74 2c3y h VAL 599 N 0.57 0.99 -0.59 1.67 2.07 -1.67 -2.16 116.25 117.13 2c3y h VAL 599 Ca 0.14 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 2c3y h VAL 599 Cb 0.25 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 2c3y h VAL 599 CO -0.01 0.13 0.09 0.50 0.02 0.00 0.00 177.57 178.31 2c3y h LYS 600 N 0.73 0.95 -0.70 1.57 1.63 -0.97 -1.00 116.57 118.78 2c3y h LYS 600 Ca 0.30 -0.24 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 2c3y h LYS 600 Cb 0.15 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 2c3y h LYS 600 CO -0.17 0.89 0.31 0.52 -3.45 0.00 0.00 179.45 177.55 2c3y h MET 601 N 0.90 1.02 0.00 1.90 2.86 -0.79 0.15 114.93 120.97 2c3y h MET 601 Ca 0.18 -0.17 -0.12 0.00 -2.06 0.00 0.00 59.70 57.53 2c3y h MET 601 Cb 0.40 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2c3y h MET 601 CO 0.01 0.83 -0.58 -0.91 1.06 0.00 0.00 176.91 177.31 2c3y h ASN 602 N 0.98 0.00 -0.20 1.22 4.21 -1.20 -0.78 115.58 119.80 2c3y h ASN 602 Ca 0.24 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.60 2c3y h ASN 602 Cb 0.16 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.37 2c3y h ASN 602 CO -0.02 0.58 -0.44 0.74 -1.29 0.00 0.00 177.43 177.00 2c3y h THR 603 N 0.00 1.32 -0.50 2.81 2.02 -0.73 -2.31 112.91 115.53 2c3y h THR 603 Ca -0.01 -1.67 -0.06 0.00 0.77 0.00 0.00 66.41 65.45 2c3y h THR 603 Cb 1.08 1.88 -0.02 0.00 -1.74 0.00 0.00 68.15 69.34 2c3y h THR 603 CO 0.08 0.52 0.07 0.44 0.37 0.00 0.00 175.52 177.00 2c3y h ASP 604 N 0.33 0.74 -0.28 4.18 3.45 -0.59 -1.74 116.42 122.51 2c3y h ASP 604 Ca 0.00 -0.15 -0.00 0.00 0.43 0.00 0.00 57.03 57.31 2c3y h ASP 604 Cb 1.05 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 39.61 2c3y h ASP 604 CO 0.10 0.76 0.17 0.00 -1.57 0.00 0.00 179.24 178.70 2c3y h ALA 605 N 1.33 0.36 -0.15 3.45 0.00 -1.01 0.36 119.26 123.61 2c3y h ALA 605 Ca 0.16 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2c3y h ALA 605 Cb 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2c3y h ALA 605 CO 0.01 -0.14 0.06 0.28 0.00 0.00 0.00 179.25 179.46 2c3y h VAL 606 N 0.36 0.98 -0.21 0.00 2.07 -1.05 0.12 116.25 118.53 2c3y h VAL 606 Ca 0.10 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.60 2c3y h VAL 606 Cb 0.01 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 2c3y h VAL 606 CO -0.02 0.03 0.05 0.44 0.02 0.00 0.00 177.57 178.09 2c3y h ASP 607 N 0.14 0.04 -0.62 0.57 3.45 -1.04 -0.08 116.42 118.88 2c3y h ASP 607 Ca 0.06 0.03 -0.04 0.00 0.43 0.00 0.00 57.03 57.51 2c3y h ASP 607 Cb 0.02 0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 38.80 2c3y h ASP 607 CO -0.05 0.05 0.22 -0.61 -1.57 0.00 0.00 179.24 177.28 2c3y h GLN 608 N 0.14 0.95 -0.33 3.56 5.75 -0.74 -1.53 115.11 122.91 2c3y h GLN 608 Ca 0.09 -0.19 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 2c3y h GLN 608 Cb 0.08 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 2c3y h GLN 608 CO -0.12 0.82 0.21 0.00 -2.65 0.00 0.00 178.83 177.10 2c3y h ALA 609 N 1.08 0.42 -0.63 3.38 0.00 -0.37 0.85 119.26 123.99 2c3y h ALA 609 Ca 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2c3y h ALA 609 Cb 0.25 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2c3y h ALA 609 CO -0.01 -0.11 0.34 0.28 0.00 0.00 0.00 179.25 179.75 2c3y h VAL 610 N 0.44 1.20 -0.60 0.00 2.07 -0.82 0.13 116.25 118.68 2c3y h VAL 610 Ca 0.12 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 2c3y h VAL 610 Cb -0.04 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 2c3y h VAL 610 CO -0.03 0.22 0.33 0.74 0.02 0.00 0.00 177.57 178.85 2c3y h THR 611 N 0.86 1.19 0.00 2.57 2.02 -0.89 -3.11 112.91 115.55 2c3y h THR 611 Ca 0.22 -0.49 0.00 0.00 0.77 0.00 0.00 66.41 66.91 2c3y h THR 611 Cb 0.04 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 2c3y h THR 611 CO -0.04 0.21 -0.19 0.28 0.37 0.00 0.00 175.52 176.16 2c3y h SER 612 N 0.81 0.00 -0.61 4.18 0.02 -0.45 -3.42 113.55 114.07 2c3y h SER 612 Ca 0.21 -0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.79 2c3y h SER 612 Cb 0.04 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.54 2c3y h SER 612 CO -0.03 0.00 1.09 -0.76 -1.14 0.00 0.00 176.83 175.98 2c3y s LEU 613 N -6.00 3.18 0.11 5.07 2.01 0.42 -4.91 118.68 118.56 2c3y s LEU 613 Ca 0.06 -1.42 0.08 0.00 0.01 0.00 0.00 54.13 52.87 2c3y s LEU 613 Cb 0.06 -2.58 -0.04 0.00 0.01 0.00 0.00 46.19 43.65 2c3y s LEU 613 CO 0.69 -2.73 -0.21 -1.10 1.01 0.00 0.00 176.35 174.01 2c3y s GLN 614 N 6.36 1.16 0.37 1.70 -1.52 -1.26 -5.00 119.66 121.46 2c3y s GLN 614 Ca 0.66 -1.19 -0.28 0.00 -1.95 0.00 0.00 55.36 52.61 2c3y s GLN 614 Cb -0.02 -1.44 -0.11 0.00 -0.22 0.00 0.00 33.01 31.22 2c3y s GLN 614 CO 0.07 0.33 1.42 0.39 -0.25 0.00 0.00 175.29 177.26 2c3y n GLU 615 N 1.04 2.48 -3.07 2.91 1.02 -1.26 -4.46 120.64 119.29 2c3y n GLU 615 Ca -0.19 0.87 -0.41 0.00 -0.02 0.00 0.00 57.16 57.40 2c3y n GLU 615 Cb 0.54 -2.56 -0.06 0.00 -0.02 0.00 0.00 31.44 29.34 2c3y n GLU 615 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2c3y s PHE 616 N -1.12 3.20 -0.63 -0.32 5.36 0.22 -4.99 117.98 119.71 2c3y s PHE 616 Ca 0.54 0.60 -0.25 0.00 -0.96 0.00 0.00 56.93 56.87 2c3y s PHE 616 Cb -0.50 -3.06 0.04 0.00 -0.34 0.00 0.00 43.02 39.15 2c3y s PHE 616 CO 0.63 -0.52 1.07 0.15 -1.46 0.00 0.00 175.22 175.09 2c3y s LYS 617 N 2.71 3.27 0.14 10.12 -0.14 -1.26 -4.60 119.74 129.98 2c3y s LYS 617 Ca 0.27 -0.31 -0.07 0.00 -1.36 0.00 0.00 55.97 54.50 2c3y s LYS 617 Cb -0.15 -4.12 -0.06 0.00 -1.68 0.00 0.00 37.83 31.83 2c3y s LYS 617 CO 0.12 -1.76 0.41 1.52 -0.76 0.00 0.00 175.35 174.88 2c3y s TYR 618 N 4.58 3.49 0.57 3.18 -0.85 -1.26 -5.02 117.35 122.04 2c3y s TYR 618 Ca 0.32 0.66 -0.16 0.00 -0.52 0.00 0.00 57.07 57.37 2c3y s TYR 618 Cb -0.12 -2.08 -0.05 0.00 0.38 0.00 0.00 41.96 40.10 2c3y s TYR 618 CO 0.17 0.43 1.04 -1.25 -1.52 0.00 0.00 175.55 174.42 2c3y s PRO 619 N -2.49 3.46 0.48 -3.49 0.04 -1.26 -4.95 135.00 126.80 2c3y s PRO 619 Ca 0.40 1.16 0.16 0.00 0.04 0.00 0.00 61.00 62.76 2c3y s PRO 619 Cb -0.12 -2.06 1.14 0.00 0.04 0.00 0.00 34.50 33.50 2c3y s PRO 619 CO 0.22 -0.69 2.07 0.22 0.04 0.00 0.00 177.00 178.86 2c3y h ASP 620 N 0.59 0.00 -0.01 6.66 3.58 -2.00 -2.31 116.42 122.93 2c3y h ASP 620 Ca -0.47 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.98 2c3y h ASP 620 Cb 1.21 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.26 2c3y h ASP 620 CO 0.58 0.10 0.07 0.77 -2.88 0.00 0.00 179.24 177.88 2c3y h SER 621 N 0.00 0.00 -0.09 2.28 4.64 -1.99 -1.59 113.55 116.80 2c3y h SER 621 Ca -0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.34 2c3y h SER 621 Cb 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2c3y h SER 621 CO 0.01 0.00 0.07 -0.50 -0.87 0.00 0.00 176.83 175.55 2c3y h TRP 622 N 0.00 0.00 -0.65 4.77 4.06 -1.73 -1.64 115.95 120.76 2c3y h TRP 622 Ca 0.00 0.00 0.19 0.00 2.06 0.00 0.00 58.89 61.14 2c3y h TRP 622 Cb 0.14 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.28 2c3y h TRP 622 CO 0.00 0.00 0.57 0.87 -3.56 0.00 0.00 178.44 176.32 2c3y h LYS 623 N 0.00 0.00 -0.46 0.49 1.57 -1.51 -1.75 116.57 114.92 2c3y h LYS 623 Ca 0.04 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.51 2c3y h LYS 623 Cb 0.19 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 32.12 2c3y h LYS 623 CO -0.00 0.00 -0.97 -0.40 -0.57 0.00 0.00 179.45 177.51 2c3y n ASP 624 N -3.92 2.60 -4.71 0.86 5.68 -0.63 -4.80 116.55 111.64 2c3y n ASP 624 Ca 0.13 -2.71 -0.43 0.00 -0.50 0.00 0.00 54.79 51.28 2c3y n ASP 624 Cb 0.81 -0.42 -0.02 0.00 -1.14 0.00 0.00 41.12 40.36 2c3y n ASP 624 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2c3y n ALA 625 N -0.55 1.70 -1.78 2.12 0.00 -0.66 -4.90 120.51 116.44 2c3y n ALA 625 Ca 0.20 0.39 -0.41 0.00 0.00 0.00 0.00 53.44 53.61 2c3y n ALA 625 Cb 0.89 -2.34 -0.01 0.00 0.00 0.00 0.00 19.45 17.98 2c3y n ALA 625 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2c3y s PRO 626 N -0.76 4.14 0.05 0.00 0.04 -1.26 -4.87 135.00 132.34 2c3y s PRO 626 Ca 0.64 2.53 -0.30 0.00 0.04 0.00 0.00 61.00 63.91 2c3y s PRO 626 Cb -0.57 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 30.92 2c3y s PRO 626 CO 0.52 -0.54 0.97 0.00 0.04 0.00 0.00 177.00 177.99 2c3y s ALA 627 N -0.64 3.20 0.80 8.56 0.00 -1.26 -4.53 121.76 127.87 2c3y s ALA 627 Ca 0.57 0.56 -0.12 0.00 0.00 0.00 0.00 51.96 52.97 2c3y s ALA 627 Cb -0.46 -3.31 0.07 0.00 0.00 0.00 0.00 23.12 19.41 2c3y s ALA 627 CO 0.56 -0.14 1.11 -1.83 0.00 0.00 0.00 175.76 175.46 2c3y s GLU 628 N 0.56 2.09 0.00 0.00 -1.05 -1.26 -5.08 118.70 113.96 2c3y s GLU 628 Ca 0.50 0.50 0.00 0.00 -0.15 0.00 0.00 54.97 55.82 2c3y s GLU 628 Cb -0.22 -1.93 0.00 0.00 -0.44 0.00 0.00 34.13 31.54 2c3y s GLU 628 CO 0.29 -1.59 0.00 0.25 0.95 0.00 0.00 175.26 175.16 2c3y n THR 629 N -3.39 0.00 -2.68 1.83 -2.24 -1.26 -5.09 114.28 101.45 2c3y n THR 629 Ca 0.07 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.83 2c3y n THR 629 Cb 0.57 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.83 2c3y n THR 629 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2c3y s LYS 630 N 0.00 0.14 -1.11 -0.78 -2.85 -1.26 -5.04 119.74 108.84 2c3y s LYS 630 Ca 0.00 -0.11 -0.07 0.00 -1.00 0.00 0.00 55.97 54.79 2c3y s LYS 630 Cb 0.00 -0.00 -0.06 0.00 -2.06 0.00 0.00 37.83 35.71 2c3y s LYS 630 CO 0.00 -0.18 2.34 0.00 0.10 0.00 0.00 175.35 177.61 2c3y n ALA 631 N 2.88 5.47 -2.39 0.59 0.00 -1.26 -4.90 120.51 120.90 2c3y n ALA 631 Ca 0.09 -2.43 -0.42 0.00 0.00 0.00 0.00 53.44 50.69 2c3y n ALA 631 Cb 0.65 -3.11 -0.03 0.00 0.00 0.00 0.00 19.45 16.96 2c3y n ALA 631 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2c3y s GLU 632 N 3.09 4.48 0.82 0.00 4.04 -1.26 -5.03 118.70 124.84 2c3y s GLU 632 Ca 0.48 1.71 -0.11 0.00 0.04 0.00 0.00 54.97 57.09 2c3y s GLU 632 Cb 0.12 -3.35 0.08 0.00 0.02 0.00 0.00 34.13 31.01 2c3y s GLU 632 CO -0.04 -0.16 1.09 -1.25 -1.84 0.00 0.00 175.26 173.06 2c3y s PRO 633 N 0.76 1.89 0.13 -4.83 0.04 -1.26 -4.98 135.00 126.76 2c3y s PRO 633 Ca 0.56 0.85 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 2c3y s PRO 633 Cb -0.28 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 2c3y s PRO 633 CO 0.30 -1.81 1.12 1.41 0.04 0.00 0.00 177.00 178.06 2c3y s MET 634 N -5.01 4.55 0.34 4.56 1.75 -1.26 -5.01 119.30 119.22 2c3y s MET 634 Ca 0.62 1.71 0.01 0.00 -1.25 0.00 0.00 55.69 56.78 2c3y s MET 634 Cb -0.16 -3.31 -0.01 0.00 2.84 0.00 0.00 34.83 34.19 2c3y s MET 634 CO 0.56 -0.02 0.39 -0.08 -0.65 0.00 0.00 175.02 175.22 2c3y s THR 635 N 0.18 0.00 0.77 10.11 -1.32 -1.26 -5.10 115.64 119.03 2c3y s THR 635 Ca 0.52 -1.76 -0.14 0.00 -1.21 0.00 0.00 61.69 59.09 2c3y s THR 635 Cb -0.29 -2.58 0.06 0.00 -1.51 0.00 0.00 72.50 68.18 2c3y s THR 635 CO 0.33 0.00 1.21 0.21 -2.21 0.00 0.00 174.62 174.16 2c3y s ASN 636 N -3.29 3.86 0.16 8.08 3.84 -1.26 -4.88 114.94 121.44 2c3y s ASN 636 Ca 0.35 2.36 -0.11 0.00 0.21 0.00 0.00 52.86 55.67 2c3y s ASN 636 Cb 0.01 -2.59 0.01 0.00 -0.55 0.00 0.00 41.25 38.13 2c3y s ASN 636 CO 0.23 -2.49 1.57 1.05 -2.79 0.00 0.00 177.10 174.67 2c3y h GLU 637 N -0.64 0.97 -0.61 0.43 9.09 -2.01 -2.10 114.58 119.71 2c3y h GLU 637 Ca -0.47 -0.37 -0.06 0.00 0.05 0.00 0.00 59.36 58.51 2c3y h GLU 637 Cb 1.30 -0.05 -0.03 0.00 -1.65 0.00 0.00 28.75 28.32 2c3y h GLU 637 CO 0.48 1.05 0.15 0.35 0.05 0.00 0.00 179.01 181.08 2c3y h PHE 638 N 0.83 0.99 -0.77 2.06 3.57 -1.98 -1.35 116.94 120.30 2c3y h PHE 638 Ca 0.13 -0.10 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 2c3y h PHE 638 Cb 0.69 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 2c3y h PHE 638 CO 0.05 0.82 0.26 0.35 -2.23 0.00 0.00 178.31 177.56 2c3y h PHE 639 N 0.91 1.22 -0.18 0.41 3.57 -1.82 0.08 116.94 121.13 2c3y h PHE 639 Ca 0.20 -0.11 -0.07 0.00 3.53 0.00 0.00 57.97 61.51 2c3y h PHE 639 Cb 0.33 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 2c3y h PHE 639 CO 0.02 0.95 -0.18 0.87 -2.23 0.00 0.00 178.31 177.74 2c3y h LYS 640 N 1.14 0.43 0.00 1.11 1.57 -1.04 -0.00 116.57 119.78 2c3y h LYS 640 Ca 0.25 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2c3y h LYS 640 Cb 0.29 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2c3y h LYS 640 CO -0.01 0.79 -0.52 -0.91 -0.57 0.00 0.00 179.45 178.24 2c3y h ASN 641 N 0.09 0.00 0.00 0.86 2.35 -1.20 -3.41 115.58 114.27 2c3y h ASN 641 Ca 0.03 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2c3y h ASN 641 Cb 0.71 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.08 2c3y h ASN 641 CO 0.04 0.02 -0.17 0.52 -1.65 0.00 0.00 177.43 176.20 2c3y n VAL 642 N -2.64 0.47 -0.08 2.81 0.31 0.00 -4.83 118.33 114.37 2c3y n VAL 642 Ca 0.02 0.15 -0.13 0.00 -0.01 0.00 0.00 64.34 64.38 2c3y n VAL 642 Cb 0.51 -1.08 -0.05 0.00 -0.91 0.00 0.00 33.84 32.31 2c3y n VAL 642 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 2c3y h VAL 643 N 0.00 1.31 -0.33 2.52 3.04 -1.54 -2.73 116.25 118.52 2c3y h VAL 643 Ca 0.00 -1.34 0.01 0.00 -1.01 0.00 0.00 66.70 64.36 2c3y h VAL 643 Cb 0.17 1.65 -0.02 0.00 -2.01 0.00 0.00 31.29 31.08 2c3y h VAL 643 CO 0.00 0.42 0.20 0.50 -1.01 0.00 0.00 177.57 177.68 2c3y h LYS 644 N 0.26 0.41 -0.98 4.17 3.64 -1.25 0.28 116.57 123.11 2c3y h LYS 644 Ca 0.04 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 2c3y h LYS 644 Cb 0.74 -0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.40 2c3y h LYS 644 CO 0.05 0.27 0.63 -1.35 -2.27 0.00 0.00 179.45 176.78 2c3y h PRO 645 N 0.42 1.10 -0.38 1.90 0.11 -1.78 0.83 132.00 134.20 2c3y h PRO 645 Ca 0.12 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.09 2c3y h PRO 645 Cb -0.03 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 30.82 2c3y h PRO 645 CO -0.04 0.73 -0.06 0.82 -0.21 0.00 0.00 178.00 179.23 2c3y h ILE 646 N 1.13 1.27 0.00 4.15 2.04 -1.05 0.15 117.51 125.20 2c3y h ILE 646 Ca 0.43 -1.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 2c3y h ILE 646 Cb 0.19 1.24 -0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2c3y h ILE 646 CO -0.17 0.37 -0.14 -0.07 0.00 0.00 0.00 178.15 178.14 2c3y h LEU 647 N 0.51 0.00 -2.72 1.44 3.38 0.48 -2.15 115.31 116.26 2c3y h LEU 647 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2c3y h LEU 647 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2c3y h LEU 647 CO 0.03 0.14 0.00 0.35 0.09 0.00 0.00 178.44 179.06 2c3y n THR 648 N -3.54 1.83 -2.21 0.22 -2.24 0.20 -4.90 114.28 103.64 2c3y n THR 648 Ca -0.01 -0.96 -0.16 0.00 -2.27 0.00 0.00 64.05 60.65 2c3y n THR 648 Cb 0.29 -0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 2c3y n THR 648 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c3y n GLN 649 N 0.49 -1.25 -0.44 -0.78 1.13 -0.81 -4.76 117.38 110.95 2c3y n GLN 649 Ca 0.19 0.80 0.06 0.00 -1.94 0.00 0.00 57.00 56.11 2c3y n GLN 649 Cb 0.88 -5.16 0.21 0.00 0.11 0.00 0.00 30.24 26.27 2c3y n GLN 649 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2c3y n GLN 650 N -2.53 2.07 -0.07 -1.09 1.13 0.49 -4.71 117.38 112.67 2c3y n GLN 650 Ca -0.19 -2.90 0.00 0.00 -1.94 0.00 0.00 57.00 51.98 2c3y n GLN 650 Cb 0.63 -1.72 0.29 0.00 0.11 0.00 0.00 30.24 29.55 2c3y n GLN 650 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2c3y h GLY 651 N 1.02 0.74 2.00 1.08 0.00 -1.76 -2.19 103.07 103.97 2c3y h GLY 651 Ca 0.05 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2c3y h GLY 651 CO 0.18 0.34 0.00 -0.55 0.00 0.00 0.00 176.54 176.51 2c3y h ASP 652 N 0.69 0.00 1.14 0.19 3.32 -1.93 -1.64 116.42 118.19 2c3y h ASP 652 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2c3y h ASP 652 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2c3y h ASP 652 CO -0.02 0.00 -0.37 0.11 -1.72 0.00 0.00 179.24 177.24 2c3y h LYS 653 N 0.00 0.00 -6.34 3.56 1.57 -1.76 -3.46 116.57 110.14 2c3y h LYS 653 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 2c3y h LYS 653 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2c3y h LYS 653 CO 0.00 0.00 0.86 -0.51 -0.57 0.00 0.00 179.45 179.23 2c3y s LEU 654 N -4.44 4.30 0.94 2.94 1.02 -0.62 -4.96 118.68 117.86 2c3y s LEU 654 Ca 0.08 2.08 -0.12 0.00 0.02 0.00 0.00 54.13 56.19 2c3y s LEU 654 Cb 0.13 -3.56 0.15 0.00 0.02 0.00 0.00 46.19 42.93 2c3y s LEU 654 CO 0.67 -0.74 1.13 -2.16 0.02 0.00 0.00 176.35 175.27 2c3y s PRO 655 N 2.64 0.93 0.43 1.29 0.04 -1.26 -4.76 135.00 134.31 2c3y s PRO 655 Ca 0.64 0.34 0.09 0.00 0.04 0.00 0.00 61.00 62.11 2c3y s PRO 655 Cb -0.31 -1.81 0.96 0.00 0.04 0.00 0.00 34.50 33.38 2c3y s PRO 655 CO 0.26 -2.35 2.07 -0.39 0.04 0.00 0.00 177.00 176.63 2c3y h VAL 656 N -1.61 1.07 0.00 -0.36 -1.51 -1.82 -2.04 116.25 109.98 2c3y h VAL 656 Ca -0.52 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 64.81 2c3y h VAL 656 Cb 1.33 0.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 2c3y h VAL 656 CO 0.61 0.08 0.00 -1.54 -1.23 0.00 0.00 177.57 175.49 2c3y n SER 657 N -4.49 0.59 0.04 4.19 3.41 -1.26 -2.34 113.62 113.76 2c3y n SER 657 Ca 0.02 0.71 0.12 0.00 -0.26 0.00 0.00 58.87 59.47 2c3y n SER 657 Cb 0.08 -0.81 0.50 0.00 -0.26 0.00 0.00 64.21 63.72 2c3y n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c3y n ALA 658 N -1.77 2.14 -2.48 7.33 0.00 -0.77 -4.85 120.51 120.12 2c3y n ALA 658 Ca 0.00 -0.06 -0.28 0.00 0.00 0.00 0.00 53.44 53.10 2c3y n ALA 658 Cb 0.12 -1.42 -0.11 0.00 0.00 0.00 0.00 19.45 18.04 2c3y n ALA 658 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2c3y s PHE 659 N -3.05 2.47 0.25 0.00 0.40 -0.99 -5.04 117.98 112.02 2c3y s PHE 659 Ca 0.11 -0.29 -0.30 0.00 -0.60 0.00 0.00 56.93 55.85 2c3y s PHE 659 Cb 0.15 -1.28 -0.09 0.00 0.51 0.00 0.00 43.02 42.31 2c3y s PHE 659 CO 0.49 0.43 1.14 -1.21 0.70 0.00 0.00 175.22 176.77 2c3y s GLU 660 N -2.39 4.58 0.44 0.44 0.41 -1.26 -4.93 118.70 115.99 2c3y s GLU 660 Ca 0.19 1.84 0.16 0.00 -0.41 0.00 0.00 54.97 56.76 2c3y s GLU 660 Cb -0.10 -3.20 1.07 0.00 -1.78 0.00 0.00 34.13 30.12 2c3y s GLU 660 CO 0.11 0.09 1.96 0.00 -0.49 0.00 0.00 175.26 176.92 2c3y h ALA 661 N 4.30 2.10 -0.47 5.21 0.00 -1.94 -0.97 119.26 127.49 2c3y h ALA 661 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2c3y h ALA 661 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2c3y h ALA 661 CO 0.69 -0.26 0.00 -0.40 0.00 0.00 0.00 179.25 179.28 2c3y n ASP 662 N -4.46 2.61 0.00 0.00 3.85 -1.26 -4.94 116.55 112.35 2c3y n ASP 662 Ca 0.12 -1.98 0.00 0.00 -0.71 0.00 0.00 54.79 52.21 2c3y n ASP 662 Cb 0.45 -0.31 0.00 0.00 -1.35 0.00 0.00 41.12 39.91 2c3y n ASP 662 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2c3y n GLY 663 N 1.29 0.46 3.78 6.12 0.00 -0.37 -4.81 105.19 111.66 2c3y n GLY 663 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2c3y n GLY 663 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2c3y s ARG 664 N -0.42 3.18 0.16 1.61 1.70 -1.26 -4.92 118.95 119.00 2c3y s ARG 664 Ca 0.00 1.49 0.07 0.00 -0.47 0.00 0.00 55.73 56.82 2c3y s ARG 664 Cb 0.00 -1.99 -0.04 0.00 -0.57 0.00 0.00 34.95 32.35 2c3y s ARG 664 CO 0.00 -0.96 -0.15 -0.06 -1.08 0.00 0.00 175.30 173.04 2c3y s PHE 665 N -2.03 1.61 0.58 5.89 0.40 -1.26 -4.53 117.98 118.63 2c3y s PHE 665 Ca 0.70 -0.54 -0.08 0.00 -0.60 0.00 0.00 56.93 56.41 2c3y s PHE 665 Cb -0.22 -0.80 -0.02 0.00 0.51 0.00 0.00 43.02 42.49 2c3y s PHE 665 CO 0.32 0.25 0.92 -1.25 0.70 0.00 0.00 175.22 176.17 2c3y s PRO 666 N -2.99 3.31 0.64 0.24 0.04 -1.26 -5.07 135.00 129.92 2c3y s PRO 666 Ca 0.15 0.33 -0.11 0.00 0.04 0.00 0.00 61.00 61.40 2c3y s PRO 666 Cb -0.04 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 2c3y s PRO 666 CO 0.05 -0.54 1.04 -0.51 0.04 0.00 0.00 177.00 177.08 2c3y s LEU 667 N -5.00 3.17 -1.09 -3.56 1.02 -1.26 -4.44 118.68 107.52 2c3y s LEU 667 Ca 0.52 1.43 0.00 0.00 0.02 0.00 0.00 54.13 56.11 2c3y s LEU 667 Cb -0.11 -4.42 0.00 0.00 0.02 0.00 0.00 46.19 41.68 2c3y s LEU 667 CO 0.48 -1.04 0.00 0.61 0.02 0.00 0.00 176.35 176.42 2c3y n GLY 668 N -2.61 0.89 0.20 -3.19 0.00 0.22 -4.86 105.19 95.83 2c3y n GLY 668 Ca 0.06 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.72 2c3y n GLY 668 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2c3y h THR 669 N 0.00 0.00 0.00 2.61 1.35 -1.69 -2.79 112.91 112.39 2c3y h THR 669 Ca -0.23 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 2c3y h THR 669 Cb 0.82 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2c3y h THR 669 CO 0.32 0.00 0.00 0.77 -0.25 0.00 0.00 175.52 176.36 2c3y h SER 670 N 0.00 0.00 -0.24 5.36 4.64 -1.84 -3.18 113.55 118.30 2c3y h SER 670 Ca 0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 2c3y h SER 670 Cb 0.55 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 2c3y h SER 670 CO 0.00 0.00 0.22 1.56 -0.87 0.00 0.00 176.83 177.74 2c3y h GLN 671 N 0.00 0.00 -0.07 4.77 1.08 -1.78 -2.51 115.11 116.60 2c3y h GLN 671 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2c3y h GLN 671 Cb 0.54 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.97 2c3y h GLN 671 CO 0.00 0.00 0.00 1.19 -0.95 0.00 0.00 178.83 179.07 2c3y n PHE 672 N -4.03 0.07 -0.10 2.96 3.01 -1.20 -4.62 117.46 113.55 2c3y n PHE 672 Ca 0.03 -0.05 -0.12 0.00 1.01 0.00 0.00 57.45 58.32 2c3y n PHE 672 Cb 0.36 -0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.79 2c3y n PHE 672 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2c3y h GLU 673 N 3.59 0.61 -7.15 -1.08 5.08 -1.61 -3.47 114.58 110.54 2c3y h GLU 673 Ca 0.00 -0.26 -0.37 0.00 -1.00 0.00 0.00 59.36 57.74 2c3y h GLU 673 Cb 0.78 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 2c3y h GLU 673 CO 0.00 0.83 -0.61 1.63 -1.00 0.00 0.00 179.01 179.86 2c3y n LYS 674 N -4.43 -0.54 -0.34 2.33 4.76 -1.26 -4.82 118.16 113.87 2c3y n LYS 674 Ca -0.03 -0.18 -0.02 0.00 -2.87 0.00 0.00 58.31 55.21 2c3y n LYS 674 Cb 0.36 -1.09 0.11 0.00 -1.84 0.00 0.00 35.03 32.56 2c3y n LYS 674 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2c3y h ARG 675 N -0.37 1.15 -5.75 1.97 3.08 -1.91 -3.47 114.38 109.09 2c3y h ARG 675 Ca -0.43 -0.07 -0.34 0.00 0.07 0.00 0.00 59.98 59.21 2c3y h ARG 675 Cb 0.85 -0.26 0.14 0.00 0.08 0.00 0.00 29.97 30.78 2c3y h ARG 675 CO 0.31 0.76 -0.81 0.41 -1.07 0.00 0.00 179.97 179.58 2c3y n GLY 676 N -1.35 -0.51 0.94 0.04 0.00 0.16 -4.92 105.19 99.55 2c3y n GLY 676 Ca 0.11 0.21 0.11 0.00 0.00 0.00 0.00 46.02 46.44 2c3y n GLY 676 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2c3y n VAL 677 N -4.01 0.20 -2.32 1.61 0.24 -1.26 -4.97 118.33 107.82 2c3y n VAL 677 Ca -0.25 -0.60 -0.37 0.00 -2.04 0.00 0.00 64.34 61.08 2c3y n VAL 677 Cb 0.66 1.26 -0.02 0.00 -1.47 0.00 0.00 33.84 34.28 2c3y n VAL 677 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c3y s ALA 678 N -1.64 2.99 -0.18 2.33 0.00 -1.26 -4.94 121.76 119.06 2c3y s ALA 678 Ca 0.29 0.88 -0.24 0.00 0.00 0.00 0.00 51.96 52.89 2c3y s ALA 678 Cb 0.19 -3.36 -0.21 0.00 0.00 0.00 0.00 23.12 19.74 2c3y s ALA 678 CO 0.28 -0.56 0.42 0.82 0.00 0.00 0.00 175.76 176.72 2c3y h ILE 679 N 1.92 1.24 -4.24 0.00 1.08 -1.91 -3.43 117.51 112.17 2c3y h ILE 679 Ca -0.49 -2.21 -0.65 0.00 -0.39 0.00 0.00 64.86 61.12 2c3y h ILE 679 Cb 1.24 2.62 -0.26 0.00 -3.07 0.00 0.00 36.82 37.35 2c3y h ILE 679 CO 0.61 0.42 -0.87 0.20 -0.69 0.00 0.00 178.15 177.82 2c3y s ASN 680 N -6.57 2.90 0.17 1.72 0.01 -1.26 -1.20 114.94 110.71 2c3y s ASN 680 Ca -0.24 -0.57 0.04 0.00 -0.71 0.00 0.00 52.86 51.38 2c3y s ASN 680 Cb 0.02 -0.25 -0.05 0.00 0.41 0.00 0.00 41.25 41.38 2c3y s ASN 680 CO 0.62 0.22 -0.07 0.68 -1.51 0.00 0.00 177.10 177.03 2c3y s VAL 681 N -0.81 1.10 0.43 1.60 -7.23 0.77 -3.93 120.40 112.33 2c3y s VAL 681 Ca 0.10 -2.05 -0.22 0.00 -1.81 0.00 0.00 61.98 58.00 2c3y s VAL 681 Cb -0.10 -1.97 -0.09 0.00 0.56 0.00 0.00 36.38 34.78 2c3y s VAL 681 CO 0.02 -0.64 1.01 -2.16 -0.31 0.00 0.00 175.10 173.02 2c3y s PRO 682 N -3.78 4.07 -0.16 4.82 0.04 -1.26 -0.07 135.00 138.66 2c3y s PRO 682 Ca 0.20 1.34 0.01 0.00 0.04 0.00 0.00 61.00 62.59 2c3y s PRO 682 Cb 0.03 -2.30 0.01 0.00 0.04 0.00 0.00 34.50 32.29 2c3y s PRO 682 CO 0.02 -0.20 -0.18 -1.14 0.04 0.00 0.00 177.00 175.55 2c3y s GLN 683 N -2.92 3.11 0.20 4.56 0.74 0.10 -4.86 119.66 120.60 2c3y s GLN 683 Ca 0.62 -0.80 -0.30 0.00 0.05 0.00 0.00 55.36 54.93 2c3y s GLN 683 Cb -0.16 -2.57 -0.08 0.00 1.10 0.00 0.00 33.01 31.30 2c3y s GLN 683 CO 0.21 -0.05 1.07 -0.46 -0.55 0.00 0.00 175.29 175.50 2c3y s TRP 684 N 0.95 3.65 -0.59 1.67 -0.00 -1.26 -1.67 118.94 121.69 2c3y s TRP 684 Ca -0.03 1.67 0.04 0.00 -0.00 0.00 0.00 56.10 57.78 2c3y s TRP 684 Cb -0.15 -3.22 0.15 0.00 -0.00 0.00 0.00 33.47 30.25 2c3y s TRP 684 CO -0.04 -0.40 0.38 0.08 -0.00 0.00 0.00 176.95 176.97 2c3y s VAL 685 N -0.52 2.39 0.40 5.86 1.01 0.13 -4.97 120.40 124.70 2c3y s VAL 685 Ca 0.47 -3.65 0.22 0.00 0.00 0.00 0.00 61.98 59.02 2c3y s VAL 685 Cb -0.29 -2.61 0.41 0.00 0.00 0.00 0.00 36.38 33.90 2c3y s VAL 685 CO 0.35 -0.96 1.70 1.55 0.00 0.00 0.00 175.10 177.74 2c3y h PRO 686 N 5.89 0.26 -0.04 2.72 0.13 -1.95 -1.49 132.00 137.53 2c3y h PRO 686 Ca 0.07 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.20 2c3y h PRO 686 Cb 0.83 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 2c3y h PRO 686 CO 0.65 0.17 0.06 0.93 -0.23 0.00 0.00 178.00 179.58 2c3y h GLU 687 N 0.27 0.00 -0.00 0.86 3.07 -1.96 -2.08 114.58 114.74 2c3y h GLU 687 Ca 0.70 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.56 2c3y h GLU 687 Cb 1.92 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.83 2c3y h GLU 687 CO -0.40 0.00 -0.73 0.09 -1.40 0.00 0.00 179.01 176.56 2c3y n ASN 688 N -3.54 0.79 -4.71 1.42 5.03 -0.57 -5.00 115.26 108.67 2c3y n ASN 688 Ca -0.02 -0.89 -0.42 0.00 0.87 0.00 0.00 54.58 54.12 2c3y n ASN 688 Cb 0.15 0.98 -0.03 0.00 -1.02 0.00 0.00 39.78 39.85 2c3y n ASN 688 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2c3y n ILE 690 N 4.02 0.96 -3.70 0.00 -5.35 -1.26 -4.97 119.36 109.05 2c3y n ILE 690 Ca 0.11 -0.97 -0.22 0.00 -0.27 0.00 0.00 62.75 61.41 2c3y n ILE 690 Cb 0.43 0.50 0.03 0.00 -1.74 0.00 0.00 39.64 38.86 2c3y n ILE 690 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c3y n GLN 691 N 1.62 -5.01 0.06 6.28 6.02 -1.26 -4.92 117.38 120.17 2c3y n GLN 691 Ca 0.24 0.63 0.11 0.00 -0.01 0.00 0.00 57.00 57.97 2c3y n GLN 691 Cb 0.61 -5.22 -0.03 0.00 1.02 0.00 0.00 30.24 26.62 2c3y n GLN 691 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2c3y n ASN 693 N -2.42 -4.48 0.12 0.00 5.03 -1.26 -4.40 115.26 107.85 2c3y n ASN 693 Ca -0.01 0.05 -0.01 0.00 0.87 0.00 0.00 54.58 55.49 2c3y n ASN 693 Cb 0.53 -2.15 0.26 0.00 -1.02 0.00 0.00 39.78 37.39 2c3y n ASN 693 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 2c3y h GLN 694 N 0.40 0.16 -0.11 3.52 4.20 -1.93 -2.75 115.11 118.60 2c3y h GLN 694 Ca -0.04 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 2c3y h GLN 694 Cb 0.54 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 2c3y h GLN 694 CO 0.06 0.55 0.06 0.00 -0.67 0.00 0.00 178.83 178.83 2c3y h ALA 696 N 0.94 1.33 -0.47 0.00 0.00 -1.85 -2.73 119.26 116.48 2c3y h ALA 696 Ca 0.04 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2c3y h ALA 696 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2c3y h ALA 696 CO -0.01 0.50 0.08 0.35 0.00 0.00 0.00 179.25 180.18 2c3y h PHE 697 N 0.82 0.74 0.00 0.00 3.57 -1.28 -3.15 116.94 117.65 2c3y h PHE 697 Ca 0.20 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2c3y h PHE 697 Cb 0.16 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.68 2c3y h PHE 697 CO 0.01 0.66 -0.55 0.28 -2.23 0.00 0.00 178.31 176.48 2c3y h VAL 698 N 0.69 0.00 -2.59 1.41 2.07 -1.14 -3.47 116.25 113.23 2c3y h VAL 698 Ca 0.15 -0.53 -0.53 0.00 0.82 0.00 0.00 66.70 66.61 2c3y h VAL 698 Cb 0.31 1.17 0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2c3y h VAL 698 CO 0.00 0.00 1.08 0.00 0.02 0.00 0.00 177.57 178.67 2c3y n PRO 700 N 6.00 0.42 0.00 0.00 -0.02 -1.26 -3.54 135.00 136.60 2c3y n PRO 700 Ca 0.17 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2c3y n PRO 700 Cb 0.40 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 2c3y n PRO 700 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2c3y n HIS 701 N -1.20 0.00 -2.60 6.00 8.25 -1.26 -4.61 115.22 119.80 2c3y n HIS 701 Ca 0.12 -0.11 -0.18 0.00 -0.26 0.00 0.00 57.72 57.29 2c3y n HIS 701 Cb 0.14 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.25 2c3y n HIS 701 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2c3y n SER 702 N -0.11 -5.35 -0.17 0.41 2.88 -1.23 -1.78 113.62 108.27 2c3y n SER 702 Ca 0.00 -0.12 0.12 0.00 -1.33 0.00 0.00 58.87 57.53 2c3y n SER 702 Cb 0.36 -4.31 0.61 0.00 -0.75 0.00 0.00 64.21 60.12 2c3y n SER 702 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2c3y n ALA 703 N -2.53 2.61 -3.75 -1.46 0.00 -1.26 -4.71 120.51 109.41 2c3y n ALA 703 Ca -0.16 -0.26 -0.33 0.00 0.00 0.00 0.00 53.44 52.70 2c3y n ALA 703 Cb 0.64 -1.30 -0.16 0.00 0.00 0.00 0.00 19.45 18.63 2c3y n ALA 703 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2c3y s ILE 704 N -1.96 2.10 -0.33 0.00 1.01 -1.26 -0.27 121.20 120.49 2c3y s ILE 704 Ca 0.35 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 60.06 2c3y s ILE 704 Cb 0.17 -1.85 0.09 0.00 0.01 0.00 0.00 42.46 40.88 2c3y s ILE 704 CO 0.28 0.55 0.04 -0.22 0.00 0.00 0.00 174.94 175.58 2c3y s LEU 705 N 0.92 4.47 0.28 2.97 2.96 -0.45 -4.78 118.68 125.04 2c3y s LEU 705 Ca -0.04 -1.88 -0.29 0.00 -0.22 0.00 0.00 54.13 51.69 2c3y s LEU 705 Cb -0.15 -1.65 -0.10 0.00 0.50 0.00 0.00 46.19 44.79 2c3y s LEU 705 CO -0.04 -0.35 1.26 -2.84 -1.32 0.00 0.00 176.35 173.06 2c3y s PRO 706 N 1.02 4.43 -0.17 0.98 0.02 -1.26 -1.71 135.00 138.31 2c3y s PRO 706 Ca 0.04 2.07 0.01 0.00 0.02 0.00 0.00 61.00 63.15 2c3y s PRO 706 Cb -0.20 -3.14 0.01 0.00 0.02 0.00 0.00 34.50 31.20 2c3y s PRO 706 CO -0.06 -0.12 -0.19 0.08 -0.33 0.00 0.00 177.00 176.38 2c3y s VAL 707 N -0.75 2.20 -0.27 3.83 1.01 0.18 -4.93 120.40 121.66 2c3y s VAL 707 Ca 0.50 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.60 2c3y s VAL 707 Cb -0.37 -1.91 0.07 0.00 0.00 0.00 0.00 36.38 34.17 2c3y s VAL 707 CO 0.46 0.53 -0.06 -0.22 0.00 0.00 0.00 175.10 175.81 2c3y s LEU 708 N 1.10 3.57 0.06 3.92 2.96 -1.26 -1.27 118.68 127.75 2c3y s LEU 708 Ca 0.00 -1.53 0.02 0.00 -0.22 0.00 0.00 54.13 52.40 2c3y s LEU 708 Cb -0.14 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 45.03 2c3y s LEU 708 CO -0.07 -0.24 -0.07 0.00 -1.32 0.00 0.00 176.35 174.64 2c3y s ALA 709 N 1.12 0.68 0.45 5.97 0.00 -0.18 -4.64 121.76 125.15 2c3y s ALA 709 Ca -0.04 -0.92 -0.19 0.00 0.00 0.00 0.00 51.96 50.81 2c3y s ALA 709 Cb -0.20 0.08 -0.10 0.00 0.00 0.00 0.00 23.12 22.90 2c3y s ALA 709 CO -0.06 -0.08 0.94 0.15 0.00 0.00 0.00 175.76 176.71 2c3y s LYS 710 N -2.18 4.13 0.00 0.00 1.02 -1.26 0.42 119.74 121.86 2c3y s LYS 710 Ca -0.04 1.03 0.00 0.00 0.02 0.00 0.00 55.97 56.98 2c3y s LYS 710 Cb -0.06 -2.19 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 2c3y s LYS 710 CO -0.01 -0.08 0.00 0.39 -0.92 0.00 0.00 175.35 174.73 2c3y n GLU 711 N -0.89 0.00 0.00 1.68 1.02 -1.26 -0.25 120.64 120.93 2c3y n GLU 711 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 2c3y n GLU 711 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.96 2c3y n GLU 711 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2c3y n GLU 712 N 0.00 0.00 0.00 3.49 0.00 -1.26 -0.96 120.64 121.90 2c3y n GLU 712 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2c3y n GLU 712 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 2c3y n GLU 712 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2c3y n GLU 713 N 0.00 0.00 -0.64 5.31 1.02 0.65 -3.56 120.64 123.42 2c3y n GLU 713 Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.23 2c3y n GLU 713 Cb 0.00 -3.67 0.36 0.00 -0.02 0.00 0.00 31.44 28.12 2c3y n GLU 713 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2c3y n LEU 714 N 0.00 4.86 0.22 -4.62 4.32 -0.14 -4.69 117.00 116.95 2c3y n LEU 714 Ca 0.00 -2.49 -0.12 0.00 -0.02 0.00 0.00 56.01 53.38 2c3y n LEU 714 Cb 0.00 -0.59 -0.06 0.00 -1.62 0.00 0.00 43.42 41.15 2c3y n LEU 714 CO 0.00 0.80 0.52 0.58 -1.22 0.00 0.00 177.39 178.07 2c3y h VAL 715 N 4.08 0.00 -0.00 4.08 2.07 -1.66 -2.83 116.25 121.98 2c3y h VAL 715 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2c3y h VAL 715 Cb 1.50 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2c3y h VAL 715 CO 0.25 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.45 2c3y n GLY 716 N -1.37 -0.97 3.59 2.17 0.00 -1.26 -4.92 105.19 102.42 2c3y n GLY 716 Ca -0.08 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 2c3y n GLY 716 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y n ALA 717 N -0.80 -0.04 -1.28 4.61 0.00 -1.07 -4.91 120.51 117.02 2c3y n ALA 717 Ca 0.16 0.19 -0.35 0.00 0.00 0.00 0.00 53.44 53.43 2c3y n ALA 717 Cb 0.08 -2.04 0.09 0.00 0.00 0.00 0.00 19.45 17.57 2c3y n ALA 717 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2c3y n PRO 718 N 0.07 0.38 -0.11 0.00 -0.02 -1.26 -4.88 135.00 129.19 2c3y n PRO 718 Ca 0.10 0.19 0.09 0.00 -2.02 0.00 0.00 63.50 61.86 2c3y n PRO 718 Cb 0.40 -2.15 0.45 0.00 -0.02 0.00 0.00 33.50 32.17 2c3y n PRO 718 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c3y h ALA 719 N -0.43 1.88 -0.54 3.55 0.00 -1.99 -1.73 119.26 120.01 2c3y h ALA 719 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2c3y h ALA 719 Cb 1.33 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2c3y h ALA 719 CO 0.45 -0.00 0.00 0.27 0.00 0.00 0.00 179.25 179.97 2c3y n ASN 720 N -4.48 5.31 -3.54 0.00 2.04 -1.26 -4.67 115.26 108.66 2c3y n ASN 720 Ca 0.09 -2.82 -0.41 0.00 -0.44 0.00 0.00 54.58 51.01 2c3y n ASN 720 Cb 0.30 -0.66 -0.01 0.00 -2.53 0.00 0.00 39.78 36.87 2c3y n ASN 720 CO 0.00 0.00 0.00 0.33 -0.44 0.00 0.00 177.26 177.15 2c3y n PHE 721 N 0.63 2.87 -1.74 -2.53 7.35 -0.65 -4.95 117.46 118.45 2c3y n PHE 721 Ca 0.26 -2.98 -0.42 0.00 -0.76 0.00 0.00 57.45 53.55 2c3y n PHE 721 Cb 1.10 -2.35 -0.03 0.00 0.35 0.00 0.00 39.48 38.56 2c3y n PHE 721 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 2c3y s THR 722 N 1.77 2.39 0.08 -2.13 2.01 -1.26 -4.94 115.64 113.55 2c3y s THR 722 Ca 0.56 0.08 0.06 0.00 0.31 0.00 0.00 61.69 62.70 2c3y s THR 722 Cb 0.16 -3.05 -0.03 0.00 0.01 0.00 0.00 72.50 69.58 2c3y s THR 722 CO -0.07 0.00 -0.15 0.00 -0.69 0.00 0.00 174.62 173.71 2c3y s ALA 723 N 2.13 1.29 0.25 7.40 0.00 -1.26 -4.76 121.76 126.81 2c3y s ALA 723 Ca 0.78 -1.05 0.07 0.00 0.00 0.00 0.00 51.96 51.76 2c3y s ALA 723 Cb -0.47 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 2c3y s ALA 723 CO 0.34 0.20 0.19 -0.51 0.00 0.00 0.00 175.76 175.99 2c3y s LEU 724 N -1.79 3.82 0.07 0.00 1.43 0.17 -4.85 118.68 117.53 2c3y s LEU 724 Ca -0.00 -0.24 -0.31 0.00 -1.03 0.00 0.00 54.13 52.55 2c3y s LEU 724 Cb -0.10 -2.36 -0.07 0.00 0.03 0.00 0.00 46.19 43.69 2c3y s LEU 724 CO 0.03 -0.03 1.46 -1.61 0.23 0.00 0.00 176.35 176.43 2c3y s GLU 725 N -3.79 4.27 0.24 1.70 0.41 -1.26 0.36 118.70 120.64 2c3y s GLU 725 Ca 0.33 2.11 -0.31 0.00 -0.41 0.00 0.00 54.97 56.69 2c3y s GLU 725 Cb -0.08 -3.43 -0.11 0.00 -1.78 0.00 0.00 34.13 28.73 2c3y s GLU 725 CO 0.25 -0.56 1.57 0.00 -0.49 0.00 0.00 175.26 176.03 2c3y s ALA 726 N 1.89 3.75 0.24 5.21 0.00 0.08 -4.73 121.76 128.19 2c3y s ALA 726 Ca 0.67 1.48 -0.10 0.00 0.00 0.00 0.00 51.96 54.00 2c3y s ALA 726 Cb -0.36 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.06 2c3y s ALA 726 CO 0.29 -0.88 0.56 0.15 0.00 0.00 0.00 175.76 175.89 2c3y s LYS 727 N 0.10 3.82 0.00 0.00 1.02 -1.26 -4.63 119.74 118.79 2c3y s LYS 727 Ca 0.65 0.31 0.00 0.00 0.02 0.00 0.00 55.97 56.95 2c3y s LYS 727 Cb -0.46 -2.63 0.00 0.00 -0.52 0.00 0.00 37.83 34.22 2c3y s LYS 727 CO 0.41 0.31 0.00 0.41 -0.92 0.00 0.00 175.35 175.56 2c3y n GLY 728 N -0.14 2.78 0.33 -3.33 0.00 -1.26 -4.59 105.19 98.98 2c3y n GLY 728 Ca 0.01 -1.53 -0.00 0.00 0.00 0.00 0.00 46.02 44.49 2c3y n GLY 728 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2c3y h LYS 729 N 0.00 0.89 -0.10 1.61 3.11 -1.96 -2.02 116.57 118.09 2c3y h LYS 729 Ca 0.00 -0.09 -0.15 0.00 -2.81 0.00 0.00 60.65 57.60 2c3y h LYS 729 Cb 0.00 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 31.04 2c3y h LYS 729 CO 0.00 0.64 -0.60 0.93 -2.81 0.00 0.00 179.45 177.61 2c3y h GLU 730 N 0.90 0.34 -0.63 1.90 3.07 -1.96 -2.93 114.58 115.27 2c3y h GLU 730 Ca 0.23 -0.23 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2c3y h GLU 730 Cb 0.01 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 2c3y h GLU 730 CO -0.04 0.84 0.00 1.28 -1.40 0.00 0.00 179.01 179.69 2c3y n LEU 731 N -3.89 3.93 0.00 1.33 4.77 -1.04 -4.83 117.00 117.26 2c3y n LEU 731 Ca -0.03 -1.98 0.00 0.00 -0.03 0.00 0.00 56.01 53.97 2c3y n LEU 731 Cb 0.62 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2c3y n LEU 731 CO 0.45 0.63 0.00 2.29 -1.33 0.00 0.00 177.39 179.44 2c3y n LYS 732 N 0.78 0.00 -0.69 3.23 -0.00 -0.79 -1.28 118.16 119.41 2c3y n LYS 732 Ca 0.20 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.58 2c3y n LYS 732 Cb 0.76 0.00 0.33 0.00 -0.00 0.00 0.00 35.03 36.12 2c3y n LYS 732 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2c3y n GLY 733 N -0.68 2.62 3.95 2.58 0.00 -1.26 -4.66 105.19 107.73 2c3y n GLY 733 Ca 0.00 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 45.03 2c3y n GLY 733 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c3y s TYR 734 N -2.30 2.88 -0.11 1.61 1.51 -0.41 -4.63 117.35 115.91 2c3y s TYR 734 Ca 0.45 0.26 0.00 0.00 -1.01 0.00 0.00 57.07 56.77 2c3y s TYR 734 Cb 0.33 -3.03 -0.02 0.00 -0.11 0.00 0.00 41.96 39.13 2c3y s TYR 734 CO 0.15 -1.21 -0.12 0.15 -1.11 0.00 0.00 175.55 173.41 2c3y s LYS 735 N -5.06 3.17 -0.06 -0.62 -0.14 0.17 -0.74 119.74 116.45 2c3y s LYS 735 Ca 0.59 -0.66 0.02 0.00 -1.36 0.00 0.00 55.97 54.56 2c3y s LYS 735 Cb -0.11 -2.60 -0.03 0.00 -1.68 0.00 0.00 37.83 33.42 2c3y s LYS 735 CO 0.42 0.34 -0.12 0.12 -0.76 0.00 0.00 175.35 175.35 2c3y s PHE 736 N 0.03 2.77 -0.20 3.18 5.36 0.16 -1.01 117.98 128.27 2c3y s PHE 736 Ca -0.04 -0.16 -0.17 0.00 -0.96 0.00 0.00 56.93 55.60 2c3y s PHE 736 Cb -0.14 -1.67 0.05 0.00 -0.34 0.00 0.00 43.02 40.92 2c3y s PHE 736 CO 0.04 0.18 0.51 0.50 -1.46 0.00 0.00 175.22 174.99 2c3y s ARG 737 N -0.63 0.59 -0.43 10.12 3.52 -0.40 0.42 118.95 132.13 2c3y s ARG 737 Ca 0.09 0.75 -0.16 0.00 -0.13 0.00 0.00 55.73 56.28 2c3y s ARG 737 Cb -0.11 0.25 0.03 0.00 -1.56 0.00 0.00 34.95 33.56 2c3y s ARG 737 CO 0.01 -0.08 0.38 0.42 -0.81 0.00 0.00 175.30 175.22 2c3y s ILE 738 N 0.46 5.18 -0.28 4.11 -1.09 -1.26 0.52 121.20 128.84 2c3y s ILE 738 Ca -0.01 -0.63 -0.13 0.00 -2.23 0.00 0.00 60.65 57.64 2c3y s ILE 738 Cb -0.04 -4.02 -0.04 0.00 -1.58 0.00 0.00 42.46 36.78 2c3y s ILE 738 CO -0.02 -0.42 0.30 -1.58 -1.23 0.00 0.00 174.94 171.99 2c3y s GLN 739 N 1.86 3.94 0.05 2.79 2.00 -0.70 -4.86 119.66 124.75 2c3y s GLN 739 Ca 0.08 -0.15 -0.26 0.00 -2.00 0.00 0.00 55.36 53.02 2c3y s GLN 739 Cb -0.19 -3.68 -0.05 0.00 0.80 0.00 0.00 33.01 29.89 2c3y s GLN 739 CO 0.11 -0.27 0.82 0.42 -0.50 0.00 0.00 175.29 175.86 2c3y s ILE 740 N 1.95 4.70 -0.89 -2.34 -1.09 -1.26 -1.34 121.20 120.93 2c3y s ILE 740 Ca 0.12 1.75 -0.12 0.00 -2.23 0.00 0.00 60.65 60.16 2c3y s ILE 740 Cb -0.16 -4.17 0.23 0.00 -1.58 0.00 0.00 42.46 36.78 2c3y s ILE 740 CO 0.11 0.34 0.83 0.21 -1.23 0.00 0.00 174.94 175.20 2c3y s ASN 741 N 0.06 6.82 0.56 3.58 3.04 0.63 -4.71 114.94 124.92 2c3y s ASN 741 Ca 0.41 -2.93 0.36 0.00 0.04 0.00 0.00 52.86 50.74 2c3y s ASN 741 Cb -0.21 -2.19 1.70 0.00 -1.54 0.00 0.00 41.25 39.01 2c3y s ASN 741 CO 0.25 -0.49 2.08 0.71 -3.04 0.00 0.00 177.10 176.61 2c3y h THR 742 N 4.52 0.00 0.00 -5.21 1.35 -1.87 -0.93 112.91 110.77 2c3y h THR 742 Ca 0.12 -0.29 -0.16 0.00 -0.55 0.00 0.00 66.41 65.53 2c3y h THR 742 Cb 0.99 1.24 -0.03 0.00 -1.73 0.00 0.00 68.15 68.63 2c3y h THR 742 CO 0.81 0.00 -1.31 -0.07 -0.25 0.00 0.00 175.52 174.70 2c3y h LEU 743 N 0.00 0.00 0.00 3.87 3.38 -1.93 -3.35 115.31 117.28 2c3y h LEU 743 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2c3y h LEU 743 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2c3y h LEU 743 CO 0.00 0.58 -1.28 0.47 0.09 0.00 0.00 178.44 178.30 2c3y n ASP 744 N -2.93 0.55 -4.76 -0.43 8.00 -1.10 0.39 116.55 116.27 2c3y n ASP 744 Ca -0.08 -0.33 -0.39 0.00 0.71 0.00 0.00 54.79 54.70 2c3y n ASP 744 Cb 0.83 1.15 0.03 0.00 -0.02 0.00 0.00 41.12 43.11 2c3y n ASP 744 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c3y n MET 746 N -0.60 1.25 -1.06 0.00 2.81 -1.26 -4.03 117.12 114.22 2c3y n MET 746 Ca 0.08 -1.44 -0.02 0.00 -1.81 0.00 0.00 57.70 54.50 2c3y n MET 746 Cb 0.43 -1.31 -0.01 0.00 -0.71 0.00 0.00 33.22 31.63 2c3y n MET 746 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c3y n GLY 747 N 0.91 0.56 0.34 3.03 0.00 -1.25 -4.59 105.19 104.19 2c3y n GLY 747 Ca 0.09 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.51 2c3y n GLY 747 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y n GLY 749 N -0.92 0.66 0.20 0.00 0.00 -1.26 -3.23 105.19 100.64 2c3y n GLY 749 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.07 2c3y n GLY 749 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2c3y h ASN 750 N 0.00 0.21 -0.08 1.61 4.21 -1.86 -1.81 115.58 117.86 2c3y h ASN 750 Ca 0.00 0.06 0.04 0.00 1.21 0.00 0.00 56.30 57.60 2c3y h ASN 750 Cb 0.00 0.03 -0.04 0.00 -1.12 0.00 0.00 38.32 37.19 2c3y h ASN 750 CO 0.00 0.15 -0.16 0.00 -1.29 0.00 0.00 177.43 176.13 2c3y h ALA 752 N 0.79 1.34 -0.12 0.00 0.00 -1.80 -0.27 119.26 119.20 2c3y h ALA 752 Ca 0.08 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2c3y h ALA 752 Cb 0.33 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2c3y h ALA 752 CO -0.21 0.47 -0.25 0.22 0.00 0.00 0.00 179.25 179.48 2c3y h ASP 753 N 0.65 0.21 0.58 0.00 3.58 -0.81 -3.17 116.42 117.46 2c3y h ASP 753 Ca 0.15 -0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 2c3y h ASP 753 Cb 0.26 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 2c3y h ASP 753 CO -0.00 0.46 -1.45 -0.38 -2.88 0.00 0.00 179.24 174.99 2c3y n ILE 754 N -4.17 0.54 -1.58 2.25 -0.00 -0.61 -4.93 119.36 110.86 2c3y n ILE 754 Ca -0.01 -0.57 -0.59 0.00 -0.00 0.00 0.00 62.75 61.58 2c3y n ILE 754 Cb 0.35 -0.29 -0.09 0.00 -0.00 0.00 0.00 39.64 39.61 2c3y n ILE 754 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2c3y h PRO 756 N 8.14 -0.36 -6.77 0.00 0.11 -1.91 -3.45 132.00 127.75 2c3y h PRO 756 Ca -0.35 0.02 -0.55 0.00 0.11 0.00 0.00 66.00 65.23 2c3y h PRO 756 Cb 1.35 0.08 0.10 0.00 0.11 0.00 0.00 31.00 32.64 2c3y h PRO 756 CO 1.00 -0.24 0.72 -0.35 -0.21 0.00 0.00 178.00 178.93 2c3y n PRO 757 N -5.42 2.44 -0.30 1.05 -0.04 -1.26 -4.88 135.00 126.59 2c3y n PRO 757 Ca -0.02 0.86 0.04 0.00 -0.04 0.00 0.00 63.50 64.35 2c3y n PRO 757 Cb 0.35 -2.57 0.19 0.00 -0.04 0.00 0.00 33.50 31.44 2c3y n PRO 757 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2c3y h LYS 758 N 3.78 0.72 -5.10 0.54 3.64 -1.96 -2.85 116.57 115.34 2c3y h LYS 758 Ca -0.47 -0.04 -0.68 0.00 -1.27 0.00 0.00 60.65 58.18 2c3y h LYS 758 Cb 1.25 -0.16 -0.17 0.00 -0.41 0.00 0.00 32.23 32.74 2c3y h LYS 758 CO 0.72 0.48 0.89 -1.21 -2.27 0.00 0.00 179.45 178.05 2c3y s GLU 759 N -6.01 3.60 0.29 1.90 0.41 -1.26 -4.98 118.70 112.64 2c3y s GLU 759 Ca -0.12 -1.72 -0.26 0.00 -0.41 0.00 0.00 54.97 52.46 2c3y s GLU 759 Cb 0.20 -4.95 -0.16 0.00 -1.78 0.00 0.00 34.13 27.44 2c3y s GLU 759 CO 0.78 -1.80 0.53 1.63 -0.49 0.00 0.00 175.26 175.91 2c3y n LYS 760 N 6.71 0.31 0.00 1.61 4.76 -1.08 -4.76 118.16 125.71 2c3y n LYS 760 Ca 0.25 0.11 0.11 0.00 -2.87 0.00 0.00 58.31 55.91 2c3y n LYS 760 Cb 0.49 -1.22 0.07 0.00 -1.84 0.00 0.00 35.03 32.53 2c3y n LYS 760 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2c3y n ALA 761 N -0.28 2.73 -3.72 7.82 0.00 -1.26 -4.80 120.51 121.00 2c3y n ALA 761 Ca 0.14 -0.67 -0.21 0.00 0.00 0.00 0.00 53.44 52.70 2c3y n ALA 761 Cb 0.31 -0.78 -0.17 0.00 0.00 0.00 0.00 19.45 18.81 2c3y n ALA 761 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2c3y s LEU 762 N -2.06 0.77 -0.05 0.00 1.43 -1.26 0.20 118.68 117.70 2c3y s LEU 762 Ca 0.25 -0.06 0.02 0.00 -1.03 0.00 0.00 54.13 53.30 2c3y s LEU 762 Cb 0.19 -0.36 0.02 0.00 0.03 0.00 0.00 46.19 46.07 2c3y s LEU 762 CO 0.36 -0.16 -0.08 -0.69 0.23 0.00 0.00 176.35 176.01 2c3y s VAL 763 N 1.63 0.78 0.14 -1.59 1.01 -0.67 -4.73 120.40 116.97 2c3y s VAL 763 Ca -0.01 -0.27 -0.31 0.00 0.00 0.00 0.00 61.98 61.39 2c3y s VAL 763 Cb -0.13 -0.76 -0.08 0.00 0.00 0.00 0.00 36.38 35.41 2c3y s VAL 763 CO -0.03 0.28 1.34 -0.04 0.00 0.00 0.00 175.10 176.64 2c3y s MET 764 N 0.80 4.36 0.07 2.72 -1.94 -1.26 0.03 119.30 124.08 2c3y s MET 764 Ca -0.13 2.03 0.01 0.00 -1.71 0.00 0.00 55.69 55.89 2c3y s MET 764 Cb -0.15 -3.24 -0.04 0.00 2.01 0.00 0.00 34.83 33.41 2c3y s MET 764 CO 0.02 -0.35 -0.05 -0.65 -0.01 0.00 0.00 175.02 173.97 2c3y s GLN 765 N 0.70 0.68 0.35 2.03 -1.52 0.91 -4.92 119.66 117.89 2c3y s GLN 765 Ca 0.61 -1.18 -0.29 0.00 -1.95 0.00 0.00 55.36 52.55 2c3y s GLN 765 Cb -0.36 -0.04 -0.11 0.00 -0.22 0.00 0.00 33.01 32.29 2c3y s GLN 765 CO 0.33 -0.05 1.53 -2.14 -0.25 0.00 0.00 175.29 174.70 2c3y s PRO 766 N -3.47 4.11 0.19 2.91 0.02 -1.26 -0.16 135.00 137.34 2c3y s PRO 766 Ca 0.06 2.58 -0.15 0.00 0.02 0.00 0.00 61.00 63.51 2c3y s PRO 766 Cb 0.04 -2.98 0.19 0.00 0.02 0.00 0.00 34.50 31.76 2c3y s PRO 766 CO -0.06 -0.57 1.64 1.25 -0.33 0.00 0.00 177.00 178.93 2c3y h LEU 767 N 3.60 -0.50 -2.40 -5.54 5.85 -1.43 -0.50 115.31 114.40 2c3y h LEU 767 Ca -0.50 0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.40 2c3y h LEU 767 Cb 1.23 0.34 -0.00 0.00 0.37 0.00 0.00 40.66 42.60 2c3y h LEU 767 CO 0.69 -0.18 0.20 -2.24 -0.34 0.00 0.00 178.44 176.57 2c3y h ASP 768 N 0.00 0.00 0.08 1.25 3.04 -1.90 0.32 116.42 119.21 2c3y h ASP 768 Ca 0.26 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.05 2c3y h ASP 768 Cb 0.40 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.69 2c3y h ASP 768 CO -0.56 0.00 -0.10 0.35 -2.04 0.00 0.00 179.24 176.89 2c3y n THR 769 N -3.08 0.00 0.00 1.15 -2.24 -0.20 -4.36 114.28 105.55 2c3y n THR 769 Ca -0.02 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2c3y n THR 769 Cb 0.26 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 2c3y n THR 769 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c3y n GLN 770 N -0.13 3.35 -0.21 -0.78 1.13 1.00 -4.87 117.38 116.86 2c3y n GLN 770 Ca 0.16 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.17 2c3y n GLN 770 Cb 0.35 -0.98 0.05 0.00 0.11 0.00 0.00 30.24 29.77 2c3y n GLN 770 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 2c3y h ARG 771 N 0.00 0.78 -0.98 -1.09 0.11 -1.43 -0.92 114.38 110.84 2c3y h ARG 771 Ca 0.00 -0.05 0.13 0.00 0.10 0.00 0.00 59.98 60.17 2c3y h ARG 771 Cb 0.96 -0.17 -0.08 0.00 1.11 0.00 0.00 29.97 31.78 2c3y h ARG 771 CO 0.00 0.51 0.62 -0.44 0.10 0.00 0.00 179.97 180.76 2c3y h ASP 772 N 0.80 0.86 0.11 0.08 3.32 -1.86 -0.99 116.42 118.73 2c3y h ASP 772 Ca 0.23 0.05 -0.29 0.00 0.02 0.00 0.00 57.03 57.05 2c3y h ASP 772 Cb -0.06 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2c3y h ASP 772 CO -0.07 0.44 -1.49 0.00 -1.72 0.00 0.00 179.24 176.40 2c3y h ALA 773 N 1.56 0.22 0.00 3.45 0.00 -1.88 -3.41 119.26 119.21 2c3y h ALA 773 Ca 0.50 -1.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 2c3y h ALA 773 Cb 0.57 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2c3y h ALA 773 CO -0.26 0.89 -0.19 1.96 0.00 0.00 0.00 179.25 181.64 2c3y h GLN 774 N -0.30 0.00 -0.21 0.00 1.08 -1.05 -3.15 115.11 111.48 2c3y h GLN 774 Ca -0.33 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 56.86 2c3y h GLN 774 Cb 1.77 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.19 2c3y h GLN 774 CO 0.04 0.05 0.07 0.28 -0.95 0.00 0.00 178.83 178.33 2c3y h VAL 775 N 0.00 1.18 -0.46 -0.54 2.07 -1.40 0.16 116.25 117.27 2c3y h VAL 775 Ca -0.00 -0.57 -0.08 0.00 0.82 0.00 0.00 66.70 66.87 2c3y h VAL 775 Cb 1.05 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 2c3y h VAL 775 CO 0.01 0.18 -0.03 -0.65 0.02 0.00 0.00 177.57 177.10 2c3y h PRO 776 N 0.17 0.76 -0.29 1.57 0.11 -1.78 -2.10 132.00 130.44 2c3y h PRO 776 Ca 0.07 -0.21 -0.09 0.00 0.11 0.00 0.00 66.00 65.88 2c3y h PRO 776 Cb 0.22 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 2c3y h PRO 776 CO -0.00 0.79 -0.19 -0.91 -0.21 0.00 0.00 178.00 177.48 2c3y h ASN 777 N 0.71 0.51 -0.19 -2.05 -0.26 -1.45 -2.27 115.58 110.59 2c3y h ASN 777 Ca 0.14 -0.15 -0.04 0.00 -0.56 0.00 0.00 56.30 55.68 2c3y h ASN 777 Cb 0.47 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 37.59 2c3y h ASN 777 CO 0.02 0.71 -0.03 0.25 -1.06 0.00 0.00 177.43 177.32 2c3y h LEU 778 N 0.47 0.35 -0.37 1.61 7.12 -0.36 0.14 115.31 124.27 2c3y h LEU 778 Ca 0.08 -0.35 0.06 0.00 0.13 0.00 0.00 57.88 57.80 2c3y h LEU 778 Cb 0.59 -0.09 -0.05 0.00 -0.53 0.00 0.00 40.66 40.57 2c3y h LEU 778 CO 0.04 0.62 0.04 -0.33 -0.13 0.00 0.00 178.44 178.68 2c3y h GLU 779 N 0.08 0.15 0.14 1.25 4.39 -1.20 0.49 114.58 119.86 2c3y h GLU 779 Ca 0.05 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2c3y h GLU 779 Cb 0.46 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2c3y h GLU 779 CO 0.02 0.10 -0.07 -0.92 -1.16 0.00 0.00 179.01 176.98 2c3y h TYR 780 N 0.15 -0.17 -0.82 4.33 3.20 -1.32 -2.97 116.97 119.38 2c3y h TYR 780 Ca 0.18 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.14 2c3y h TYR 780 Cb 0.23 0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.50 2c3y h TYR 780 CO -0.22 0.05 0.53 0.00 -1.64 0.00 0.00 178.16 176.88 2c3y h ALA 781 N 0.47 1.74 0.00 1.82 0.00 -0.67 -0.62 119.26 122.00 2c3y h ALA 781 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2c3y h ALA 781 Cb 0.29 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2c3y h ALA 781 CO 0.03 0.10 -0.03 0.00 0.00 0.00 0.00 179.25 179.35 2c3y h ALA 782 N 1.59 1.19 0.00 0.00 0.00 -0.74 -1.79 119.26 119.51 2c3y h ALA 782 Ca 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2c3y h ALA 782 Cb 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2c3y h ALA 782 CO -0.15 0.03 -0.73 0.54 0.00 0.00 0.00 179.25 178.95 2c3y n ARG 783 N -3.38 0.21 -2.42 0.00 1.74 -0.25 -4.88 116.66 107.67 2c3y n ARG 783 Ca -0.02 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.67 2c3y n ARG 783 Cb 0.14 -1.60 -0.03 0.00 -1.02 0.00 0.00 32.46 29.94 2c3y n ARG 783 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2c3y s ILE 784 N -3.13 4.00 0.20 0.55 1.01 -0.67 -4.96 121.20 118.19 2c3y s ILE 784 Ca 0.07 1.46 -0.33 0.00 0.00 0.00 0.00 60.65 61.85 2c3y s ILE 784 Cb 0.15 -3.93 -0.14 0.00 0.01 0.00 0.00 42.46 38.55 2c3y s ILE 784 CO 0.74 0.13 1.49 -2.65 0.00 0.00 0.00 174.94 174.65 2c3y n PRO 785 N 3.78 2.08 -2.45 2.79 -0.02 -1.26 -4.93 135.00 134.99 2c3y n PRO 785 Ca 0.08 0.75 -0.42 0.00 -2.02 0.00 0.00 63.50 61.89 2c3y n PRO 785 Cb 0.46 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 2c3y n PRO 785 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c3y s VAL 786 N 0.44 4.17 -1.30 -1.45 1.01 -1.26 -4.84 120.40 117.17 2c3y s VAL 786 Ca 0.74 1.53 -0.10 0.00 0.00 0.00 0.00 61.98 64.15 2c3y s VAL 786 Cb -0.67 -3.98 0.15 0.00 0.00 0.00 0.00 36.38 31.88 2c3y s VAL 786 CO 0.44 0.06 1.91 0.29 0.00 0.00 0.00 175.10 177.79 2c3y n LYS 787 N 4.56 3.51 0.09 2.72 4.76 -1.25 -4.76 118.16 127.78 2c3y n LYS 787 Ca 0.10 -3.42 0.12 0.00 -2.87 0.00 0.00 58.31 52.24 2c3y n LYS 787 Cb 0.46 -2.98 0.45 0.00 -1.84 0.00 0.00 35.03 31.13 2c3y n LYS 787 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2c3y n SER 788 N 4.24 0.53 -0.84 4.39 3.41 -1.00 -3.41 113.62 120.93 2c3y n SER 788 Ca 0.41 0.59 0.09 0.00 -0.26 0.00 0.00 58.87 59.70 2c3y n SER 788 Cb 0.37 -0.72 0.14 0.00 -0.26 0.00 0.00 64.21 63.74 2c3y n SER 788 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2c3y n GLU 789 N -2.04 1.97 0.12 4.33 4.71 -1.26 -4.55 120.64 123.91 2c3y n GLU 789 Ca 0.04 -1.87 -0.20 0.00 -0.01 0.00 0.00 57.16 55.12 2c3y n GLU 789 Cb 0.30 -1.38 -0.15 0.00 -1.01 0.00 0.00 31.44 29.20 2c3y n GLU 789 CO 0.00 0.00 0.00 -0.24 0.09 0.00 0.00 177.13 176.98 2c3y h VAL 790 N 3.52 1.36 -2.79 2.62 3.04 -1.94 -3.47 116.25 118.58 2c3y h VAL 790 Ca 0.00 -2.87 -0.47 0.00 -1.01 0.00 0.00 66.70 62.35 2c3y h VAL 790 Cb 0.81 2.97 -0.14 0.00 -2.01 0.00 0.00 31.29 32.91 2c3y h VAL 790 CO 0.00 0.85 -0.67 -0.76 -1.01 0.00 0.00 177.57 175.98 2c3y s LEU 791 N -7.32 2.43 0.18 3.16 1.43 -1.26 -4.95 118.68 112.35 2c3y s LEU 791 Ca -0.07 -1.19 -0.33 0.00 -1.03 0.00 0.00 54.13 51.51 2c3y s LEU 791 Cb 0.06 -0.56 -0.13 0.00 0.03 0.00 0.00 46.19 45.58 2c3y s LEU 791 CO 0.91 -0.37 1.59 -2.65 0.23 0.00 0.00 176.35 176.06 2c3y n PRO 792 N -0.54 2.27 -0.08 1.29 -0.02 -1.26 -4.88 135.00 131.79 2c3y n PRO 792 Ca -0.06 0.82 0.04 0.00 -2.02 0.00 0.00 63.50 62.28 2c3y n PRO 792 Cb 0.63 -2.59 0.37 0.00 -0.02 0.00 0.00 33.50 31.89 2c3y n PRO 792 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2c3y h ARG 793 N 5.85 0.68 -0.58 -0.52 2.43 -1.86 -2.44 114.38 117.95 2c3y h ARG 793 Ca -0.45 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2c3y h ARG 793 Cb 1.25 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2c3y h ARG 793 CO 0.88 0.45 0.00 -0.40 -1.51 0.00 0.00 179.97 179.39 2c3y n ASP 794 N -4.46 3.23 -4.89 -3.80 3.85 -1.26 -3.21 116.55 106.01 2c3y n ASP 794 Ca 0.06 -2.15 -0.29 0.00 -0.71 0.00 0.00 54.79 51.69 2c3y n ASP 794 Cb 0.08 -0.42 -0.02 0.00 -1.35 0.00 0.00 41.12 39.40 2c3y n ASP 794 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 2c3y s SER 795 N -0.90 6.44 0.05 -1.12 1.04 -0.92 -4.79 113.70 113.50 2c3y s SER 795 Ca 0.37 0.94 -0.17 0.00 0.48 0.00 0.00 55.95 57.56 2c3y s SER 795 Cb 0.21 -2.24 -0.07 0.00 0.10 0.00 0.00 66.02 64.02 2c3y s SER 795 CO 0.22 -0.37 1.27 0.25 0.98 0.00 0.00 173.24 175.59 2c3y h LEU 796 N 1.15 -0.77 -0.71 2.42 6.46 -1.91 0.40 115.31 122.35 2c3y h LEU 796 Ca -0.47 0.08 -0.05 0.00 -0.12 0.00 0.00 57.88 57.32 2c3y h LEU 796 Cb 1.19 0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 41.37 2c3y h LEU 796 CO 0.64 -0.28 0.25 0.50 -0.62 0.00 0.00 178.44 178.93 2c3y h LYS 797 N -0.39 1.07 -0.43 1.25 3.64 -1.93 -3.05 116.57 116.73 2c3y h LYS 797 Ca -0.01 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.09 2c3y h LYS 797 Cb 0.38 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 2c3y h LYS 797 CO -0.13 0.90 -0.04 0.78 -2.27 0.00 0.00 179.45 178.70 2c3y h GLY 798 N 1.02 0.78 1.53 5.01 0.00 -1.66 -2.73 103.07 107.03 2c3y h GLY 798 Ca 0.23 -0.53 0.07 0.00 0.00 0.00 0.00 47.33 47.10 2c3y h GLY 798 CO -0.01 0.49 0.17 1.48 0.00 0.00 0.00 176.54 178.67 2c3y h SER 799 N 0.68 0.00 -0.15 0.19 4.64 -0.09 -0.20 113.55 118.62 2c3y h SER 799 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2c3y h SER 799 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2c3y h SER 799 CO 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 2c3y n GLN 800 N -4.39 1.56 -0.44 4.77 1.13 -1.03 -2.80 117.38 116.17 2c3y n GLN 800 Ca 0.02 -0.84 0.08 0.00 -1.94 0.00 0.00 57.00 54.32 2c3y n GLN 800 Cb 0.32 -1.34 0.26 0.00 0.11 0.00 0.00 30.24 29.59 2c3y n GLN 800 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 2c3y n PHE 801 N 0.08 0.99 -4.17 1.08 0.99 -0.09 -4.61 117.46 111.74 2c3y n PHE 801 Ca 0.14 -0.75 -0.24 0.00 -0.00 0.00 0.00 57.45 56.60 2c3y n PHE 801 Cb 0.26 -0.26 -0.06 0.00 -1.00 0.00 0.00 39.48 38.41 2c3y n PHE 801 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 2c3y s GLN 802 N -2.31 2.65 -0.21 -1.08 -1.52 -1.12 -2.36 119.66 113.71 2c3y s GLN 802 Ca 0.40 -1.09 -0.29 0.00 -1.95 0.00 0.00 55.36 52.42 2c3y s GLN 802 Cb 0.30 -2.45 -0.00 0.00 -0.22 0.00 0.00 33.01 30.64 2c3y s GLN 802 CO 0.13 0.43 1.18 -1.21 -0.25 0.00 0.00 175.29 175.57 2c3y s GLU 803 N -3.38 4.21 0.01 2.91 2.02 -1.26 -4.99 118.70 118.22 2c3y s GLU 803 Ca 0.31 1.50 -0.30 0.00 0.02 0.00 0.00 54.97 56.49 2c3y s GLU 803 Cb -0.08 -3.73 -0.04 0.00 0.10 0.00 0.00 34.13 30.38 2c3y s GLU 803 CO 0.22 -0.72 1.07 -1.25 0.02 0.00 0.00 175.26 174.60 2c3y s PRO 804 N 3.46 4.49 -0.26 0.39 0.04 -1.26 -4.37 135.00 137.49 2c3y s PRO 804 Ca 0.51 1.56 0.13 0.00 0.04 0.00 0.00 61.00 63.24 2c3y s PRO 804 Cb -0.19 -3.43 0.73 0.00 0.04 0.00 0.00 34.50 31.65 2c3y s PRO 804 CO 0.12 -0.17 1.70 1.28 0.04 0.00 0.00 177.00 179.98 2c3y n LEU 805 N 4.07 5.45 -3.43 -3.56 4.32 -1.26 -4.75 117.00 117.83 2c3y n LEU 805 Ca 0.08 -3.09 -0.15 0.00 -0.02 0.00 0.00 56.01 52.83 2c3y n LEU 805 Cb 0.49 -0.68 -0.11 0.00 -1.62 0.00 0.00 43.42 41.50 2c3y n LEU 805 CO 0.53 0.73 -0.14 -0.32 -1.22 0.00 0.00 177.39 176.97 2c3y s MET 806 N -2.89 0.25 0.01 3.23 1.75 -1.26 -0.97 119.30 119.44 2c3y s MET 806 Ca 0.52 0.33 -0.04 0.00 -1.25 0.00 0.00 55.69 55.25 2c3y s MET 806 Cb 0.41 -0.92 -0.01 0.00 2.84 0.00 0.00 34.83 37.15 2c3y s MET 806 CO 0.13 -0.65 0.05 -1.21 -0.65 0.00 0.00 175.02 172.69 2c3y s GLU 807 N 2.41 0.41 -1.32 4.11 2.02 -0.32 -4.75 118.70 121.26 2c3y s GLU 807 Ca 0.09 -0.53 -0.02 0.00 0.02 0.00 0.00 54.97 54.53 2c3y s GLU 807 Cb -0.16 0.16 0.01 0.00 0.10 0.00 0.00 34.13 34.25 2c3y s GLU 807 CO -0.14 -0.09 0.82 1.19 0.02 0.00 0.00 175.26 177.07 2c3y n PHE 808 N 1.46 -2.08 -2.00 1.61 0.99 -0.73 -4.46 117.46 112.26 2c3y n PHE 808 Ca -0.23 0.88 -0.28 0.00 -0.00 0.00 0.00 57.45 57.82 2c3y n PHE 808 Cb 0.55 -4.51 0.11 0.00 -1.00 0.00 0.00 39.48 34.63 2c3y n PHE 808 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2c3y s SER 809 N -4.16 4.23 -0.03 4.37 1.04 -1.26 -4.80 113.70 113.10 2c3y s SER 809 Ca 0.13 0.55 0.04 0.00 0.48 0.00 0.00 55.95 57.14 2c3y s SER 809 Cb -0.06 -0.96 0.15 0.00 0.10 0.00 0.00 66.02 65.25 2c3y s SER 809 CO 0.79 -2.04 0.91 0.61 0.98 0.00 0.00 173.24 174.50 2c3y n GLY 810 N -3.32 0.89 3.72 7.32 0.00 -1.25 -4.92 105.19 107.62 2c3y n GLY 810 Ca 0.10 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 2c3y n GLY 810 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y s ALA 811 N -1.55 1.99 0.95 4.61 0.00 -1.26 -1.78 121.76 124.73 2c3y s ALA 811 Ca 0.11 0.69 -0.11 0.00 0.00 0.00 0.00 51.96 52.65 2c3y s ALA 811 Cb 0.07 -3.43 0.17 0.00 0.00 0.00 0.00 23.12 19.93 2c3y s ALA 811 CO 0.05 -2.05 1.11 0.00 0.00 0.00 0.00 175.76 174.88 2c3y s SER 813 N -2.75 6.76 0.00 0.00 0.01 -1.26 -2.31 113.70 114.15 2c3y s SER 813 Ca 0.66 2.47 0.00 0.00 1.31 0.00 0.00 55.95 60.39 2c3y s SER 813 Cb -0.22 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.41 2c3y s SER 813 CO 0.59 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 174.18 2c3y n GLY 814 N 3.03 0.60 3.54 3.44 0.00 -1.26 -4.85 105.19 109.69 2c3y n GLY 814 Ca 0.10 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.60 2c3y n GLY 814 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y n GLY 816 N 1.98 -0.85 0.12 0.00 0.00 -0.69 -4.07 105.19 101.68 2c3y n GLY 816 Ca 0.17 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 2c3y n GLY 816 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3y n GLU 817 N -0.83 0.63 0.18 1.61 1.02 -1.26 -4.25 120.64 117.74 2c3y n GLU 817 Ca 0.18 0.38 0.06 0.00 -0.02 0.00 0.00 57.16 57.76 2c3y n GLU 817 Cb 0.23 -1.66 0.52 0.00 -0.02 0.00 0.00 31.44 30.51 2c3y n GLU 817 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2c3y h THR 818 N -0.59 1.08 -0.76 2.62 1.35 -1.85 -2.87 112.91 111.89 2c3y h THR 818 Ca -0.47 -0.32 -0.03 0.00 -0.55 0.00 0.00 66.41 65.05 2c3y h THR 818 Cb 1.63 1.03 -0.04 0.00 -1.73 0.00 0.00 68.15 69.05 2c3y h THR 818 CO -0.16 0.10 0.37 -0.65 -0.25 0.00 0.00 175.52 174.94 2c3y h PRO 819 N 0.14 1.08 0.23 4.72 0.11 -1.76 -1.55 132.00 134.96 2c3y h PRO 819 Ca 0.03 -0.15 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 2c3y h PRO 819 Cb 0.13 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.04 2c3y h PRO 819 CO 0.00 0.83 -0.11 1.88 -0.21 0.00 0.00 178.00 180.39 2c3y h TYR 820 N 1.08 -0.28 -0.70 0.65 -1.99 -1.78 -2.76 116.97 111.19 2c3y h TYR 820 Ca 0.26 -0.01 0.01 0.00 2.00 0.00 0.00 58.73 61.00 2c3y h TYR 820 Cb 0.10 0.09 -0.04 0.00 2.00 0.00 0.00 36.73 38.88 2c3y h TYR 820 CO 0.01 -0.11 0.46 -0.24 -0.00 0.00 0.00 178.16 178.28 2c3y h VAL 821 N -0.39 1.17 -0.18 -2.88 3.04 -1.48 -1.73 116.25 113.80 2c3y h VAL 821 Ca -0.03 -0.32 0.04 0.00 -1.01 0.00 0.00 66.70 65.38 2c3y h VAL 821 Cb 0.30 0.15 -0.04 0.00 -2.01 0.00 0.00 31.29 29.68 2c3y h VAL 821 CO 0.05 0.17 -0.09 -0.09 -1.01 0.00 0.00 177.57 176.60 2c3y h ARG 822 N 0.94 -0.07 -0.44 4.17 2.43 -1.24 -1.64 114.38 118.52 2c3y h ARG 822 Ca 0.26 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.38 2c3y h ARG 822 Cb -0.10 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 2c3y h ARG 822 CO -0.06 -0.04 0.06 -0.39 -1.51 0.00 0.00 179.97 178.02 2c3y h VAL 823 N -0.07 1.21 -0.79 0.20 -1.51 -1.18 -2.13 116.25 111.98 2c3y h VAL 823 Ca 0.10 -0.82 0.04 0.00 -1.23 0.00 0.00 66.70 64.79 2c3y h VAL 823 Cb 0.22 0.82 -0.05 0.00 -2.13 0.00 0.00 31.29 30.14 2c3y h VAL 823 CO -0.22 0.29 0.49 0.40 -1.23 0.00 0.00 177.57 177.30 2c3y h ILE 824 N 0.66 1.07 0.00 7.19 2.04 -0.55 -0.78 117.51 127.14 2c3y h ILE 824 Ca 0.14 -0.32 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 2c3y h ILE 824 Cb 0.33 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 2c3y h ILE 824 CO 0.01 0.17 -0.20 0.71 0.00 0.00 0.00 178.15 178.83 2c3y h THR 825 N 0.93 0.65 0.00 -0.27 1.35 -0.68 -1.22 112.91 113.68 2c3y h THR 825 Ca 0.33 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2c3y h THR 825 Cb 0.09 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.07 2c3y h THR 825 CO -0.14 0.20 0.00 1.56 -0.25 0.00 0.00 175.52 176.89 2c3y h GLN 826 N 0.00 0.00 0.00 4.72 4.20 -0.70 0.16 115.11 123.49 2c3y h GLN 826 Ca -0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 2c3y h GLN 826 Cb 0.55 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.26 2c3y h GLN 826 CO 0.03 0.00 -2.39 1.28 -0.67 0.00 0.00 178.83 177.07 2c3y n LEU 827 N -2.93 1.53 0.00 1.46 4.32 -0.75 -4.76 117.00 115.87 2c3y n LEU 827 Ca 0.02 -0.07 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 2c3y n LEU 827 Cb 0.35 -0.22 0.00 0.00 -1.62 0.00 0.00 43.42 41.93 2c3y n LEU 827 CO 0.28 0.71 0.09 0.49 -1.22 0.00 0.00 177.39 177.74 2c3y n PHE 828 N -2.99 0.00 -0.27 -1.77 3.01 -0.54 -4.94 117.46 109.96 2c3y n PHE 828 Ca -0.39 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.06 2c3y n PHE 828 Cb 1.06 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.54 2c3y n PHE 828 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2c3y n GLY 829 N 0.04 -1.50 0.00 1.37 0.00 0.56 -1.12 105.19 104.55 2c3y n GLY 829 Ca 0.00 0.79 0.03 0.00 0.00 0.00 0.00 46.02 46.84 2c3y n GLY 829 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2c3y n GLU 830 N -5.02 0.00 -0.83 1.61 0.00 -1.26 -2.82 120.64 112.33 2c3y n GLU 830 Ca 0.06 0.39 0.03 0.00 0.00 0.00 0.00 57.16 57.65 2c3y n GLU 830 Cb 0.27 -1.50 0.05 0.00 0.00 0.00 0.00 31.44 30.26 2c3y n GLU 830 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 2c3y n ARG 831 N -1.49 0.32 -4.11 3.44 1.85 -0.27 -4.35 116.66 112.04 2c3y n ARG 831 Ca 0.02 -1.80 -0.30 0.00 -1.00 0.00 0.00 57.85 54.77 2c3y n ARG 831 Cb 0.07 -0.55 -0.08 0.00 -1.05 0.00 0.00 32.46 30.85 2c3y n ARG 831 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2c3y s MET 832 N -0.69 2.62 0.03 2.89 0.23 -1.13 0.64 119.30 123.89 2c3y s MET 832 Ca 0.20 -0.82 0.03 0.00 -1.03 0.00 0.00 55.69 54.07 2c3y s MET 832 Cb 0.22 -2.57 -0.04 0.00 -1.53 0.00 0.00 34.83 30.90 2c3y s MET 832 CO -0.07 0.54 -0.00 -0.06 -2.03 0.00 0.00 175.02 173.40 2c3y s PHE 833 N -1.35 3.03 -0.13 3.16 0.40 0.16 -1.54 117.98 121.71 2c3y s PHE 833 Ca 0.27 0.04 -0.01 0.00 -0.60 0.00 0.00 56.93 56.62 2c3y s PHE 833 Cb -0.12 -1.62 0.04 0.00 0.51 0.00 0.00 43.02 41.83 2c3y s PHE 833 CO 0.19 0.46 -0.02 0.42 0.70 0.00 0.00 175.22 176.97 2c3y s ILE 834 N -1.16 0.71 -0.44 0.64 1.01 0.83 -1.39 121.20 121.41 2c3y s ILE 834 Ca 0.21 -0.28 -0.13 0.00 0.00 0.00 0.00 60.65 60.45 2c3y s ILE 834 Cb -0.12 -0.92 0.07 0.00 0.01 0.00 0.00 42.46 41.50 2c3y s ILE 834 CO 0.13 0.15 0.33 0.00 0.00 0.00 0.00 174.94 175.55 2c3y s ALA 835 N 1.81 3.45 -0.23 9.38 0.00 -0.09 -1.55 121.76 134.54 2c3y s ALA 835 Ca 0.03 -2.06 -0.08 0.00 0.00 0.00 0.00 51.96 49.85 2c3y s ALA 835 Cb -0.14 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 2c3y s ALA 835 CO -0.07 -1.65 0.09 1.21 0.00 0.00 0.00 175.76 175.34 2c3y s ASN 836 N 2.29 5.50 0.59 0.00 3.84 -0.11 -0.94 114.94 126.11 2c3y s ASN 836 Ca 0.04 -0.05 -0.18 0.00 0.21 0.00 0.00 52.86 52.87 2c3y s ASN 836 Cb -0.23 -1.98 -0.04 0.00 -0.55 0.00 0.00 41.25 38.46 2c3y s ASN 836 CO 0.06 0.05 1.15 0.00 -2.79 0.00 0.00 177.10 175.56 2c3y s ALA 837 N 1.14 2.58 0.36 1.71 0.00 0.46 -4.05 121.76 123.95 2c3y s ALA 837 Ca 0.05 0.82 -0.28 0.00 0.00 0.00 0.00 51.96 52.55 2c3y s ALA 837 Cb -0.14 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 19.50 2c3y s ALA 837 CO 0.04 -1.03 1.29 0.99 0.00 0.00 0.00 175.76 177.05 2c3y s THR 838 N -1.86 2.74 -5.00 0.00 2.01 -1.18 -4.16 115.64 108.19 2c3y s THR 838 Ca 0.73 0.71 0.00 0.00 0.31 0.00 0.00 61.69 63.44 2c3y s THR 838 Cb -0.25 -3.44 0.00 0.00 0.01 0.00 0.00 72.50 68.82 2c3y s THR 838 CO 0.32 0.14 0.00 0.61 -0.69 0.00 0.00 174.62 175.01 2c3y n GLY 839 N 0.75 -0.90 0.30 4.40 0.00 -1.26 -4.83 105.19 103.66 2c3y n GLY 839 Ca 0.01 -1.37 0.10 0.00 0.00 0.00 0.00 46.02 44.77 2c3y n GLY 839 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y h SER 841 N 0.40 0.00 1.08 0.00 4.64 -1.92 0.26 113.55 118.01 2c3y h SER 841 Ca 0.50 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.73 2c3y h SER 841 Cb 0.90 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.97 2c3y h SER 841 CO -0.50 0.10 -0.97 0.77 -0.87 0.00 0.00 176.83 175.36 2c3y h SER 842 N 0.00 0.00 0.14 4.97 4.64 -0.96 -2.16 113.55 120.17 2c3y h SER 842 Ca -0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 2c3y h SER 842 Cb 0.28 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.38 2c3y h SER 842 CO 0.01 0.37 -0.87 0.40 -0.87 0.00 0.00 176.83 175.87 2c3y h ILE 843 N 0.00 1.47 0.00 0.95 1.08 0.38 -1.42 117.51 119.96 2c3y h ILE 843 Ca -0.07 -2.52 0.00 0.00 -0.39 0.00 0.00 64.86 61.87 2c3y h ILE 843 Cb 1.35 3.15 0.00 0.00 -3.07 0.00 0.00 36.82 38.25 2c3y h ILE 843 CO 0.04 0.71 -0.14 4.11 -0.69 0.00 0.00 178.15 182.18 2c3y h TRP 844 N -0.37 0.00 0.00 1.37 5.08 -0.72 -3.02 115.95 118.29 2c3y h TRP 844 Ca -0.16 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.62 2c3y h TRP 844 Cb 1.65 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 27.78 2c3y h TRP 844 CO 0.19 0.00 -0.92 0.78 -1.28 0.00 0.00 178.44 177.21 2c3y h GLY 845 N 4.09 0.01 -5.00 11.11 0.00 -1.42 -3.33 103.07 108.52 2c3y h GLY 845 Ca 0.00 -0.02 -0.23 0.00 0.00 0.00 0.00 47.33 47.09 2c3y h GLY 845 CO 0.00 0.01 -0.39 0.00 0.00 0.00 0.00 176.54 176.16 2c3y n ALA 846 N -2.37 1.37 -2.57 3.60 0.00 -0.54 -4.19 120.51 115.81 2c3y n ALA 846 Ca -0.00 -1.38 -0.43 0.00 0.00 0.00 0.00 53.44 51.63 2c3y n ALA 846 Cb 0.87 -0.99 -0.05 0.00 0.00 0.00 0.00 19.45 19.28 2c3y n ALA 846 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2c3y s SER 847 N -1.30 6.44 0.40 0.00 0.01 -1.14 -4.92 113.70 113.20 2c3y s SER 847 Ca 0.22 -0.04 -0.25 0.00 1.31 0.00 0.00 55.95 57.20 2c3y s SER 847 Cb 0.40 -2.42 -0.11 0.00 0.21 0.00 0.00 66.02 64.10 2c3y s SER 847 CO -0.08 -1.02 0.98 0.00 0.41 0.00 0.00 173.24 173.52 2c3y n ALA 848 N 7.03 0.01 -0.14 1.44 0.00 -1.26 -1.65 120.51 125.95 2c3y n ALA 848 Ca 0.04 0.25 0.10 0.00 0.00 0.00 0.00 53.44 53.83 2c3y n ALA 848 Cb 0.48 -2.05 0.30 0.00 0.00 0.00 0.00 19.45 18.18 2c3y n ALA 848 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2c3y n PRO 849 N 0.26 2.67 -3.01 0.00 -0.04 -1.26 -5.04 135.00 128.58 2c3y n PRO 849 Ca 0.10 -2.40 -0.42 0.00 -0.04 0.00 0.00 63.50 60.74 2c3y n PRO 849 Cb 0.38 -1.56 -0.06 0.00 -0.04 0.00 0.00 33.50 32.22 2c3y n PRO 849 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2c3y s SER 850 N -0.98 6.49 -0.38 3.54 0.15 -0.66 -4.82 113.70 117.05 2c3y s SER 850 Ca 0.44 0.21 -0.01 0.00 0.70 0.00 0.00 55.95 57.29 2c3y s SER 850 Cb 0.24 -2.37 0.10 0.00 -1.71 0.00 0.00 66.02 62.28 2c3y s SER 850 CO 0.29 -0.72 0.15 -0.04 1.20 0.00 0.00 173.24 174.12 2c3y s MET 851 N 3.01 1.92 0.33 5.44 -1.94 -1.26 -3.77 119.30 123.03 2c3y s MET 851 Ca 0.29 -1.79 0.08 0.00 -1.71 0.00 0.00 55.69 52.56 2c3y s MET 851 Cb -0.13 -3.46 0.57 0.00 2.01 0.00 0.00 34.83 33.81 2c3y s MET 851 CO 0.17 -1.00 1.77 -1.00 -0.01 0.00 0.00 175.02 174.95 2c3y h PRO 852 N 7.95 0.21 -6.89 2.03 0.13 -1.78 -2.63 132.00 131.01 2c3y h PRO 852 Ca -0.12 -0.08 -0.52 0.00 -0.87 0.00 0.00 66.00 64.42 2c3y h PRO 852 Cb 1.04 -0.01 0.05 0.00 0.13 0.00 0.00 31.00 32.22 2c3y h PRO 852 CO 0.64 0.52 0.57 0.71 -0.23 0.00 0.00 178.00 180.21 2c3y s TYR 853 N -4.30 3.14 0.24 1.56 1.51 -1.26 -1.17 117.35 117.07 2c3y s TYR 853 Ca -0.04 1.51 0.01 0.00 -1.01 0.00 0.00 57.07 57.53 2c3y s TYR 853 Cb 0.14 -3.53 -0.03 0.00 -0.11 0.00 0.00 41.96 38.43 2c3y s TYR 853 CO 0.76 -1.48 0.20 -1.59 -1.11 0.00 0.00 175.55 172.33 2c3y s LYS 854 N -1.90 1.40 0.34 -0.62 -2.85 -0.14 0.72 119.74 116.69 2c3y s LYS 854 Ca 0.51 -1.73 0.03 0.00 -1.00 0.00 0.00 55.97 53.78 2c3y s LYS 854 Cb -0.36 0.30 -0.02 0.00 -2.06 0.00 0.00 37.83 35.69 2c3y s LYS 854 CO 0.46 -0.49 0.50 0.95 0.10 0.00 0.00 175.35 176.88 2c3y s THR 855 N -3.91 4.71 0.14 3.79 -4.23 -1.26 -4.35 115.64 110.53 2c3y s THR 855 Ca 0.38 -0.73 -0.01 0.00 -1.18 0.00 0.00 61.69 60.15 2c3y s THR 855 Cb 0.05 -3.69 0.03 0.00 1.34 0.00 0.00 72.50 70.23 2c3y s THR 855 CO 0.17 -0.36 0.20 -0.46 -0.54 0.00 0.00 174.62 173.62 2c3y n ASN 856 N -1.71 0.12 0.30 3.99 0.23 0.31 -4.85 115.26 113.64 2c3y n ASN 856 Ca -0.04 -1.13 0.20 0.00 -0.53 0.00 0.00 54.58 53.08 2c3y n ASN 856 Cb 0.57 -0.14 1.03 0.00 -2.08 0.00 0.00 39.78 39.16 2c3y n ASN 856 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2c3y h ARG 857 N 0.00 0.00 -0.66 -3.83 0.11 -2.00 -1.08 114.38 106.92 2c3y h ARG 857 Ca -0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.02 2c3y h ARG 857 Cb 0.20 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.28 2c3y h ARG 857 CO 0.05 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.40 2c3y n LEU 858 N -2.92 3.66 -0.02 0.08 4.32 -1.26 -4.93 117.00 115.92 2c3y n LEU 858 Ca -0.02 -1.80 -0.00 0.00 -0.02 0.00 0.00 56.01 54.17 2c3y n LEU 858 Cb 0.10 -0.44 -0.00 0.00 -1.62 0.00 0.00 43.42 41.46 2c3y n LEU 858 CO 0.19 0.90 -0.00 0.61 -1.22 0.00 0.00 177.39 177.87 2c3y n GLY 859 N 1.59 0.47 3.88 -0.72 0.00 -0.41 -5.03 105.19 104.97 2c3y n GLY 859 Ca 0.23 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2c3y n GLY 859 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c3y s GLN 860 N -0.48 3.56 0.10 1.61 -0.21 -1.26 -4.75 119.66 118.24 2c3y s GLN 860 Ca 0.00 -0.05 -0.26 0.00 0.02 0.00 0.00 55.36 55.06 2c3y s GLN 860 Cb 0.00 -3.14 0.08 0.00 1.00 0.00 0.00 33.01 30.96 2c3y s GLN 860 CO 0.00 0.70 1.08 0.20 -2.12 0.00 0.00 175.29 175.15 2c3y s GLY 861 N -1.42 -0.23 0.18 3.09 0.00 -1.26 0.11 107.32 107.80 2c3y s GLY 861 Ca 0.23 0.21 -0.32 0.00 0.00 0.00 0.00 44.72 44.84 2c3y s GLY 861 CO 0.12 0.57 1.72 -4.14 0.00 0.00 0.00 173.10 171.37 2c3y s PRO 862 N -2.83 4.14 -0.59 2.90 0.02 -1.13 -4.69 135.00 132.82 2c3y s PRO 862 Ca 0.15 2.56 -0.25 0.00 0.02 0.00 0.00 61.00 63.48 2c3y s PRO 862 Cb 0.00 -3.21 0.04 0.00 0.02 0.00 0.00 34.50 31.36 2c3y s PRO 862 CO 0.01 -0.75 1.03 0.00 -0.33 0.00 0.00 177.00 176.96 2c3y s ALA 863 N 1.53 3.08 -0.14 -1.55 0.00 -0.59 -4.93 121.76 119.16 2c3y s ALA 863 Ca 0.75 -1.22 -0.06 0.00 0.00 0.00 0.00 51.96 51.44 2c3y s ALA 863 Cb -0.48 -3.87 -0.04 0.00 0.00 0.00 0.00 23.12 18.73 2c3y s ALA 863 CO 0.33 -2.57 0.07 -0.46 0.00 0.00 0.00 175.76 173.13 2c3y s TRP 864 N 4.36 3.33 -0.12 0.00 -0.00 -1.26 -0.12 118.94 125.14 2c3y s TRP 864 Ca 0.33 0.24 -0.14 0.00 -0.00 0.00 0.00 56.10 56.53 2c3y s TRP 864 Cb -0.11 -1.98 0.04 0.00 -0.00 0.00 0.00 33.47 31.42 2c3y s TRP 864 CO 0.19 0.40 0.38 0.20 -0.00 0.00 0.00 176.95 178.12 2c3y s GLY 865 N -0.31 -0.28 -0.21 5.86 0.00 -0.60 -4.99 107.32 106.80 2c3y s GLY 865 Ca 0.09 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.79 2c3y s GLY 865 CO 0.02 0.81 -0.14 0.21 0.00 0.00 0.00 173.10 173.99 2c3y s ASN 866 N -0.07 3.67 0.00 1.64 2.47 -1.26 -0.94 114.94 120.46 2c3y s ASN 866 Ca -0.02 -0.78 0.00 0.00 0.42 0.00 0.00 52.86 52.47 2c3y s ASN 866 Cb -0.03 -1.55 0.00 0.00 -1.45 0.00 0.00 41.25 38.22 2c3y s ASN 866 CO 0.01 -0.06 0.00 -0.24 -3.72 0.00 0.00 177.10 173.10 2c3y n SER 867 N 4.62 0.00 -3.06 -4.21 2.88 -1.26 -5.02 113.62 107.57 2c3y n SER 867 Ca -0.19 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.18 2c3y n SER 867 Cb 0.48 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.88 2c3y n SER 867 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2c3y n LEU 868 N -0.61 0.00 0.05 2.46 4.77 -1.26 -4.98 117.00 117.43 2c3y n LEU 868 Ca 0.00 -2.45 -0.20 0.00 -0.03 0.00 0.00 56.01 53.34 2c3y n LEU 868 Cb 0.00 1.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.99 2c3y n LEU 868 CO 0.00 -0.39 0.08 0.15 -1.33 0.00 0.00 177.39 175.90 2c3y h PHE 869 N 1.67 0.68 0.00 -1.77 3.57 -1.92 -3.14 116.94 116.03 2c3y h PHE 869 Ca -0.22 -0.44 0.00 0.00 3.53 0.00 0.00 57.97 60.85 2c3y h PHE 869 Cb 0.94 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.63 2c3y h PHE 869 CO 0.00 1.30 0.00 -0.85 -2.23 0.00 0.00 178.31 176.53 2c3y n GLU 870 N -4.08 0.19 -0.19 1.11 0.00 -1.26 -4.28 120.64 112.14 2c3y n GLU 870 Ca -0.13 0.16 0.07 0.00 0.00 0.00 0.00 57.16 57.26 2c3y n GLU 870 Cb 0.82 -1.73 0.15 0.00 0.00 0.00 0.00 31.44 30.68 2c3y n GLU 870 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2c3y n ASP 871 N -2.06 2.84 -0.25 -1.84 3.85 -1.26 -4.40 116.55 113.44 2c3y n ASP 871 Ca 0.06 -2.65 0.05 0.00 -0.71 0.00 0.00 54.79 51.54 2c3y n ASP 871 Cb 0.41 -0.34 0.18 0.00 -1.35 0.00 0.00 41.12 40.01 2c3y n ASP 871 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2c3y h ALA 872 N 0.91 1.01 -0.05 2.12 0.00 -1.75 0.11 119.26 121.60 2c3y h ALA 872 Ca 0.00 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2c3y h ALA 872 Cb 0.98 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2c3y h ALA 872 CO 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.08 2c3y h ALA 873 N 1.55 0.07 -0.25 0.00 0.00 -1.89 -1.05 119.26 117.69 2c3y h ALA 873 Ca 0.40 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2c3y h ALA 873 Cb 0.62 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2c3y h ALA 873 CO -0.42 -0.27 -0.05 1.05 0.00 0.00 0.00 179.25 179.56 2c3y h GLU 874 N -0.19 0.38 -0.02 0.00 9.09 -1.73 0.28 114.58 122.40 2c3y h GLU 874 Ca 0.01 -0.08 -0.00 0.00 0.05 0.00 0.00 59.36 59.34 2c3y h GLU 874 Cb 0.31 -0.06 -0.00 0.00 -1.65 0.00 0.00 28.75 27.35 2c3y h GLU 874 CO 0.00 0.45 0.01 -0.92 0.05 0.00 0.00 179.01 178.60 2c3y h TYR 875 N 0.37 0.03 -0.66 2.06 3.20 -0.63 0.87 116.97 122.22 2c3y h TYR 875 Ca 0.08 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 2c3y h TYR 875 Cb 0.32 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.56 2c3y h TYR 875 CO 0.01 0.19 0.16 0.78 -1.64 0.00 0.00 178.16 177.66 2c3y h GLY 876 N -0.13 1.12 0.72 1.82 0.00 -0.72 -2.13 103.07 103.74 2c3y h GLY 876 Ca 0.01 -0.68 0.07 0.00 0.00 0.00 0.00 47.33 46.72 2c3y h GLY 876 CO -0.00 0.64 0.65 -2.75 0.00 0.00 0.00 176.54 175.07 2c3y h PHE 877 N 0.99 1.20 -0.58 5.60 3.57 -0.01 -1.17 116.94 126.54 2c3y h PHE 877 Ca 0.21 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 2c3y h PHE 877 Cb 0.35 -0.39 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2c3y h PHE 877 CO 0.03 0.61 0.06 0.78 -2.23 0.00 0.00 178.31 177.56 2c3y h GLY 878 N 1.17 1.04 1.02 2.40 0.00 -0.19 -0.67 103.07 107.83 2c3y h GLY 878 Ca 0.44 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 2c3y h GLY 878 CO -0.18 0.64 0.35 -0.33 0.00 0.00 0.00 176.54 177.02 2c3y h MET 879 N 0.90 1.08 -0.91 4.80 2.86 -0.86 -1.40 114.93 121.40 2c3y h MET 879 Ca 0.18 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2c3y h MET 879 Cb 0.44 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.87 2c3y h MET 879 CO 0.02 0.85 0.52 -0.97 1.06 0.00 0.00 176.91 178.39 2c3y h ASN 880 N 1.05 1.13 -0.75 1.22 -0.73 -0.65 -1.92 115.58 114.93 2c3y h ASN 880 Ca 0.26 -0.09 -0.05 0.00 1.87 0.00 0.00 56.30 58.28 2c3y h ASN 880 Cb 0.13 -0.29 -0.03 0.00 0.27 0.00 0.00 38.32 38.40 2c3y h ASN 880 CO -0.03 0.89 0.26 0.24 -0.37 0.00 0.00 177.43 178.42 2c3y h MET 881 N 1.27 1.15 0.02 6.67 2.86 -0.46 -1.53 114.93 124.91 2c3y h MET 881 Ca 0.32 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2c3y h MET 881 Cb -0.00 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.48 2c3y h MET 881 CO -0.06 0.96 -0.01 1.03 1.06 0.00 0.00 176.91 179.90 2c3y h SER 882 N 1.10 -0.03 -0.96 1.22 0.87 -0.86 -1.42 113.55 113.46 2c3y h SER 882 Ca 0.24 -0.15 0.04 0.00 -1.23 0.00 0.00 61.79 60.70 2c3y h SER 882 Cb 0.27 0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 62.18 2c3y h SER 882 CO -0.01 0.14 0.63 0.24 -0.53 0.00 0.00 176.83 177.29 2c3y h MET 883 N -0.19 1.16 -0.12 2.24 2.86 -1.23 0.22 114.93 119.87 2c3y h MET 883 Ca -0.00 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2c3y h MET 883 Cb 0.18 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 2c3y h MET 883 CO 0.01 0.77 0.04 0.35 1.06 0.00 0.00 176.91 179.14 2c3y h PHE 884 N 1.19 0.18 -0.40 -0.22 3.57 -1.05 0.90 116.94 121.11 2c3y h PHE 884 Ca 0.39 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.82 2c3y h PHE 884 Cb 0.04 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2c3y h PHE 884 CO -0.00 0.29 0.02 0.00 -2.23 0.00 0.00 178.31 176.38 2c3y h ALA 885 N 0.87 0.53 -0.13 2.41 0.00 -0.79 -1.55 119.26 120.61 2c3y h ALA 885 Ca 0.04 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2c3y h ALA 885 Cb 0.19 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2c3y h ALA 885 CO -0.00 0.29 -0.64 0.00 0.00 0.00 0.00 179.25 178.90 2c3y h ARG 886 N 0.52 0.49 0.00 0.00 3.08 -0.55 -2.22 114.38 115.70 2c3y h ARG 886 Ca 0.11 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 2c3y h ARG 886 Cb 0.45 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 2c3y h ARG 886 CO 0.02 0.97 -0.07 0.00 -1.07 0.00 0.00 179.97 179.81 2c3y h ARG 887 N 0.35 0.00 0.03 0.04 3.08 -0.81 -1.61 114.38 115.46 2c3y h ARG 887 Ca -0.01 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.82 2c3y h ARG 887 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 2c3y h ARG 887 CO 0.12 0.07 -0.97 1.15 -1.07 0.00 0.00 179.97 179.26 2c3y h THR 888 N 0.00 1.50 -0.06 2.04 2.02 -1.17 -1.07 112.91 116.16 2c3y h THR 888 Ca -0.00 -2.75 -0.00 0.00 0.77 0.00 0.00 66.41 64.43 2c3y h THR 888 Cb 0.95 2.59 -0.00 0.00 -1.74 0.00 0.00 68.15 69.95 2c3y h THR 888 CO 0.01 0.80 0.02 -0.74 0.37 0.00 0.00 175.52 175.98 2c3y h HIS 889 N 0.11 0.10 -0.50 3.16 -0.00 -1.12 -1.42 115.15 115.48 2c3y h HIS 889 Ca -0.07 -0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.33 2c3y h HIS 889 Cb 1.64 -0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 28.98 2c3y h HIS 889 CO 0.04 0.27 0.28 1.25 -0.00 0.00 0.00 177.93 179.76 2c3y h LEU 890 N -0.10 0.43 -1.07 0.26 5.85 -1.25 -1.93 115.31 117.49 2c3y h LEU 890 Ca 0.02 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2c3y h LEU 890 Cb 0.22 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2c3y h LEU 890 CO -0.00 0.30 0.46 0.00 -0.34 0.00 0.00 178.44 178.86 2c3y h ALA 891 N 1.24 1.30 -0.51 1.25 0.00 -1.04 -0.11 119.26 121.39 2c3y h ALA 891 Ca 0.21 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2c3y h ALA 891 Cb 0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2c3y h ALA 891 CO -0.12 0.59 -0.04 -0.44 0.00 0.00 0.00 179.25 179.24 2c3y h ASP 892 N 1.12 0.86 -0.16 0.00 5.19 -0.80 -1.15 116.42 121.48 2c3y h ASP 892 Ca 0.29 -0.24 -0.12 0.00 -0.62 0.00 0.00 57.03 56.34 2c3y h ASP 892 Cb -0.01 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.26 2c3y h ASP 892 CO -0.05 0.95 -0.29 -0.07 -3.12 0.00 0.00 179.24 176.65 2c3y h LEU 893 N 0.81 0.66 -0.16 1.55 4.07 -0.75 -1.99 115.31 119.51 2c3y h LEU 893 Ca 0.15 -0.25 -0.01 0.00 0.08 0.00 0.00 57.88 57.84 2c3y h LEU 893 Cb 0.54 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 2c3y h LEU 893 CO 0.03 0.92 0.04 0.00 -1.08 0.00 0.00 178.44 178.35 2c3y h ALA 894 N 1.12 0.21 -0.51 1.53 0.00 -0.66 -0.31 119.26 120.65 2c3y h ALA 894 Ca 0.07 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.87 2c3y h ALA 894 Cb 0.78 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2c3y h ALA 894 CO 0.06 -0.16 0.29 0.00 0.00 0.00 0.00 179.25 179.44 2c3y h ALA 895 N 0.85 0.65 -0.61 0.00 0.00 -1.10 -1.87 119.26 117.19 2c3y h ALA 895 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2c3y h ALA 895 Cb 0.25 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2c3y h ALA 895 CO -0.00 -0.03 0.17 0.87 0.00 0.00 0.00 179.25 180.26 2c3y h LYS 896 N 0.57 0.94 0.00 0.00 1.57 -1.21 -2.02 116.57 116.42 2c3y h LYS 896 Ca 0.21 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2c3y h LYS 896 Cb 0.06 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 2c3y h LYS 896 CO -0.12 0.82 -0.11 0.00 -0.57 0.00 0.00 179.45 179.48 2c3y h ALA 897 N 1.28 1.35 0.00 3.86 0.00 -0.28 -1.06 119.26 124.41 2c3y h ALA 897 Ca 0.20 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2c3y h ALA 897 Cb 0.29 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2c3y h ALA 897 CO -0.00 0.13 -0.09 -0.07 0.00 0.00 0.00 179.25 179.22 2c3y h LEU 898 N 0.00 0.00 -3.75 0.00 3.38 -0.66 -2.42 115.31 111.86 2c3y h LEU 898 Ca -0.00 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.70 2c3y h LEU 898 Cb 0.28 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.87 2c3y h LEU 898 CO 0.01 0.09 0.34 -0.62 0.09 0.00 0.00 178.44 178.35 2c3y n GLU 899 N -3.31 3.50 -2.54 1.13 1.02 -0.40 -4.93 120.64 115.11 2c3y n GLU 899 Ca -0.01 -3.03 -0.09 0.00 -0.02 0.00 0.00 57.16 54.02 2c3y n GLU 899 Cb 0.29 -2.21 -0.01 0.00 -0.02 0.00 0.00 31.44 29.49 2c3y n GLU 899 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2c3y n SER 900 N -0.28 2.03 -1.50 1.62 3.41 -0.91 -5.02 113.62 112.97 2c3y n SER 900 Ca 0.44 -1.62 -0.02 0.00 -0.26 0.00 0.00 58.87 57.40 2c3y n SER 900 Cb 1.43 0.06 0.21 0.00 -0.26 0.00 0.00 64.21 65.64 2c3y n SER 900 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2c3y n ASP 901 N -1.47 3.79 -4.63 4.04 3.85 -1.26 -4.95 116.55 115.91 2c3y n ASP 901 Ca -0.04 -2.71 -0.36 0.00 -0.71 0.00 0.00 54.79 50.97 2c3y n ASP 901 Cb 0.19 -0.65 0.09 0.00 -1.35 0.00 0.00 41.12 39.40 2c3y n ASP 901 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2c3y n ALA 902 N 0.09 -0.05 -0.73 2.12 0.00 -1.26 -4.93 120.51 115.75 2c3y n ALA 902 Ca 0.24 -0.17 -0.31 0.00 0.00 0.00 0.00 53.44 53.19 2c3y n ALA 902 Cb 0.97 -2.15 0.17 0.00 0.00 0.00 0.00 19.45 18.43 2c3y n ALA 902 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2c3y s SER 903 N -1.64 2.93 0.34 0.00 1.04 -1.26 -4.78 113.70 110.33 2c3y s SER 903 Ca 0.74 2.14 0.03 0.00 0.48 0.00 0.00 55.95 59.34 2c3y s SER 903 Cb -0.35 -2.55 0.60 0.00 0.10 0.00 0.00 66.02 63.82 2c3y s SER 903 CO 0.49 -3.09 1.94 1.23 0.98 0.00 0.00 173.24 174.79 2c3y h GLY 904 N -1.86 0.75 0.96 7.32 0.00 -1.99 -1.57 103.07 106.68 2c3y h GLY 904 Ca -0.44 -0.36 -0.10 0.00 0.00 0.00 0.00 47.33 46.44 2c3y h GLY 904 CO 0.42 0.34 -0.16 -0.55 0.00 0.00 0.00 176.54 176.60 2c3y h ASP 905 N 0.70 0.73 -0.28 0.19 3.45 -1.99 -1.83 116.42 117.39 2c3y h ASP 905 Ca 0.17 -0.40 -0.01 0.00 0.43 0.00 0.00 57.03 57.22 2c3y h ASP 905 Cb 0.12 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.67 2c3y h ASP 905 CO -0.02 0.97 0.14 0.58 -1.57 0.00 0.00 179.24 179.34 2c3y h VAL 906 N 0.49 1.14 -0.90 -1.35 2.07 -1.84 -1.31 116.25 114.55 2c3y h VAL 906 Ca 0.08 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2c3y h VAL 906 Cb 0.69 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 2c3y h VAL 906 CO 0.05 0.15 0.51 0.11 0.02 0.00 0.00 177.57 178.41 2c3y h LYS 907 N 0.32 1.24 -0.31 1.57 1.57 -1.26 0.12 116.57 119.83 2c3y h LYS 907 Ca 0.10 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2c3y h LYS 907 Cb 0.10 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2c3y h LYS 907 CO -0.01 0.89 0.18 1.49 -0.57 0.00 0.00 179.45 181.42 2c3y h GLU 908 N 1.25 0.43 -0.73 3.15 4.81 -1.07 0.10 114.58 122.51 2c3y h GLU 908 Ca 0.32 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.46 2c3y h GLU 908 Cb -0.01 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 2c3y h GLU 908 CO -0.05 0.35 0.30 0.00 -0.73 0.00 0.00 179.01 178.87 2c3y h ALA 909 N 1.05 0.95 -0.79 2.92 0.00 -0.78 -0.41 119.26 122.21 2c3y h ALA 909 Ca 0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2c3y h ALA 909 Cb 0.04 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 2c3y h ALA 909 CO -0.02 0.57 0.35 -0.07 0.00 0.00 0.00 179.25 180.07 2c3y h LEU 910 N 1.05 1.06 -0.31 0.00 4.07 -0.36 -0.46 115.31 120.36 2c3y h LEU 910 Ca 0.24 -0.16 -0.10 0.00 0.08 0.00 0.00 57.88 57.95 2c3y h LEU 910 Cb 0.21 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.67 2c3y h LEU 910 CO -0.02 0.92 -0.20 -0.61 -1.08 0.00 0.00 178.44 177.45 2c3y h GLN 911 N 1.13 0.69 -0.16 1.13 5.75 -0.49 -1.27 115.11 121.89 2c3y h GLN 911 Ca 0.27 -0.32 0.01 0.00 -0.15 0.00 0.00 58.65 58.46 2c3y h GLN 911 Cb 0.17 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 2c3y h GLN 911 CO -0.03 0.93 0.06 0.78 -2.65 0.00 0.00 178.83 177.92 2c3y h GLY 912 N 0.45 0.20 0.99 2.39 0.00 -0.75 -1.05 103.07 105.30 2c3y h GLY 912 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 2c3y h GLY 912 CO 0.06 0.03 0.29 -0.25 0.00 0.00 0.00 176.54 176.67 2c3y h TRP 913 N 0.15 0.83 -1.01 5.60 7.01 -1.05 -1.57 115.95 125.90 2c3y h TRP 913 Ca 0.07 -0.04 0.07 0.00 2.11 0.00 0.00 58.89 61.10 2c3y h TRP 913 Cb 0.03 -0.26 -0.07 0.00 -2.10 0.00 0.00 29.16 26.76 2c3y h TRP 913 CO -0.10 0.63 0.65 1.25 -2.79 0.00 0.00 178.44 178.08 2c3y h LEU 914 N 0.79 1.04 -0.39 0.65 5.85 -0.90 0.58 115.31 122.93 2c3y h LEU 914 Ca 0.20 0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.79 2c3y h LEU 914 Cb 0.10 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2c3y h LEU 914 CO -0.03 0.66 -0.69 0.00 -0.34 0.00 0.00 178.44 178.04 2c3y h ALA 915 N 1.46 0.70 0.00 1.25 0.00 -0.77 -3.33 119.26 118.56 2c3y h ALA 915 Ca 0.44 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2c3y h ALA 915 Cb 0.18 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2c3y h ALA 915 CO -0.18 0.86 -0.16 0.41 0.00 0.00 0.00 179.25 180.18 2c3y n GLY 916 N 0.81 4.84 0.41 0.00 0.00 -0.63 -4.80 105.19 105.81 2c3y n GLY 916 Ca -0.00 -1.16 0.23 0.00 0.00 0.00 0.00 46.02 45.09 2c3y n GLY 916 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2c3y h LYS 917 N 0.30 0.00 -0.65 1.61 2.10 0.02 0.84 116.57 120.79 2c3y h LYS 917 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2c3y h LYS 917 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 2c3y h LYS 917 CO 0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 2c3y n ASN 918 N -4.22 4.23 -4.37 7.07 5.03 -1.26 -4.12 115.26 117.62 2c3y n ASN 918 Ca 0.12 -2.23 -0.37 0.00 0.87 0.00 0.00 54.58 52.97 2c3y n ASN 918 Cb 0.72 -0.51 -0.13 0.00 -1.02 0.00 0.00 39.78 38.84 2c3y n ASN 918 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2c3y s ASP 919 N -0.99 5.02 0.36 6.41 3.68 0.26 -4.97 116.67 126.44 2c3y s ASP 919 Ca 0.47 -0.53 0.13 0.00 2.13 0.00 0.00 52.55 54.76 2c3y s ASP 919 Cb 0.28 -1.87 0.97 0.00 -1.45 0.00 0.00 42.92 40.84 2c3y s ASP 919 CO 0.27 -0.13 1.77 -0.65 0.13 0.00 0.00 175.17 176.56 2c3y h PRO 920 N 8.22 0.51 0.20 4.34 0.11 -1.86 0.32 132.00 143.83 2c3y h PRO 920 Ca -0.35 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 2c3y h PRO 920 Cb 1.14 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2c3y h PRO 920 CO 0.60 0.34 -0.09 0.82 -0.21 0.00 0.00 178.00 179.45 2c3y h ILE 921 N 0.52 0.00 -0.51 4.15 2.04 -1.94 -3.22 117.51 118.56 2c3y h ILE 921 Ca 0.59 -0.75 -0.06 0.00 1.00 0.00 0.00 64.86 65.64 2c3y h ILE 921 Cb 1.27 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2c3y h ILE 921 CO -0.35 0.00 0.07 0.11 0.00 0.00 0.00 178.15 177.98 2c3y h LYS 922 N -1.01 0.80 -0.88 2.37 1.79 -1.79 -0.80 116.57 117.05 2c3y h LYS 922 Ca -0.03 -0.19 -0.00 0.00 -2.18 0.00 0.00 60.65 58.25 2c3y h LYS 922 Cb 0.20 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 30.70 2c3y h LYS 922 CO 0.04 0.77 0.53 0.66 -1.08 0.00 0.00 179.45 180.37 2c3y h SER 923 N 0.76 1.05 -0.11 0.86 4.64 -0.58 -0.57 113.55 119.61 2c3y h SER 923 Ca 0.16 -0.06 -0.23 0.00 -0.47 0.00 0.00 61.79 61.19 2c3y h SER 923 Cb 0.37 -0.27 0.01 0.00 -0.31 0.00 0.00 62.40 62.20 2c3y h SER 923 CO 0.01 0.81 -0.82 0.50 -0.87 0.00 0.00 176.83 176.46 2c3y h LYS 924 N 1.21 0.75 0.36 4.77 3.64 -1.49 -0.05 116.57 125.76 2c3y h LYS 924 Ca 0.32 -0.66 -0.01 0.00 -1.27 0.00 0.00 60.65 59.03 2c3y h LYS 924 Cb -0.06 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2c3y h LYS 924 CO -0.06 1.26 -0.31 1.49 -2.27 0.00 0.00 179.45 179.56 2c3y h GLU 925 N 0.46 -0.65 0.00 1.90 4.81 -0.62 0.11 114.58 120.58 2c3y h GLU 925 Ca -0.07 0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.09 2c3y h GLU 925 Cb 1.46 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.97 2c3y h GLU 925 CO 0.17 -0.44 -0.54 1.88 -0.73 0.00 0.00 179.01 179.35 2c3y h TYR 926 N -0.68 0.00 -0.37 0.92 -1.99 -1.21 -2.92 116.97 110.72 2c3y h TYR 926 Ca -0.03 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.66 2c3y h TYR 926 Cb 0.60 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.31 2c3y h TYR 926 CO -0.16 0.54 0.06 0.78 -0.00 0.00 0.00 178.16 179.39 2c3y h GLY 927 N 2.42 0.66 1.47 3.88 0.00 -0.75 -0.69 103.07 110.06 2c3y h GLY 927 Ca -0.01 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 46.85 2c3y h GLY 927 CO 0.07 0.41 0.11 -0.55 0.00 0.00 0.00 176.54 176.57 2c3y h ASP 928 N 0.45 0.62 -0.41 0.19 3.32 -0.72 0.37 116.42 120.24 2c3y h ASP 928 Ca 0.11 -0.10 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 2c3y h ASP 928 Cb 0.36 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 2c3y h ASP 928 CO 0.01 0.62 -0.19 0.11 -1.72 0.00 0.00 179.24 178.06 2c3y h LYS 929 N 0.65 0.90 -0.56 3.56 1.57 -1.30 -2.51 116.57 118.88 2c3y h LYS 929 Ca 0.15 -0.36 -0.06 0.00 -1.87 0.00 0.00 60.65 58.51 2c3y h LYS 929 Cb 0.25 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2c3y h LYS 929 CO -0.00 1.01 0.13 1.25 -0.57 0.00 0.00 179.45 181.27 2c3y h LEU 930 N 0.79 0.82 -1.19 2.94 5.85 -0.17 0.90 115.31 125.25 2c3y h LEU 930 Ca 0.11 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 2c3y h LEU 930 Cb 0.74 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 2c3y h LEU 930 CO 0.06 0.81 0.03 0.11 -0.34 0.00 0.00 178.44 179.11 2c3y h LYS 931 N 0.84 0.59 0.03 1.25 1.57 -0.65 -0.50 116.57 119.70 2c3y h LYS 931 Ca 0.18 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2c3y h LYS 931 Cb 0.32 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2c3y h LYS 931 CO 0.00 0.59 -0.02 0.87 -0.57 0.00 0.00 179.45 180.32 2c3y h LYS 932 N 0.57 -0.04 -0.15 3.15 1.57 -0.97 -3.08 116.57 117.61 2c3y h LYS 932 Ca 0.12 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2c3y h LYS 932 Cb 0.32 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 2c3y h LYS 932 CO 0.01 0.65 0.04 -0.07 -0.57 0.00 0.00 179.45 179.50 2c3y h LEU 933 N -0.85 0.18 -2.75 2.94 3.38 -0.77 -2.75 115.31 114.69 2c3y h LEU 933 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2c3y h LEU 933 Cb 0.71 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2c3y h LEU 933 CO 0.01 0.18 0.00 0.18 0.09 0.00 0.00 178.44 178.90 2c3y n LEU 934 N -4.46 3.84 -4.68 1.67 4.77 -0.20 -4.96 117.00 112.98 2c3y n LEU 934 Ca -0.01 -1.98 -0.46 0.00 -0.03 0.00 0.00 56.01 53.54 2c3y n LEU 934 Cb 0.12 -0.45 -0.04 0.00 -2.33 0.00 0.00 43.42 40.72 2c3y n LEU 934 CO 0.35 0.95 1.32 0.00 -1.33 0.00 0.00 177.39 178.69 2c3y n ALA 935 N 1.53 1.45 0.00 -1.18 0.00 -1.04 -0.88 120.51 120.39 2c3y n ALA 935 Ca 0.23 0.38 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2c3y n ALA 935 Cb 0.60 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2c3y n ALA 935 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3y n GLY 936 N 3.82 3.29 3.68 0.00 0.00 -1.26 -5.02 105.19 109.71 2c3y n GLY 936 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 2c3y n GLY 936 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2c3y n GLN 937 N -1.81 2.61 0.00 1.61 1.13 -0.05 -4.83 117.38 116.03 2c3y n GLN 937 Ca 0.00 0.95 0.00 0.00 -1.94 0.00 0.00 57.00 56.01 2c3y n GLN 937 Cb 0.00 -2.84 0.00 0.00 0.11 0.00 0.00 30.24 27.51 2c3y n GLN 937 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2c3y n LYS 938 N 6.14 2.00 -4.36 -1.09 4.01 -1.26 -4.55 118.16 119.04 2c3y n LYS 938 Ca 0.20 -0.08 -0.25 0.00 -0.51 0.00 0.00 58.31 57.67 2c3y n LYS 938 Cb 0.35 -0.40 -0.09 0.00 -0.51 0.00 0.00 35.03 34.38 2c3y n LYS 938 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2c3y s ASP 939 N -0.31 4.03 0.74 4.39 -0.00 -1.26 -4.71 116.67 119.55 2c3y s ASP 939 Ca 0.00 -0.75 0.00 0.00 -0.00 0.00 0.00 52.55 51.80 2c3y s ASP 939 Cb 0.00 -0.57 0.00 0.00 -0.00 0.00 0.00 42.92 42.35 2c3y s ASP 939 CO 0.00 0.07 0.00 0.61 -0.00 0.00 0.00 175.17 175.85 2c3y n GLY 940 N -0.31 0.86 0.20 0.21 0.00 -1.26 -0.77 105.19 104.11 2c3y n GLY 940 Ca -0.09 -0.81 -0.04 0.00 0.00 0.00 0.00 46.02 45.09 2c3y n GLY 940 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2c3y h LEU 941 N 0.00 0.29 -1.49 0.99 3.38 -1.97 -1.92 115.31 114.59 2c3y h LEU 941 Ca 0.00 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.06 2c3y h LEU 941 Cb 0.00 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 2c3y h LEU 941 CO 0.00 0.21 0.40 -0.07 0.09 0.00 0.00 178.44 179.07 2c3y h LEU 942 N 0.44 0.55 -0.36 1.67 4.07 -1.95 0.29 115.31 120.02 2c3y h LEU 942 Ca 0.22 -0.00 -0.07 0.00 0.08 0.00 0.00 57.88 58.11 2c3y h LEU 942 Cb 0.16 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.76 2c3y h LEU 942 CO -0.17 0.37 -0.05 1.23 -1.08 0.00 0.00 178.44 178.73 2c3y h GLY 943 N 0.64 0.72 0.96 0.83 0.00 -0.19 -0.36 103.07 105.67 2c3y h GLY 943 Ca 0.26 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.99 2c3y h GLY 943 CO -0.07 0.52 0.16 1.46 0.00 0.00 0.00 176.54 178.61 2c3y h GLN 944 N 0.46 0.69 -0.48 4.80 4.20 -0.74 -2.26 115.11 121.78 2c3y h GLN 944 Ca 0.09 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2c3y h GLN 944 Cb 0.54 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 2c3y h GLN 944 CO 0.03 0.65 0.25 0.82 -0.67 0.00 0.00 178.83 179.91 2c3y h ILE 945 N 0.59 1.17 -0.87 2.54 2.04 -0.90 -2.74 117.51 119.35 2c3y h ILE 945 Ca 0.15 -0.46 0.06 0.00 1.00 0.00 0.00 64.86 65.61 2c3y h ILE 945 Cb 0.23 0.60 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 2c3y h ILE 945 CO -0.01 0.19 0.54 0.00 0.00 0.00 0.00 178.15 178.87 2c3y h ALA 946 N 1.10 1.18 0.00 1.87 0.00 -0.85 -1.11 119.26 121.45 2c3y h ALA 946 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2c3y h ALA 946 Cb 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2c3y h ALA 946 CO -0.03 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.54 2c3y n ALA 947 N -2.35 1.74 -1.16 0.00 0.00 -0.87 -2.84 120.51 115.02 2c3y n ALA 947 Ca 0.12 -0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 2c3y n ALA 947 Cb 0.16 -1.23 0.25 0.00 0.00 0.00 0.00 19.45 18.63 2c3y n ALA 947 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2c3y n MET 948 N -1.38 2.80 0.29 0.00 2.00 -0.42 -4.69 117.12 115.73 2c3y n MET 948 Ca 0.05 -3.03 0.15 0.00 0.00 0.00 0.00 57.70 54.87 2c3y n MET 948 Cb 0.13 -1.97 0.88 0.00 0.00 0.00 0.00 33.22 32.27 2c3y n MET 948 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2c3y h SER 949 N 1.77 0.00 0.00 7.83 4.64 -1.62 -1.23 113.55 124.95 2c3y h SER 949 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2c3y h SER 949 Cb 1.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.94 2c3y h SER 949 CO 0.47 0.04 0.00 -0.90 -0.87 0.00 0.00 176.83 175.57 2c3y n ASP 950 N -3.73 0.00 -0.08 4.97 5.68 -1.26 -2.23 116.55 119.90 2c3y n ASP 950 Ca -0.03 -1.29 0.02 0.00 -0.50 0.00 0.00 54.79 52.99 2c3y n ASP 950 Cb 0.13 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.11 2c3y n ASP 950 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2c3y n LEU 951 N -0.70 0.74 0.31 -2.12 4.77 -0.46 -4.81 117.00 114.73 2c3y n LEU 951 Ca 0.08 -0.74 -0.16 0.00 -0.03 0.00 0.00 56.01 55.16 2c3y n LEU 951 Cb 0.04 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.04 2c3y n LEU 951 CO 0.06 0.16 0.52 1.88 -1.33 0.00 0.00 177.39 178.69 2c3y h TYR 952 N 0.40 -1.18 -3.77 -1.77 0.99 -1.49 -3.43 116.97 106.72 2c3y h TYR 952 Ca 0.00 -0.00 -0.49 0.00 2.00 0.00 0.00 58.73 60.24 2c3y h TYR 952 Cb 0.13 0.44 -0.02 0.00 1.00 0.00 0.00 36.73 38.28 2c3y h TYR 952 CO 0.00 -0.61 0.28 -0.08 -0.00 0.00 0.00 178.16 177.75 2c3y s THR 953 N -5.47 4.29 0.08 -2.88 -1.32 -1.26 -4.67 115.64 104.41 2c3y s THR 953 Ca -0.16 1.71 -0.33 0.00 -1.21 0.00 0.00 61.69 61.71 2c3y s THR 953 Cb 0.03 -4.02 -0.12 0.00 -1.51 0.00 0.00 72.50 66.89 2c3y s THR 953 CO 0.51 0.22 1.78 1.17 -2.21 0.00 0.00 174.62 176.09 2c3y n LYS 954 N 0.77 2.45 -2.90 7.08 3.00 -1.26 -4.97 118.16 122.32 2c3y n LYS 954 Ca -0.00 0.89 -0.24 0.00 -0.00 0.00 0.00 58.31 58.96 2c3y n LYS 954 Cb 0.50 -2.74 0.01 0.00 0.00 0.00 0.00 35.03 32.80 2c3y n LYS 954 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2c3y s LYS 955 N 2.58 3.11 -0.24 1.64 -0.14 -1.26 -4.79 119.74 120.65 2c3y s LYS 955 Ca 0.84 -0.36 0.02 0.00 -1.36 0.00 0.00 55.97 55.11 2c3y s LYS 955 Cb -0.59 -2.51 0.05 0.00 -1.68 0.00 0.00 37.83 33.09 2c3y s LYS 955 CO 0.41 -0.30 -0.13 0.45 -0.76 0.00 0.00 175.35 175.03 2c3y s SER 956 N -4.21 4.07 -0.29 2.83 0.15 0.21 -5.00 113.70 111.47 2c3y s SER 956 Ca 0.48 -1.14 -0.19 0.00 0.70 0.00 0.00 55.95 55.80 2c3y s SER 956 Cb -0.10 -1.54 -0.02 0.00 -1.71 0.00 0.00 66.02 62.65 2c3y s SER 956 CO 0.39 -0.13 0.56 -0.69 1.20 0.00 0.00 173.24 174.57 2c3y s VAL 957 N 1.18 5.01 0.05 4.45 1.01 -1.26 -0.67 120.40 130.17 2c3y s VAL 957 Ca -0.04 0.81 0.09 0.00 0.00 0.00 0.00 61.98 62.84 2c3y s VAL 957 Cb -0.18 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2c3y s VAL 957 CO -0.07 -0.03 -0.26 0.26 0.00 0.00 0.00 175.10 175.00 2c3y s TRP 958 N 2.43 2.33 -0.22 5.22 0.52 -0.49 -0.81 118.94 127.93 2c3y s TRP 958 Ca 0.22 -0.40 0.00 0.00 0.02 0.00 0.00 56.10 55.94 2c3y s TRP 958 Cb -0.15 -1.39 0.03 0.00 -1.15 0.00 0.00 33.47 30.80 2c3y s TRP 958 CO 0.11 0.14 -0.13 0.42 0.02 0.00 0.00 176.95 177.51 2c3y s ILE 959 N -0.82 2.44 -0.08 2.03 1.01 0.11 -0.91 121.20 124.98 2c3y s ILE 959 Ca 0.12 -1.06 -0.03 0.00 0.00 0.00 0.00 60.65 59.68 2c3y s ILE 959 Cb -0.10 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 2c3y s ILE 959 CO 0.02 0.32 0.05 -0.36 0.00 0.00 0.00 174.94 174.97 2c3y s PHE 960 N 1.28 3.29 -0.09 3.97 2.99 -0.12 -0.45 117.98 128.86 2c3y s PHE 960 Ca 0.01 0.28 -0.32 0.00 0.00 0.00 0.00 56.93 56.90 2c3y s PHE 960 Cb -0.16 -1.82 0.12 0.00 0.00 0.00 0.00 43.02 41.17 2c3y s PHE 960 CO -0.08 0.55 1.12 0.20 -0.00 0.00 0.00 175.22 177.01 2c3y s GLY 961 N -1.05 -0.35 0.48 4.36 0.00 -1.04 -0.41 107.32 109.32 2c3y s GLY 961 Ca 0.15 1.17 0.00 0.00 0.00 0.00 0.00 44.72 46.05 2c3y s GLY 961 CO 0.04 0.37 0.66 0.61 0.00 0.00 0.00 173.10 174.78 2c3y n GLY 962 N -0.23 0.79 0.22 0.20 0.00 -1.26 -1.02 105.19 103.88 2c3y n GLY 962 Ca -0.04 -2.02 -0.03 0.00 0.00 0.00 0.00 46.02 43.93 2c3y n GLY 962 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2c3y h ASP 963 N -0.36 0.39 -0.39 1.61 2.03 -1.83 -1.72 116.42 116.14 2c3y h ASP 963 Ca -0.22 -0.15 0.01 0.00 -0.73 0.00 0.00 57.03 55.94 2c3y h ASP 963 Cb 0.82 -0.11 -0.02 0.00 -0.83 0.00 0.00 39.33 39.19 2c3y h ASP 963 CO 0.24 0.71 0.25 1.23 -1.03 0.00 0.00 179.24 180.64 2c3y h GLY 964 N 1.10 0.55 0.85 7.15 0.00 -1.90 0.22 103.07 111.04 2c3y h GLY 964 Ca 0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 2c3y h GLY 964 CO 0.06 0.18 -0.31 -0.25 0.00 0.00 0.00 176.54 176.22 2c3y h TRP 965 N 0.50 -0.80 -0.53 5.60 7.01 -1.85 -1.89 115.95 123.99 2c3y h TRP 965 Ca 0.15 -0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.06 2c3y h TRP 965 Cb -0.03 0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 2c3y h TRP 965 CO -0.06 -0.46 0.04 0.00 -2.79 0.00 0.00 178.44 175.17 2c3y h ALA 966 N -0.78 1.07 0.00 2.65 0.00 -1.22 0.29 119.26 121.26 2c3y h ALA 966 Ca -0.09 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 2c3y h ALA 966 Cb 0.70 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2c3y h ALA 966 CO 0.15 0.59 -1.33 0.66 0.00 0.00 0.00 179.25 179.32 2c3y n TYR 967 N -4.22 0.85 0.00 0.00 4.02 0.76 -3.83 117.16 114.75 2c3y n TYR 967 Ca 0.03 0.27 0.00 0.00 -0.01 0.00 0.00 57.90 58.19 2c3y n TYR 967 Cb 0.29 -0.97 0.00 0.00 -0.02 0.00 0.00 39.34 38.64 2c3y n TYR 967 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2c3y n ASP 968 N -2.73 0.00 -0.20 7.72 10.43 -0.72 -4.75 116.55 126.30 2c3y n ASP 968 Ca -0.06 0.00 -0.03 0.00 2.57 0.00 0.00 54.79 57.28 2c3y n ASP 968 Cb 0.70 0.00 0.08 0.00 1.84 0.00 0.00 41.12 43.74 2c3y n ASP 968 CO 0.00 0.00 0.00 -0.29 -1.07 0.00 0.00 177.20 175.84 2c3y h ILE 969 N 0.00 0.95 -0.23 0.53 2.10 -1.30 -2.67 117.51 116.89 2c3y h ILE 969 Ca 0.00 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.74 2c3y h ILE 969 Cb 0.00 0.31 0.00 0.00 -1.09 0.00 0.00 36.82 36.04 2c3y h ILE 969 CO 0.00 0.11 0.00 0.61 -1.08 0.00 0.00 178.15 177.79 2c3y n GLY 970 N -1.27 0.63 0.20 8.18 0.00 0.99 -4.44 105.19 109.48 2c3y n GLY 970 Ca 0.07 -0.49 -0.04 0.00 0.00 0.00 0.00 46.02 45.56 2c3y n GLY 970 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2c3y h TYR 971 N 2.72 0.42 -0.83 1.61 3.20 -1.25 -0.73 116.97 122.10 2c3y h TYR 971 Ca 0.00 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.95 2c3y h TYR 971 Cb 0.60 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.69 2c3y h TYR 971 CO 0.14 0.20 0.51 0.78 -1.64 0.00 0.00 178.16 178.15 2c3y h GLY 972 N 0.46 1.25 1.35 1.82 0.00 -1.79 0.80 103.07 106.96 2c3y h GLY 972 Ca 0.22 -0.37 -0.18 0.00 0.00 0.00 0.00 47.33 47.01 2c3y h GLY 972 CO -0.17 0.25 -0.57 -1.33 0.00 0.00 0.00 176.54 174.71 2c3y h GLY 973 N 0.93 0.75 0.80 4.60 0.00 -1.74 -2.33 103.07 106.08 2c3y h GLY 973 Ca 0.37 -0.89 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 2c3y h GLY 973 CO -0.18 0.80 0.01 -2.00 0.00 0.00 0.00 176.54 175.17 2c3y h LEU 974 N 0.52 0.03 -0.38 3.11 5.85 -0.69 -0.63 115.31 123.11 2c3y h LEU 974 Ca 0.00 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.59 2c3y h LEU 974 Cb 1.15 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 2c3y h LEU 974 CO 0.12 0.23 -0.04 -0.78 -0.34 0.00 0.00 178.44 177.63 2c3y h ASP 975 N -0.18 -0.24 -0.44 1.25 1.82 -0.87 -0.08 116.42 117.68 2c3y h ASP 975 Ca 0.01 0.10 -0.01 0.00 -0.39 0.00 0.00 57.03 56.73 2c3y h ASP 975 Cb 0.21 0.19 -0.02 0.00 0.68 0.00 0.00 39.33 40.39 2c3y h ASP 975 CO -0.00 -0.08 0.22 -0.74 -1.61 0.00 0.00 179.24 177.04 2c3y h HIS 976 N 0.06 0.62 -0.74 0.28 2.76 -1.24 -1.24 115.15 115.65 2c3y h HIS 976 Ca 0.19 -0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.28 2c3y h HIS 976 Cb 0.28 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 29.01 2c3y h HIS 976 CO -0.29 0.49 0.25 0.28 -1.30 0.00 0.00 177.93 177.36 2c3y h VAL 977 N 0.57 1.26 -0.54 5.26 2.07 -0.60 -1.89 116.25 122.39 2c3y h VAL 977 Ca 0.15 -0.88 -0.10 0.00 0.82 0.00 0.00 66.70 66.69 2c3y h VAL 977 Cb 0.09 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2c3y h VAL 977 CO -0.02 0.35 -0.06 -0.07 0.02 0.00 0.00 177.57 177.78 2c3y h LEU 978 N 1.10 0.98 -2.15 2.57 3.38 -0.81 -2.73 115.31 117.65 2c3y h LEU 978 Ca 0.24 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2c3y h LEU 978 Cb 0.28 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2c3y h LEU 978 CO -0.01 1.08 0.00 0.00 0.09 0.00 0.00 178.44 179.60 2c3y h ALA 979 N 0.93 1.00 -0.19 1.53 0.00 -0.87 -2.77 119.26 118.90 2c3y h ALA 979 Ca 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 2c3y h ALA 979 Cb 0.62 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2c3y h ALA 979 CO 0.04 0.00 -0.13 0.66 0.00 0.00 0.00 179.25 179.82 2c3y h SER 980 N 0.00 0.29 0.00 0.00 4.64 -1.02 -3.47 113.55 113.99 2c3y h SER 980 Ca 0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2c3y h SER 980 Cb 0.27 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2c3y h SER 980 CO 0.00 0.45 0.00 0.61 -0.87 0.00 0.00 176.83 177.02 2c3y n GLY 981 N -0.81 0.69 3.87 -0.77 0.00 -1.05 -5.05 105.19 102.08 2c3y n GLY 981 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2c3y n GLY 981 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c3y s GLU 982 N -0.33 3.12 -1.10 1.61 0.41 -1.26 -4.25 118.70 116.90 2c3y s GLU 982 Ca 0.00 0.59 -0.21 0.00 -0.41 0.00 0.00 54.97 54.94 2c3y s GLU 982 Cb 0.00 -2.04 0.07 0.00 -1.78 0.00 0.00 34.13 30.38 2c3y s GLU 982 CO 0.00 -0.88 1.49 0.34 -0.49 0.00 0.00 175.26 175.72 2c3y s ASP 983 N -4.26 6.64 0.08 -0.19 3.68 -1.26 -1.32 116.67 120.04 2c3y s ASP 983 Ca 0.57 -1.89 0.02 0.00 2.13 0.00 0.00 52.55 53.38 2c3y s ASP 983 Cb -0.11 -2.54 -0.04 0.00 -1.45 0.00 0.00 42.92 38.78 2c3y s ASP 983 CO 0.53 -1.31 -0.07 0.68 0.13 0.00 0.00 175.17 175.13 2c3y s VAL 984 N 4.28 0.61 -0.14 1.11 -7.23 -1.24 -4.67 120.40 113.11 2c3y s VAL 984 Ca 0.46 -1.69 0.01 0.00 -1.81 0.00 0.00 61.98 58.95 2c3y s VAL 984 Cb 0.00 -1.38 0.02 0.00 0.56 0.00 0.00 36.38 35.59 2c3y s VAL 984 CO -0.04 -0.75 -0.16 0.20 -0.31 0.00 0.00 175.10 174.03 2c3y s ASN 985 N -2.64 2.75 -0.21 4.85 0.01 0.01 -1.71 114.94 118.00 2c3y s ASN 985 Ca 0.06 -0.51 -0.06 0.00 -0.71 0.00 0.00 52.86 51.64 2c3y s ASN 985 Cb 0.01 -1.23 -0.03 0.00 0.41 0.00 0.00 41.25 40.41 2c3y s ASN 985 CO -0.04 -0.02 0.02 0.54 -1.51 0.00 0.00 177.10 176.09 2c3y s VAL 986 N 1.30 4.16 -0.26 1.60 0.11 -0.05 0.09 120.40 127.35 2c3y s VAL 986 Ca 0.02 -0.24 -0.01 0.00 -2.93 0.00 0.00 61.98 58.81 2c3y s VAL 986 Cb -0.13 -2.89 0.03 0.00 -1.53 0.00 0.00 36.38 31.86 2c3y s VAL 986 CO -0.09 0.42 -0.06 0.12 -3.33 0.00 0.00 175.10 172.16 2c3y s PHE 987 N 1.00 3.11 -0.26 1.54 5.36 0.41 -0.75 117.98 128.38 2c3y s PHE 987 Ca 0.02 -1.69 -0.10 0.00 -0.96 0.00 0.00 56.93 54.20 2c3y s PHE 987 Cb -0.14 -2.05 -0.04 0.00 -0.34 0.00 0.00 43.02 40.45 2c3y s PHE 987 CO 0.02 -0.76 0.15 0.08 -1.46 0.00 0.00 175.22 173.25 2c3y s VAL 988 N 1.29 5.02 -0.59 3.12 1.01 0.28 -2.49 120.40 128.04 2c3y s VAL 988 Ca -0.02 0.07 -0.17 0.00 0.00 0.00 0.00 61.98 61.86 2c3y s VAL 988 Cb -0.17 -3.37 0.12 0.00 0.00 0.00 0.00 36.38 32.96 2c3y s VAL 988 CO -0.04 0.29 0.62 -0.04 0.00 0.00 0.00 175.10 175.93 2c3y s MET 989 N 1.59 3.06 -0.57 2.72 -1.94 -0.19 -0.55 119.30 123.43 2c3y s MET 989 Ca 0.07 -1.59 -0.24 0.00 -1.71 0.00 0.00 55.69 52.22 2c3y s MET 989 Cb -0.15 -4.31 0.04 0.00 2.01 0.00 0.00 34.83 32.42 2c3y s MET 989 CO 0.08 -1.43 0.96 0.34 -0.01 0.00 0.00 175.02 174.96 2c3y s ASP 990 N 3.53 6.31 0.00 3.03 -1.08 -0.46 -2.81 116.67 125.18 2c3y s ASP 990 Ca 0.08 -0.43 0.23 0.00 -0.52 0.00 0.00 52.55 51.92 2c3y s ASP 990 Cb -0.26 -2.44 0.48 0.00 -1.46 0.00 0.00 42.92 39.24 2c3y s ASP 990 CO 0.03 -1.28 1.42 0.35 0.52 0.00 0.00 175.17 176.22 2c3y n THR 991 N 6.18 0.33 -2.12 1.71 -2.24 -1.26 -1.48 114.28 115.40 2c3y n THR 991 Ca 0.01 -0.60 -0.21 0.00 -2.27 0.00 0.00 64.05 60.98 2c3y n THR 991 Cb 0.47 0.93 -0.04 0.00 -2.10 0.00 0.00 70.33 69.59 2c3y n THR 991 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2c3y n GLU 992 N 1.18 -1.60 -3.59 -0.78 1.02 -1.26 -4.86 120.64 110.75 2c3y n GLU 992 Ca 0.18 1.10 -0.05 0.00 -0.02 0.00 0.00 57.16 58.36 2c3y n GLU 992 Cb 0.54 -5.67 -0.02 0.00 -0.02 0.00 0.00 31.44 26.27 2c3y n GLU 992 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2c3y s VAL 993 N -2.95 0.00 -0.77 2.62 0.11 -1.26 -3.87 120.40 114.28 2c3y s VAL 993 Ca 0.00 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.78 2c3y s VAL 993 Cb 0.00 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.88 2c3y s VAL 993 CO 0.00 0.00 1.31 -0.31 -3.33 0.00 0.00 175.10 172.77 2c3y s TYR 994 N -2.31 2.30 -0.01 1.54 1.51 0.65 -4.62 117.35 116.41 2c3y s TYR 994 Ca 0.08 -0.13 -0.20 0.00 -1.01 0.00 0.00 57.07 55.80 2c3y s TYR 994 Cb -0.01 -4.63 -0.11 0.00 -0.11 0.00 0.00 41.96 37.10 2c3y s TYR 994 CO -0.05 -2.07 0.84 0.77 -1.11 0.00 0.00 175.55 173.93 2c3y h SER 995 N 10.05 -0.62 -0.82 2.29 0.02 -1.94 0.66 113.55 123.19 2c3y h SER 995 Ca -0.22 0.02 0.19 0.00 -0.84 0.00 0.00 61.79 60.94 2c3y h SER 995 Cb 1.05 0.16 -0.12 0.00 0.14 0.00 0.00 62.40 63.63 2c3y h SER 995 CO 1.30 -0.21 0.29 -1.13 -1.14 0.00 0.00 176.83 175.93 2c3y h ASN 996 N -1.19 0.17 0.66 3.07 -1.24 -1.93 -1.06 115.58 114.05 2c3y h ASN 996 Ca -0.07 0.15 0.00 0.00 0.71 0.00 0.00 56.30 57.09 2c3y h ASN 996 Cb 0.56 0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.78 2c3y h ASN 996 CO 0.12 -0.02 0.00 0.35 -1.29 0.00 0.00 177.43 176.59 2c3y n THR 997 N -5.10 0.33 0.00 -3.57 -2.24 -1.26 -4.86 114.28 97.57 2c3y n THR 997 Ca 0.18 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 2c3y n THR 997 Cb 0.56 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 68.11 2c3y n THR 997 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3y n GLY 998 N 0.85 1.65 2.33 3.38 0.00 -0.41 -4.87 105.19 108.10 2c3y n GLY 998 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 2c3y n GLY 998 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c3y n GLY 999 N 0.00 0.21 3.83 -0.02 0.00 0.19 -4.77 105.19 104.64 2c3y n GLY 999 Ca 0.00 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 2c3y n GLY 999 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c3y s GLN 1000N -5.26 4.11 0.50 1.61 1.11 -1.03 -1.69 119.66 119.01 2c3y s GLN 1000Ca 0.17 0.75 -0.23 0.00 0.01 0.00 0.00 55.36 56.06 2c3y s GLN 1000Cb -0.08 -2.64 -0.06 0.00 -1.01 0.00 0.00 33.01 29.22 2c3y s GLN 1000CO 0.33 0.27 1.34 0.45 0.01 0.00 0.00 175.29 177.69 2c3y s SER 1001N -1.99 5.65 0.39 5.90 0.15 -0.30 -0.25 113.70 123.26 2c3y s SER 1001Ca 0.49 2.73 0.04 0.00 0.70 0.00 0.00 55.95 59.90 2c3y s SER 1001Cb -0.13 -2.64 -0.03 0.00 -1.71 0.00 0.00 66.02 61.52 2c3y s SER 1001CO 0.19 -1.31 0.14 -0.94 1.20 0.00 0.00 173.24 172.52 2c3y s SER 1002N -0.88 2.57 0.00 5.45 1.04 -1.26 -4.73 113.70 115.89 2c3y s SER 1002Ca 0.66 -1.66 0.21 0.00 0.48 0.00 0.00 55.95 55.64 2c3y s SER 1002Cb -0.39 0.47 1.03 0.00 0.10 0.00 0.00 66.02 67.23 2c3y s SER 1002CO 0.48 -0.92 1.65 0.29 0.98 0.00 0.00 173.24 175.72 2c3y n LYS 1003N -0.85 0.27 0.00 4.02 5.02 -1.26 -1.82 118.16 123.54 2c3y n LYS 1003Ca -0.04 0.10 0.12 0.00 -2.02 0.00 0.00 58.31 56.47 2c3y n LYS 1003Cb 0.65 -1.50 0.29 0.00 -0.02 0.00 0.00 35.03 34.45 2c3y n LYS 1003CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2c3y n ALA 1004N -1.30 3.40 -2.06 7.82 0.00 -1.26 -0.79 120.51 126.32 2c3y n ALA 1004Ca 0.09 -0.35 -0.41 0.00 0.00 0.00 0.00 53.44 52.77 2c3y n ALA 1004Cb 0.17 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 2c3y n ALA 1004CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2c3y s THR 1005N -2.89 3.35 0.64 0.00 2.01 -0.75 -4.68 115.64 113.32 2c3y s THR 1005Ca 0.14 1.09 -0.10 0.00 0.31 0.00 0.00 61.69 63.14 2c3y s THR 1005Cb 0.18 -3.70 -0.01 0.00 0.01 0.00 0.00 72.50 68.98 2c3y s THR 1005CO 0.65 0.15 1.01 -2.16 -0.69 0.00 0.00 174.62 173.59 2c3y s PRO 1006N 0.04 3.16 0.16 4.92 0.04 -1.26 -3.76 135.00 138.30 2c3y s PRO 1006Ca 0.57 0.44 -0.34 0.00 0.04 0.00 0.00 61.00 61.70 2c3y s PRO 1006Cb -0.35 -2.12 -0.14 0.00 0.04 0.00 0.00 34.50 31.93 2c3y s PRO 1006CO 0.37 -0.75 1.51 2.41 0.04 0.00 0.00 177.00 180.58 2c3y n THR 1007N -2.78 0.17 -0.29 1.26 -1.04 -1.24 -2.31 114.28 108.04 2c3y n THR 1007Ca 0.06 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2c3y n THR 1007Cb 0.56 -1.43 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 2c3y n THR 1007CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2c3y n GLY 1008N 3.08 1.99 3.74 3.41 0.00 0.11 -4.82 105.19 112.70 2c3y n GLY 1008Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2c3y n GLY 1008CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y s ALA 1009N -3.15 3.34 -0.05 4.61 0.00 -0.98 -4.41 121.76 121.12 2c3y s ALA 1009Ca 0.00 0.72 -0.19 0.00 0.00 0.00 0.00 51.96 52.49 2c3y s ALA 1009Cb 0.00 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.77 2c3y s ALA 1009CO 0.00 -0.06 0.53 0.08 0.00 0.00 0.00 175.76 176.31 2c3y s VAL 1010N -0.51 5.04 0.26 0.00 1.01 0.57 -1.17 120.40 125.61 2c3y s VAL 1010Ca 0.46 1.09 -0.21 0.00 0.00 0.00 0.00 61.98 63.32 2c3y s VAL 1010Cb -0.27 -3.86 0.03 0.00 0.00 0.00 0.00 36.38 32.27 2c3y s VAL 1010CO 0.34 0.39 0.70 0.00 0.00 0.00 0.00 175.10 176.53 2c3y s ALA 1011N 0.08 -1.29 0.34 5.51 0.00 -0.99 -4.79 121.76 120.62 2c3y s ALA 1011Ca 0.28 -0.16 -0.29 0.00 0.00 0.00 0.00 51.96 51.80 2c3y s ALA 1011Cb -0.17 0.86 -0.11 0.00 0.00 0.00 0.00 23.12 23.70 2c3y s ALA 1011CO 0.14 -0.99 1.49 0.15 0.00 0.00 0.00 175.76 176.55 2c3y s LYS 1012N -3.88 4.15 -0.22 0.00 -0.14 -0.68 -0.30 119.74 118.67 2c3y s LYS 1012Ca 0.09 2.51 0.00 0.00 -1.36 0.00 0.00 55.97 57.22 2c3y s LYS 1012Cb -0.05 -3.00 0.00 0.00 -1.68 0.00 0.00 37.83 33.10 2c3y s LYS 1012CO 0.03 -0.51 0.00 1.19 -0.76 0.00 0.00 175.35 175.30 2c3y n PHE 1013N 1.04 0.00 -2.69 3.18 0.99 -1.26 -1.15 117.46 117.57 2c3y n PHE 1013Ca 0.03 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.41 2c3y n PHE 1013Cb 0.39 -0.84 0.08 0.00 -1.00 0.00 0.00 39.48 38.11 2c3y n PHE 1013CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2c3y n ALA 1014N 1.04 2.25 0.28 4.37 0.00 0.59 -4.87 120.51 124.16 2c3y n ALA 1014Ca -0.02 -2.04 0.07 0.00 0.00 0.00 0.00 53.44 51.45 2c3y n ALA 1014Cb 0.16 -0.96 0.34 0.00 0.00 0.00 0.00 19.45 19.00 2c3y n ALA 1014CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c3y n ALA 1015N -0.46 1.37 -1.60 0.00 0.00 -1.11 -2.03 120.51 116.68 2c3y n ALA 1015Ca 0.01 0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.56 2c3y n ALA 1015Cb 0.84 -1.24 0.12 0.00 0.00 0.00 0.00 19.45 19.17 2c3y n ALA 1015CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c3y n ALA 1016N -1.63 2.65 0.00 0.00 0.00 -1.26 -4.96 120.51 115.30 2c3y n ALA 1016Ca 0.01 -2.50 0.00 0.00 0.00 0.00 0.00 53.44 50.95 2c3y n ALA 1016Cb 0.12 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2c3y n ALA 1016CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3y n GLY 1017N -0.81 -0.83 3.71 0.00 0.00 -0.86 -4.93 105.19 101.47 2c3y n GLY 1017Ca 0.13 -1.18 -0.43 0.00 0.00 0.00 0.00 46.02 44.54 2c3y n GLY 1017CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2c3y n LYS 1018N 1.20 2.67 -0.50 1.61 4.81 -0.31 -4.65 118.16 122.99 2c3y n LYS 1018Ca 0.00 0.96 0.11 0.00 -0.87 0.00 0.00 58.31 58.51 2c3y n LYS 1018Cb 0.00 -2.79 0.34 0.00 0.02 0.00 0.00 35.03 32.60 2c3y n LYS 1018CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2c3y n ARG 1019N 3.72 3.21 -4.43 1.64 5.12 -1.26 0.08 116.66 124.73 2c3y n ARG 1019Ca 0.16 -2.76 -0.22 0.00 -1.93 0.00 0.00 57.85 53.10 2c3y n ARG 1019Cb 0.34 -1.73 -0.14 0.00 -1.16 0.00 0.00 32.46 29.77 2c3y n ARG 1019CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2c3y s THR 1020N -1.42 1.27 1.00 0.55 -4.23 -1.26 -5.02 115.64 106.52 2c3y s THR 1020Ca 0.50 -1.05 -0.13 0.00 -1.18 0.00 0.00 61.69 59.83 2c3y s THR 1020Cb 0.29 -1.13 0.19 0.00 1.34 0.00 0.00 72.50 73.19 2c3y s THR 1020CO 0.29 0.06 1.12 -0.83 -0.54 0.00 0.00 174.62 174.72 2c3y s GLY 1021N -1.14 1.57 0.22 3.99 0.00 -1.26 -3.71 107.32 106.99 2c3y s GLY 1021Ca 0.03 -0.52 -0.30 0.00 0.00 0.00 0.00 44.72 43.94 2c3y s GLY 1021CO 0.01 0.12 1.31 1.25 0.00 0.00 0.00 173.10 175.79 2c3y s LYS 1022N -5.14 4.38 0.24 2.90 2.20 -1.25 -4.77 119.74 118.31 2c3y s LYS 1022Ca 0.66 2.08 -0.30 0.00 -0.36 0.00 0.00 55.97 58.06 2c3y s LYS 1022Cb -0.16 -3.17 -0.09 0.00 -1.51 0.00 0.00 37.83 32.89 2c3y s LYS 1022CO 0.56 -0.24 1.29 0.21 -0.36 0.00 0.00 175.35 176.81 2c3y s LYS 1023N -0.38 4.41 -1.23 4.03 2.20 0.03 -4.93 119.74 123.86 2c3y s LYS 1023Ca 0.55 2.07 -0.12 0.00 -0.36 0.00 0.00 55.97 58.12 2c3y s LYS 1023Cb -0.37 -3.16 0.18 0.00 -1.51 0.00 0.00 37.83 32.97 2c3y s LYS 1023CO 0.40 -0.18 1.60 -3.47 -0.36 0.00 0.00 175.35 173.33 2c3y n ASP 1024N 1.98 5.22 -0.25 1.43 -0.08 -1.26 -4.81 116.55 118.78 2c3y n ASP 1024Ca 0.04 -3.04 -0.03 0.00 -1.51 0.00 0.00 54.79 50.25 2c3y n ASP 1024Cb 0.43 -1.52 0.09 0.00 2.34 0.00 0.00 41.12 42.45 2c3y n ASP 1024CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2c3y h LEU 1025N 8.81 0.68 0.01 -2.67 5.85 -1.97 -2.55 115.31 123.47 2c3y h LEU 1025Ca 0.34 0.01 0.02 0.00 0.84 0.00 0.00 57.88 59.09 2c3y h LEU 1025Cb 0.77 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2c3y h LEU 1025CO 1.38 0.46 -0.13 0.00 -0.34 0.00 0.00 178.44 179.82 2c3y h ALA 1026N 1.32 -0.16 -0.04 1.25 0.00 -2.00 -2.21 119.26 117.43 2c3y h ALA 1026Ca 0.29 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 2c3y h ALA 1026Cb 0.07 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2c3y h ALA 1026CO -0.13 -0.62 -0.34 0.00 0.00 0.00 0.00 179.25 178.16 2c3y h ARG 1027N -0.22 0.07 -0.26 0.00 3.08 -1.95 -1.60 114.38 113.50 2c3y h ARG 1027Ca 0.04 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2c3y h ARG 1027Cb 0.27 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2c3y h ARG 1027CO -0.12 0.40 0.07 0.52 -1.07 0.00 0.00 179.97 179.77 2c3y h MET 1028N 0.06 0.41 -0.01 0.04 2.86 -1.17 -2.94 114.93 114.18 2c3y h MET 1028Ca 0.01 -0.10 -0.11 0.00 -2.06 0.00 0.00 59.70 57.44 2c3y h MET 1028Cb 0.63 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 2c3y h MET 1028CO 0.05 0.50 -0.53 -0.39 1.06 0.00 0.00 176.91 177.60 2c3y h VAL 1029N 0.24 1.38 0.00 -2.22 -1.51 -1.22 -2.58 116.25 110.34 2c3y h VAL 1029Ca 0.08 -1.80 0.00 0.00 -1.23 0.00 0.00 66.70 63.75 2c3y h VAL 1029Cb 0.27 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 2c3y h VAL 1029CO -0.00 0.52 0.00 0.24 -1.23 0.00 0.00 177.57 177.10 2c3y h MET 1030N 0.02 0.00 0.00 5.19 2.07 -1.12 -2.12 114.93 118.97 2c3y h MET 1030Ca -0.00 0.00 -0.00 0.00 -2.07 0.00 0.00 59.70 57.62 2c3y h MET 1030Cb 0.94 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.67 2c3y h MET 1030CO 0.07 0.00 -0.02 1.79 1.07 0.00 0.00 176.91 179.82 2c3y h THR 1031N 0.00 0.11 -0.36 2.22 1.35 -1.31 -2.41 112.91 112.50 2c3y h THR 1031Ca 0.00 -0.21 -0.12 0.00 -0.55 0.00 0.00 66.41 65.54 2c3y h THR 1031Cb 0.23 1.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 2c3y h THR 1031CO 0.00 0.02 -0.25 1.88 -0.25 0.00 0.00 175.52 176.91 2c3y h TYR 1032N 0.00 0.84 0.00 4.73 0.05 -1.57 -3.47 116.97 117.55 2c3y h TYR 1032Ca -0.00 -0.20 0.00 0.00 0.05 0.00 0.00 58.73 58.58 2c3y h TYR 1032Cb 0.18 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 37.72 2c3y h TYR 1032CO 0.00 0.91 0.00 0.41 -1.05 0.00 0.00 178.16 178.43 2c3y n GLY 1033N -0.21 2.78 0.93 3.88 0.00 -0.91 -4.76 105.19 106.91 2c3y n GLY 1033Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 2c3y n GLY 1033CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2c3y n TYR 1034N -0.63 0.95 -5.02 1.61 0.18 -1.26 -4.57 117.16 108.42 2c3y n TYR 1034Ca 0.00 -0.81 -0.32 0.00 1.88 0.00 0.00 57.90 58.65 2c3y n TYR 1034Cb 0.00 -0.29 -0.15 0.00 -0.38 0.00 0.00 39.34 38.52 2c3y n TYR 1034CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2c3y s VAL 1035N -2.55 2.58 -0.06 -3.48 1.01 -1.26 -4.50 120.40 112.13 2c3y s VAL 1035Ca 0.40 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 2c3y s VAL 1035Cb 0.32 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 2c3y s VAL 1035CO 0.11 0.55 1.04 -0.47 0.00 0.00 0.00 175.10 176.33 2c3y s TYR 1036N 0.05 3.49 -0.02 5.22 5.04 -0.01 -4.66 117.35 126.46 2c3y s TYR 1036Ca -0.07 1.54 0.03 0.00 -2.44 0.00 0.00 57.07 56.13 2c3y s TYR 1036Cb -0.15 -3.22 -0.00 0.00 0.35 0.00 0.00 41.96 38.94 2c3y s TYR 1036CO 0.05 -0.40 -0.11 0.08 -1.34 0.00 0.00 175.55 173.83 2c3y s VAL 1037N 1.74 0.92 0.03 3.14 1.01 -0.76 0.83 120.40 127.32 2c3y s VAL 1037Ca 0.51 -0.45 -0.20 0.00 0.00 0.00 0.00 61.98 61.84 2c3y s VAL 1037Cb -0.21 -0.80 0.04 0.00 0.00 0.00 0.00 36.38 35.41 2c3y s VAL 1037CO 0.22 0.28 0.45 0.00 0.00 0.00 0.00 175.10 176.04 2c3y s ALA 1038N 0.07 -1.11 0.03 5.51 0.00 -0.32 0.37 121.76 126.30 2c3y s ALA 1038Ca -0.02 0.44 0.09 0.00 0.00 0.00 0.00 51.96 52.48 2c3y s ALA 1038Cb -0.08 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 23.32 2c3y s ALA 1038CO 0.01 -0.45 -0.25 0.95 0.00 0.00 0.00 175.76 176.02 2c3y s THR 1039N -2.29 2.24 0.09 0.00 -4.23 -0.69 -1.23 115.64 109.53 2c3y s THR 1039Ca -0.06 -1.29 0.02 0.00 -1.18 0.00 0.00 61.69 59.17 2c3y s THR 1039Cb -0.01 -1.87 -0.04 0.00 1.34 0.00 0.00 72.50 71.92 2c3y s THR 1039CO -0.01 0.41 -0.06 0.68 -0.54 0.00 0.00 174.62 175.10 2c3y s VAL 1040N -0.78 0.64 -0.29 2.29 -7.23 -0.18 -3.98 120.40 110.87 2c3y s VAL 1040Ca 0.12 -1.86 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 2c3y s VAL 1040Cb -0.10 -1.59 0.17 0.00 0.56 0.00 0.00 36.38 35.42 2c3y s VAL 1040CO 0.02 -0.85 0.48 -0.55 -0.31 0.00 0.00 175.10 173.89 2c3y s SER 1041N -2.93 -0.41 0.19 4.85 0.15 -1.26 -1.99 113.70 112.31 2c3y s SER 1041Ca 0.10 -0.09 -0.18 0.00 0.70 0.00 0.00 55.95 56.48 2c3y s SER 1041Cb 0.04 1.48 0.16 0.00 -1.71 0.00 0.00 66.02 65.99 2c3y s SER 1041CO -0.05 -0.33 1.61 -0.03 1.20 0.00 0.00 173.24 175.65 2c3y h MET 1042N 8.10 -0.10 -0.44 5.44 4.05 -1.86 -1.38 114.93 128.74 2c3y h MET 1042Ca -0.07 0.01 0.13 0.00 -0.28 0.00 0.00 59.70 59.48 2c3y h MET 1042Cb 1.15 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.95 2c3y h MET 1042CO 0.22 -0.07 0.34 0.78 0.23 0.00 0.00 176.91 178.42 2c3y h GLY 1043N -0.10 0.00 0.44 1.39 0.00 -1.84 -2.44 103.07 100.52 2c3y h GLY 1043Ca 0.25 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.44 2c3y h GLY 1043CO -0.62 0.00 -0.65 -1.82 0.00 0.00 0.00 176.54 173.45 2c3y h TYR 1044N 0.00 0.35 -1.26 5.60 3.20 -1.41 -3.38 116.97 120.07 2c3y h TYR 1044Ca 0.21 -0.26 0.02 0.00 3.14 0.00 0.00 58.73 61.84 2c3y h TYR 1044Cb 0.89 -0.01 -0.24 0.00 1.54 0.00 0.00 36.73 38.91 2c3y h TYR 1044CO 0.00 1.25 -0.33 0.45 -1.64 0.00 0.00 178.16 177.89 2c3y s SER 1045N -6.75 -0.92 0.28 -2.11 0.15 -0.92 -4.98 113.70 98.44 2c3y s SER 1045Ca -0.16 0.68 0.12 0.00 0.70 0.00 0.00 55.95 57.29 2c3y s SER 1045Cb 0.00 1.86 0.35 0.00 -1.71 0.00 0.00 66.02 66.53 2c3y s SER 1045CO 0.77 -0.27 1.60 0.11 1.20 0.00 0.00 173.24 176.65 2c3y h LYS 1046N 8.05 0.00 -0.15 5.44 1.57 -1.82 -2.79 116.57 126.88 2c3y h LYS 1046Ca -0.22 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.55 2c3y h LYS 1046Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 2c3y h LYS 1046CO 0.26 0.61 0.03 1.96 -0.57 0.00 0.00 179.45 181.74 2c3y h GLN 1047N 0.00 0.24 -0.20 3.15 7.50 -1.94 -1.21 115.11 122.65 2c3y h GLN 1047Ca -0.01 -0.06 -0.08 0.00 0.50 0.00 0.00 58.65 59.00 2c3y h GLN 1047Cb 1.13 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.62 2c3y h GLN 1047CO 0.08 0.40 -0.23 0.37 -1.50 0.00 0.00 178.83 177.95 2c3y h GLN 1048N 0.03 0.36 -0.21 1.46 -0.00 -1.96 -1.24 115.11 113.56 2c3y h GLN 1048Ca 0.05 -0.12 -0.02 0.00 -0.00 0.00 0.00 58.65 58.55 2c3y h GLN 1048Cb 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.71 2c3y h GLN 1048CO 0.00 0.58 0.06 0.35 0.00 0.00 0.00 178.83 179.81 2c3y h PHE 1049N 0.33 0.35 -0.67 3.99 3.57 -1.27 -0.80 116.94 122.44 2c3y h PHE 1049Ca 0.05 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 2c3y h PHE 1049Cb 0.58 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 2c3y h PHE 1049CO 0.01 0.43 0.16 -0.07 -2.23 0.00 0.00 178.31 176.61 2c3y h LEU 1050N 0.16 1.01 -0.77 0.59 3.38 -0.97 -1.71 115.31 117.00 2c3y h LEU 1050Ca 0.07 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2c3y h LEU 1050Cb 0.26 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 2c3y h LEU 1050CO -0.00 0.98 0.42 0.50 0.09 0.00 0.00 178.44 180.43 2c3y h LYS 1051N 1.02 1.07 -0.22 1.13 3.64 -1.05 -2.19 116.57 119.98 2c3y h LYS 1051Ca 0.21 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 2c3y h LYS 1051Cb 0.37 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2c3y h LYS 1051CO 0.00 0.80 0.11 0.28 -2.27 0.00 0.00 179.45 178.37 2c3y h VAL 1052N 1.07 1.13 -0.06 2.00 2.07 -0.70 -1.08 116.25 120.67 2c3y h VAL 1052Ca 0.27 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.47 2c3y h VAL 1052Cb 0.03 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2c3y h VAL 1052CO -0.04 0.12 -0.10 -0.07 0.02 0.00 0.00 177.57 177.49 2c3y h LEU 1053N 0.23 -0.31 -0.26 2.57 3.38 -1.11 0.46 115.31 120.27 2c3y h LEU 1053Ca 0.07 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.13 2c3y h LEU 1053Cb 0.09 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2c3y h LEU 1053CO -0.01 -0.14 0.07 0.50 0.09 0.00 0.00 178.44 178.94 2c3y h LYS 1054N -0.15 0.17 -0.35 1.13 3.64 -1.31 0.09 116.57 119.79 2c3y h LYS 1054Ca 0.06 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 2c3y h LYS 1054Cb 0.23 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2c3y h LYS 1054CO -0.15 0.11 -0.02 0.93 -2.27 0.00 0.00 179.45 178.05 2c3y h GLU 1055N 0.17 0.64 0.01 1.90 5.08 -0.90 -1.36 114.58 120.13 2c3y h GLU 1055Ca 0.12 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2c3y h GLU 1055Cb 0.10 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2c3y h GLU 1055CO -0.14 0.76 -0.01 0.00 -1.00 0.00 0.00 179.01 178.63 2c3y h ALA 1056N 0.85 -0.02 -0.62 3.43 0.00 0.08 -1.86 119.26 121.11 2c3y h ALA 1056Ca 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2c3y h ALA 1056Cb 0.49 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2c3y h ALA 1056CO 0.02 -0.42 0.27 1.49 0.00 0.00 0.00 179.25 180.61 2c3y h GLU 1057N -0.20 0.92 0.00 0.00 4.22 -1.00 -2.49 114.58 116.03 2c3y h GLU 1057Ca -0.00 -0.16 0.00 0.00 0.08 0.00 0.00 59.36 59.28 2c3y h GLU 1057Cb 0.19 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2c3y h GLU 1057CO 0.00 0.77 0.00 -1.13 -2.18 0.00 0.00 179.01 176.47 2c3y n SER 1058N -4.46 0.71 -4.67 1.04 3.41 -0.51 -4.77 113.62 104.37 2c3y n SER 1058Ca 0.04 0.62 -0.42 0.00 -0.26 0.00 0.00 58.87 58.85 2c3y n SER 1058Cb 0.15 -0.79 -0.03 0.00 -0.26 0.00 0.00 64.21 63.28 2c3y n SER 1058CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2c3y s PHE 1059N -3.22 1.89 -1.48 7.33 5.36 -0.71 -4.85 117.98 122.31 2c3y s PHE 1059Ca 0.07 -0.04 -0.10 0.00 -0.96 0.00 0.00 56.93 55.89 2c3y s PHE 1059Cb 0.11 -4.09 -0.07 0.00 -0.34 0.00 0.00 43.02 38.63 2c3y s PHE 1059CO 0.48 -4.65 2.70 -0.35 -1.46 0.00 0.00 175.22 171.93 2c3y n PRO 1060N 6.58 3.27 -3.16 10.12 -0.04 -1.26 -4.73 135.00 145.78 2c3y n PRO 1060Ca 0.18 -2.15 0.00 0.00 -0.04 0.00 0.00 63.50 61.49 2c3y n PRO 1060Cb 0.41 -2.83 0.00 0.00 -0.04 0.00 0.00 33.50 31.03 2c3y n PRO 1060CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2c3y n GLY 1061N 3.72 -0.89 3.75 0.55 0.00 -1.26 -4.86 105.19 106.18 2c3y n GLY 1061Ca 0.69 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 2c3y n GLY 1061CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2c3y s PRO 1062N -0.31 4.63 -0.01 1.61 0.02 -0.44 -3.65 135.00 136.85 2c3y s PRO 1062Ca 0.00 1.73 0.05 0.00 0.02 0.00 0.00 61.00 62.80 2c3y s PRO 1062Cb 0.00 -3.25 -0.01 0.00 0.02 0.00 0.00 34.50 31.26 2c3y s PRO 1062CO 0.00 0.16 -0.17 -1.12 -0.33 0.00 0.00 177.00 175.54 2c3y s SER 1063N -0.48 2.04 -0.14 2.53 0.01 -0.70 -0.83 113.70 116.14 2c3y s SER 1063Ca 0.47 -0.32 -0.00 0.00 1.31 0.00 0.00 55.95 57.41 2c3y s SER 1063Cb -0.30 -0.24 0.03 0.00 0.21 0.00 0.00 66.02 65.71 2c3y s SER 1063CO 0.37 0.21 -0.09 -0.22 0.41 0.00 0.00 173.24 173.92 2c3y s LEU 1064N -0.38 1.48 -0.12 2.44 0.20 0.24 -0.87 118.68 121.67 2c3y s LEU 1064Ca 0.06 -0.47 0.02 0.00 0.69 0.00 0.00 54.13 54.44 2c3y s LEU 1064Cb -0.07 -0.97 0.01 0.00 -0.43 0.00 0.00 46.19 44.73 2c3y s LEU 1064CO -0.01 -0.12 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.06 2c3y s VAL 1065N 1.61 1.78 -0.19 1.68 1.01 0.07 -1.17 120.40 125.19 2c3y s VAL 1065Ca 0.04 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 2c3y s VAL 1065Cb -0.13 -1.59 -0.00 0.00 0.00 0.00 0.00 36.38 34.65 2c3y s VAL 1065CO -0.09 0.50 -0.10 -0.63 0.00 0.00 0.00 175.10 174.78 2c3y s ILE 1066N 0.81 2.99 -0.03 2.22 1.01 -0.37 -0.56 121.20 127.27 2c3y s ILE 1066Ca -0.09 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.93 2c3y s ILE 1066Cb -0.16 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 2c3y s ILE 1066CO 0.00 0.47 -0.02 0.00 0.00 0.00 0.00 174.94 175.39 2c3y s ALA 1067N 1.19 3.20 -0.39 9.38 0.00 0.29 -1.01 121.76 134.42 2c3y s ALA 1067Ca 0.02 -0.92 -0.28 0.00 0.00 0.00 0.00 51.96 50.78 2c3y s ALA 1067Cb -0.14 -1.32 0.02 0.00 0.00 0.00 0.00 23.12 21.67 2c3y s ALA 1067CO -0.04 0.62 1.03 -0.47 0.00 0.00 0.00 175.76 176.90 2c3y s TYR 1068N -0.99 3.01 -0.23 0.00 5.04 -0.84 -1.36 117.35 121.98 2c3y s TYR 1068Ca 0.17 0.84 -0.04 0.00 -2.44 0.00 0.00 57.07 55.60 2c3y s TYR 1068Cb -0.11 -3.91 -0.00 0.00 0.35 0.00 0.00 41.96 38.29 2c3y s TYR 1068CO 0.07 -0.96 -0.03 0.00 -1.34 0.00 0.00 175.55 173.29 2c3y s ALA 1069N 3.82 2.83 0.64 3.97 0.00 -0.55 -4.76 121.76 127.70 2c3y s ALA 1069Ca 0.43 -1.22 -0.14 0.00 0.00 0.00 0.00 51.96 51.03 2c3y s ALA 1069Cb -0.10 -1.74 -0.02 0.00 0.00 0.00 0.00 23.12 21.26 2c3y s ALA 1069CO 0.22 -0.51 1.07 0.95 0.00 0.00 0.00 175.76 177.49 2c3y s THR 1070N 1.47 3.76 0.03 0.00 -4.23 -1.26 -4.13 115.64 111.28 2c3y s THR 1070Ca 0.05 0.75 -0.17 0.00 -1.18 0.00 0.00 61.69 61.15 2c3y s THR 1070Cb -0.15 -3.32 0.03 0.00 1.34 0.00 0.00 72.50 70.40 2c3y s THR 1070CO -0.03 -0.57 0.37 0.00 -0.54 0.00 0.00 174.62 173.85 2c3y h ILE 1072N 3.23 0.66 0.00 0.00 3.07 -1.95 -1.79 117.51 120.73 2c3y h ILE 1072Ca -0.31 -0.35 -0.03 0.00 1.55 0.00 0.00 64.86 65.72 2c3y h ILE 1072Cb 1.20 1.22 -0.00 0.00 -0.27 0.00 0.00 36.82 38.96 2c3y h ILE 1072CO 0.43 0.08 -0.15 0.78 -1.05 0.00 0.00 178.15 178.25 2c3y h ASN 1073N 0.00 0.00 0.78 2.16 -0.26 -1.96 -2.58 115.58 113.73 2c3y h ASN 1073Ca -0.00 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.69 2c3y h ASN 1073Cb 0.21 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.46 2c3y h ASN 1073CO 0.01 0.15 -0.25 1.56 -1.06 0.00 0.00 177.43 177.84 2c3y h GLN 1074N 0.00 0.00 -2.51 0.81 4.20 -1.68 -3.43 115.11 112.51 2c3y h GLN 1074Ca -0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 2c3y h GLN 1074Cb 0.27 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.08 2c3y h GLN 1074CO 0.02 0.25 -0.16 0.41 -0.67 0.00 0.00 178.83 178.68 2c3y n GLY 1075N -0.00 0.41 3.65 3.46 0.00 -0.97 -1.93 105.19 109.81 2c3y n GLY 1075Ca -0.00 -0.40 -0.47 0.00 0.00 0.00 0.00 46.02 45.15 2c3y n GLY 1075CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c3y n LEU 1076N -1.61 3.45 0.28 0.99 4.77 -1.26 -0.77 117.00 122.84 2c3y n LEU 1076Ca -0.04 0.83 0.16 0.00 -0.03 0.00 0.00 56.01 56.93 2c3y n LEU 1076Cb 0.53 -1.41 0.79 0.00 -2.33 0.00 0.00 43.42 41.00 2c3y n LEU 1076CO 0.14 -0.14 1.01 0.08 -1.33 0.00 0.00 177.39 177.15 2c3y h ARG 1077N 10.41 0.00 -0.30 3.23 0.11 -1.69 -2.86 114.38 123.27 2c3y h ARG 1077Ca -0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.62 2c3y h ARG 1077Cb 1.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.35 2c3y h ARG 1077CO 0.96 0.06 0.00 1.63 0.10 0.00 0.00 179.97 182.72 2c3y n LYS 1078N -3.29 2.18 0.00 0.08 5.02 -1.26 -5.08 118.16 115.81 2c3y n LYS 1078Ca -0.01 -1.94 0.00 0.00 -2.02 0.00 0.00 58.31 54.34 2c3y n LYS 1078Cb 0.25 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 2c3y n LYS 1078CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c3y n GLY 1079N 0.89 2.90 0.05 0.72 0.00 -1.08 -4.75 105.19 103.93 2c3y n GLY 1079Ca 0.13 -1.85 0.09 0.00 0.00 0.00 0.00 46.02 44.40 2c3y n GLY 1079CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c3y n MET 1080N 0.13 0.08 0.00 1.61 2.81 -1.26 -1.79 117.12 118.70 2c3y n MET 1080Ca 0.00 0.32 0.09 0.00 -1.81 0.00 0.00 57.70 56.30 2c3y n MET 1080Cb 0.00 -1.65 0.49 0.00 -0.71 0.00 0.00 33.22 31.35 2c3y n MET 1080CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c3y n GLY 1081N 0.01 -0.87 1.26 3.03 0.00 -1.20 -1.47 105.19 105.95 2c3y n GLY 1081Ca 0.03 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.05 2c3y n GLY 1081CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2c3y n LYS 1082N -1.24 3.00 -0.09 1.61 4.76 -0.74 -3.70 118.16 121.75 2c3y n LYS 1082Ca 0.10 -2.61 -0.06 0.00 -2.87 0.00 0.00 58.31 52.87 2c3y n LYS 1082Cb 0.14 -1.59 0.00 0.00 -1.84 0.00 0.00 35.03 31.74 2c3y n LYS 1082CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 2c3y h SER 1083N 3.74 -0.24 -0.67 4.39 0.02 -1.44 0.69 113.55 120.03 2c3y h SER 1083Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2c3y h SER 1083Cb 1.06 0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.75 2c3y h SER 1083CO 0.06 -0.08 0.43 1.56 -1.14 0.00 0.00 176.83 177.66 2c3y h GLN 1084N 0.03 0.89 -0.53 3.45 1.08 -1.84 0.96 115.11 119.15 2c3y h GLN 1084Ca 0.16 -0.06 -0.05 0.00 -1.45 0.00 0.00 58.65 57.25 2c3y h GLN 1084Cb 0.23 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.44 2c3y h GLN 1084CO -0.31 0.60 0.13 0.22 -0.95 0.00 0.00 178.83 178.52 2c3y h ASP 1085N 0.91 0.74 -0.43 1.46 3.58 -1.72 0.08 116.42 121.04 2c3y h ASP 1085Ca 0.24 -0.13 -0.14 0.00 0.42 0.00 0.00 57.03 57.43 2c3y h ASP 1085Cb -0.08 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 40.76 2c3y h ASP 1085CO -0.05 0.73 -0.27 0.58 -2.88 0.00 0.00 179.24 177.35 2c3y h VAL 1086N 0.77 1.27 -0.17 2.25 2.07 -0.26 -0.56 116.25 121.63 2c3y h VAL 1086Ca 0.17 -1.43 -0.05 0.00 0.82 0.00 0.00 66.70 66.21 2c3y h VAL 1086Cb 0.28 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 2c3y h VAL 1086CO -0.00 0.49 -0.14 0.24 0.02 0.00 0.00 177.57 178.18 2c3y h MET 1087N 0.81 0.27 -0.09 1.57 2.86 -0.26 0.13 114.93 120.24 2c3y h MET 1087Ca 0.10 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 2c3y h MET 1087Cb 0.84 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.47 2c3y h MET 1087CO 0.07 0.42 -0.08 -0.97 1.06 0.00 0.00 176.91 177.41 2c3y h ASN 1088N 0.26 0.22 0.01 1.22 -0.00 -0.59 -3.15 115.58 113.55 2c3y h ASN 1088Ca 0.05 -0.48 -0.08 0.00 -0.00 0.00 0.00 56.30 55.79 2c3y h ASN 1088Cb 0.40 -0.06 -0.01 0.00 -0.00 0.00 0.00 38.32 38.65 2c3y h ASN 1088CO 0.02 0.65 -0.23 0.74 -0.00 0.00 0.00 177.43 178.61 2c3y h THR 1089N -0.21 1.25 -0.99 -3.57 2.02 -0.81 -1.70 112.91 108.90 2c3y h THR 1089Ca 0.01 -1.17 0.09 0.00 0.77 0.00 0.00 66.41 66.12 2c3y h THR 1089Cb 0.59 1.35 -0.07 0.00 -1.74 0.00 0.00 68.15 68.27 2c3y h THR 1089CO 0.02 0.37 0.64 0.00 0.37 0.00 0.00 175.52 176.91 2c3y h ALA 1090N 1.42 1.48 0.01 6.16 0.00 -0.73 0.29 119.26 127.88 2c3y h ALA 1090Ca 0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2c3y h ALA 1090Cb 0.60 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2c3y h ALA 1090CO 0.04 0.33 -0.00 0.28 0.00 0.00 0.00 179.25 179.90 2c3y h VAL 1091N 1.08 1.36 -0.95 0.00 2.07 -1.45 0.38 116.25 118.74 2c3y h VAL 1091Ca 0.46 -1.98 0.13 0.00 0.82 0.00 0.00 66.70 66.13 2c3y h VAL 1091Cb 0.32 2.55 -0.08 0.00 -1.52 0.00 0.00 31.29 32.56 2c3y h VAL 1091CO -0.21 0.45 0.60 0.11 0.02 0.00 0.00 177.57 178.55 2c3y h LYS 1092N -0.99 0.82 0.00 1.57 1.57 -1.13 0.50 116.57 118.91 2c3y h LYS 1092Ca -0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2c3y h LYS 1092Cb 0.75 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2c3y h LYS 1092CO 0.00 0.54 0.00 0.66 -0.57 0.00 0.00 179.45 180.08 2c3y h SER 1093N 0.84 0.00 0.00 0.86 4.64 -1.08 -2.35 113.55 116.46 2c3y h SER 1093Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 2c3y h SER 1093Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2c3y h SER 1093CO -0.24 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.33 2c3y n GLY 1094N 0.12 0.80 0.21 -0.77 0.00 0.17 -4.11 105.19 101.61 2c3y n GLY 1094Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 2c3y n GLY 1094CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2c3y h TYR 1095N 0.00 0.67 -2.74 1.61 3.20 -1.60 -3.36 116.97 114.76 2c3y h TYR 1095Ca 0.00 -0.07 -0.61 0.00 3.14 0.00 0.00 58.73 61.20 2c3y h TYR 1095Cb 0.00 -0.20 -0.41 0.00 1.54 0.00 0.00 36.73 37.67 2c3y h TYR 1095CO 0.00 0.62 -0.71 1.87 -1.64 0.00 0.00 178.16 178.30 2c3y n TRP 1096N -4.58 1.99 -2.13 -3.82 -0.00 0.13 -5.00 117.44 104.03 2c3y n TRP 1096Ca 0.00 -3.99 -0.39 0.00 -0.00 0.00 0.00 57.50 53.12 2c3y n TRP 1096Cb 0.18 -0.36 -0.01 0.00 -0.00 0.00 0.00 31.31 31.12 2c3y n TRP 1096CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2c3y s PRO 1097N -1.16 3.98 -0.09 5.87 0.04 -1.26 -4.03 135.00 138.35 2c3y s PRO 1097Ca 0.29 2.05 -0.05 0.00 0.04 0.00 0.00 61.00 63.33 2c3y s PRO 1097Cb 0.01 -2.72 -0.04 0.00 0.04 0.00 0.00 34.50 31.79 2c3y s PRO 1097CO -0.16 -0.45 0.13 -0.51 0.04 0.00 0.00 177.00 176.05 2c3y s LEU 1098N -2.47 4.26 0.16 -3.56 1.43 -1.26 -4.86 118.68 112.38 2c3y s LEU 1098Ca 0.57 0.39 -0.24 0.00 -1.03 0.00 0.00 54.13 53.82 2c3y s LEU 1098Cb -0.36 -2.14 0.06 0.00 0.03 0.00 0.00 46.19 43.79 2c3y s LEU 1098CO 0.45 0.37 0.77 0.72 0.23 0.00 0.00 176.35 178.90 2c3y s PHE 1099N -1.07 -0.31 -0.01 0.29 -0.12 -1.26 -0.28 117.98 115.23 2c3y s PHE 1099Ca 0.17 0.01 0.01 0.00 -0.05 0.00 0.00 56.93 57.08 2c3y s PHE 1099Cb -0.12 0.62 -0.00 0.00 -0.63 0.00 0.00 43.02 42.89 2c3y s PHE 1099CO 0.07 -0.91 -0.05 1.03 -0.05 0.00 0.00 175.22 175.31 2c3y s ARG 1100N -3.58 0.44 -0.27 1.99 0.52 0.30 -1.70 118.95 116.64 2c3y s ARG 1100Ca 0.07 -0.16 0.02 0.00 -0.52 0.00 0.00 55.73 55.14 2c3y s ARG 1100Cb -0.03 -0.44 0.07 0.00 0.52 0.00 0.00 34.95 35.08 2c3y s ARG 1100CO -0.03 0.08 -0.03 -0.47 0.02 0.00 0.00 175.30 174.88 2c3y s TYR 1101N 0.02 2.90 -0.33 -0.53 5.04 0.16 0.48 117.35 125.08 2c3y s TYR 1101Ca 0.00 -2.21 -0.01 0.00 -2.44 0.00 0.00 57.07 52.41 2c3y s TYR 1101Cb -0.04 -2.02 0.07 0.00 0.35 0.00 0.00 41.96 40.33 2c3y s TYR 1101CO -0.00 -0.86 0.05 0.34 -1.34 0.00 0.00 175.55 173.74 2c3y s ASP 1102N 1.22 4.94 0.47 4.32 -1.08 -0.02 -1.83 116.67 124.69 2c3y s ASP 1102Ca -0.01 -1.61 0.22 0.00 -0.52 0.00 0.00 52.55 50.62 2c3y s ASP 1102Cb -0.19 -1.72 1.23 0.00 -1.46 0.00 0.00 42.92 40.78 2c3y s ASP 1102CO -0.08 -0.35 1.92 -0.65 0.52 0.00 0.00 175.17 176.53 2c3y h PRO 1103N 7.94 0.22 0.00 4.34 0.11 -1.83 -1.22 132.00 141.57 2c3y h PRO 1103Ca -0.16 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.93 2c3y h PRO 1103Cb 1.05 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2c3y h PRO 1103CO 0.57 0.15 0.00 0.07 -0.21 0.00 0.00 178.00 178.58 2c3y h ARG 1104N 0.23 0.00 -0.17 1.05 0.11 -1.94 -1.43 114.38 112.23 2c3y h ARG 1104Ca 0.38 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 60.26 2c3y h ARG 1104Cb 1.14 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.22 2c3y h ARG 1104CO -0.08 0.00 -0.68 -0.07 0.10 0.00 0.00 179.97 179.24 2c3y h LEU 1105N 0.00 0.77 -1.23 0.08 3.38 -1.51 -2.72 115.31 114.08 2c3y h LEU 1105Ca 0.00 -0.47 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 2c3y h LEU 1105Cb 0.38 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2c3y h LEU 1105CO 0.00 1.23 -0.12 0.00 0.09 0.00 0.00 178.44 179.64 2c3y h ALA 1106N 0.76 1.36 0.00 1.53 0.00 -0.99 0.55 119.26 122.47 2c3y h ALA 1106Ca -0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2c3y h ALA 1106Cb 1.27 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 2c3y h ALA 1106CO 0.13 0.44 -0.12 0.00 0.00 0.00 0.00 179.25 179.69 2c3y h ALA 1107N 1.52 1.13 -0.52 0.00 0.00 -1.21 -1.48 119.26 118.69 2c3y h ALA 1107Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2c3y h ALA 1107Cb 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2c3y h ALA 1107CO 0.02 0.15 0.00 1.04 0.00 0.00 0.00 179.25 180.47 2c3y n GLN 1108N -3.42 2.25 -1.13 0.00 6.02 -0.42 -4.90 117.38 115.77 2c3y n GLN 1108Ca -0.01 -1.90 -0.04 0.00 -0.01 0.00 0.00 57.00 55.05 2c3y n GLN 1108Cb 0.30 -1.42 -0.02 0.00 1.02 0.00 0.00 30.24 30.12 2c3y n GLN 1108CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2c3y n GLY 1109N 1.32 0.66 3.55 1.08 0.00 -0.56 -5.03 105.19 106.20 2c3y n GLY 1109Ca 0.18 -0.90 -0.24 0.00 0.00 0.00 0.00 46.02 45.05 2c3y n GLY 1109CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c3y s LYS 1110N -2.35 1.89 -0.12 1.61 1.02 0.05 -4.99 119.74 116.84 2c3y s LYS 1110Ca 0.00 -1.76 -0.29 0.00 0.02 0.00 0.00 55.97 53.94 2c3y s LYS 1110Cb 0.00 -1.84 -0.04 0.00 -0.52 0.00 0.00 37.83 35.42 2c3y s LYS 1110CO 0.00 0.24 1.64 1.21 -0.92 0.00 0.00 175.35 177.52 2c3y s ASN 1111N -3.60 6.55 0.44 2.83 2.47 -1.26 -2.56 114.94 119.80 2c3y s ASN 1111Ca 0.32 1.99 0.18 0.00 0.42 0.00 0.00 52.86 55.76 2c3y s ASN 1111Cb -0.02 -2.53 1.01 0.00 -1.45 0.00 0.00 41.25 38.26 2c3y s ASN 1111CO 0.17 -1.06 1.94 1.55 -3.72 0.00 0.00 177.10 175.98 2c3y h PRO 1112N 10.05 0.00 -6.08 0.43 0.13 -1.86 -3.43 132.00 131.24 2c3y h PRO 1112Ca -0.37 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.20 2c3y h PRO 1112Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 2c3y h PRO 1112CO 0.97 0.24 0.30 0.12 -0.23 0.00 0.00 178.00 179.40 2c3y s PHE 1113N -4.31 3.52 -0.08 1.56 5.36 -1.26 -0.84 117.98 121.93 2c3y s PHE 1113Ca -0.03 1.36 0.00 0.00 -0.96 0.00 0.00 56.93 57.31 2c3y s PHE 1113Cb 0.14 -2.98 0.02 0.00 -0.34 0.00 0.00 43.02 39.86 2c3y s PHE 1113CO 0.68 -0.09 -0.06 -0.65 -1.46 0.00 0.00 175.22 173.63 2c3y s GLN 1114N 1.50 1.24 -0.23 10.12 -0.21 0.18 -4.67 119.66 127.59 2c3y s GLN 1114Ca 0.41 -0.18 -0.23 0.00 0.02 0.00 0.00 55.36 55.38 2c3y s GLN 1114Cb -0.18 -1.28 -0.01 0.00 1.00 0.00 0.00 33.01 32.54 2c3y s GLN 1114CO 0.18 -0.18 0.77 -1.17 -2.12 0.00 0.00 175.29 172.76 2c3y s LEU 1115N 1.42 4.10 0.00 2.90 0.20 -1.26 -0.54 118.68 125.49 2c3y s LEU 1115Ca -0.02 0.97 0.24 0.00 0.69 0.00 0.00 54.13 56.01 2c3y s LEU 1115Cb -0.13 -3.09 0.17 0.00 -0.43 0.00 0.00 46.19 42.71 2c3y s LEU 1115CO -0.04 -0.44 1.22 0.47 -0.29 0.00 0.00 176.35 177.28 2c3y n ASP 1116N 5.72 2.40 -4.25 3.68 8.00 0.61 -4.95 116.55 127.75 2c3y n ASP 1116Ca 0.03 -1.71 -0.27 0.00 0.71 0.00 0.00 54.79 53.55 2c3y n ASP 1116Cb 0.48 0.22 -0.08 0.00 -0.02 0.00 0.00 41.12 41.72 2c3y n ASP 1116CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2c3y s SER 1117N -2.24 3.09 0.41 -2.24 1.04 -1.13 -4.86 113.70 107.77 2c3y s SER 1117Ca 0.24 -1.67 0.08 0.00 0.48 0.00 0.00 55.95 55.08 2c3y s SER 1117Cb 0.19 0.50 -0.01 0.00 0.10 0.00 0.00 66.02 66.81 2c3y s SER 1117CO 0.43 -0.91 0.46 -0.54 0.98 0.00 0.00 173.24 173.66 2c3y s LYS 1118N -3.74 2.70 0.64 4.02 1.02 -1.26 -4.91 119.74 118.20 2c3y s LYS 1118Ca 0.20 -1.37 -0.18 0.00 0.02 0.00 0.00 55.97 54.64 2c3y s LYS 1118Cb 0.02 -2.57 -0.02 0.00 -0.52 0.00 0.00 37.83 34.75 2c3y s LYS 1118CO 0.12 -0.19 1.16 0.00 -0.92 0.00 0.00 175.35 175.52 2c3y n ALA 1119N -1.67 0.72 -1.63 5.17 0.00 -1.26 -4.74 120.51 117.10 2c3y n ALA 1119Ca 0.05 -0.01 -0.55 0.00 0.00 0.00 0.00 53.44 52.93 2c3y n ALA 1119Cb 0.60 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.75 2c3y n ALA 1119CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2c3y n PRO 1120N -1.61 1.07 -0.04 0.00 -0.02 -1.26 -4.80 135.00 128.35 2c3y n PRO 1120Ca 0.15 0.39 0.12 0.00 -2.02 0.00 0.00 63.50 62.14 2c3y n PRO 1120Cb 0.48 -2.04 0.50 0.00 -0.02 0.00 0.00 33.50 32.42 2c3y n PRO 1120CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2c3y n ASP 1121N 3.49 1.18 0.00 2.55 5.68 -0.89 -4.92 116.55 123.65 2c3y n ASP 1121Ca 0.21 -1.54 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 2c3y n ASP 1121Cb 0.16 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 2c3y n ASP 1121CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2c3y n GLY 1122N 1.07 0.68 0.81 6.12 0.00 -1.26 -4.94 105.19 107.66 2c3y n GLY 1122Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2c3y n GLY 1122CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2c3y n SER 1123N 0.00 2.44 -0.21 1.61 3.41 -1.26 -4.52 113.62 115.09 2c3y n SER 1123Ca 0.00 -1.82 0.02 0.00 -0.26 0.00 0.00 58.87 56.80 2c3y n SER 1123Cb 0.00 -0.13 0.11 0.00 -0.26 0.00 0.00 64.21 63.93 2c3y n SER 1123CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2c3y h VAL 1124N 3.33 0.46 -0.37 -3.33 -1.51 -1.92 -1.62 116.25 111.29 2c3y h VAL 1124Ca 0.00 -0.04 0.08 0.00 -1.23 0.00 0.00 66.70 65.51 2c3y h VAL 1124Cb 0.73 0.34 -0.08 0.00 -2.13 0.00 0.00 31.29 30.14 2c3y h VAL 1124CO 0.00 0.02 -0.21 -0.08 -1.23 0.00 0.00 177.57 176.07 2c3y h GLU 1125N 0.11 -0.14 0.00 5.19 4.57 -1.95 0.02 114.58 122.39 2c3y h GLU 1125Ca 0.34 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 2c3y h GLU 1125Cb 0.55 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2c3y h GLU 1125CO -0.56 -0.09 0.00 -1.91 -1.18 0.00 0.00 179.01 175.27 2c3y n GLU 1126N -5.37 0.00 0.00 1.92 4.07 -0.81 -1.85 120.64 118.59 2c3y n GLU 1126Ca 0.02 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.12 2c3y n GLU 1126Cb 0.29 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.67 2c3y n GLU 1126CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2c3y n PHE 1127N 0.00 -0.12 0.21 4.31 7.35 -0.21 -2.11 117.46 126.89 2c3y n PHE 1127Ca 0.00 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.55 2c3y n PHE 1127Cb 0.00 0.36 -0.08 0.00 0.35 0.00 0.00 39.48 40.11 2c3y n PHE 1127CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2c3y h LEU 1128N 0.00 -0.45 0.00 -2.13 3.38 -0.82 -3.07 115.31 112.22 2c3y h LEU 1128Ca 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2c3y h LEU 1128Cb 0.00 0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2c3y h LEU 1128CO 0.00 -0.14 0.00 0.23 0.09 0.00 0.00 178.44 178.62 2c3y n MET 1129N -5.23 0.01 -0.01 1.13 2.81 -0.77 -1.00 117.12 114.05 2c3y n MET 1129Ca -0.10 0.42 0.14 0.00 -1.81 0.00 0.00 57.70 56.34 2c3y n MET 1129Cb 0.28 -1.50 0.56 0.00 -0.71 0.00 0.00 33.22 31.85 2c3y n MET 1129CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c3y n ALA 1130N -1.48 2.58 -3.39 3.04 0.00 -0.90 -4.66 120.51 115.71 2c3y n ALA 1130Ca 0.01 -0.42 -0.28 0.00 0.00 0.00 0.00 53.44 52.75 2c3y n ALA 1130Cb 0.04 -1.20 -0.17 0.00 0.00 0.00 0.00 19.45 18.12 2c3y n ALA 1130CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2c3y s GLN 1131N -1.97 2.37 0.45 0.00 -0.21 -0.17 -1.70 119.66 118.43 2c3y s GLN 1131Ca 0.38 -0.64 0.14 0.00 0.02 0.00 0.00 55.36 55.26 2c3y s GLN 1131Cb 0.20 -1.87 1.07 0.00 1.00 0.00 0.00 33.01 33.42 2c3y s GLN 1131CO 0.33 0.08 2.02 -0.97 -2.12 0.00 0.00 175.29 174.63 2c3y h ASN 1132N 6.92 0.30 -0.02 5.90 -0.73 -0.76 -0.09 115.58 127.09 2c3y h ASN 1132Ca -0.26 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.92 2c3y h ASN 1132Cb 1.21 -0.06 -0.00 0.00 0.27 0.00 0.00 38.32 39.74 2c3y h ASN 1132CO 0.48 0.19 0.09 0.08 -0.37 0.00 0.00 177.43 177.90 2c3y h ARG 1133N 0.34 0.00 0.00 6.67 0.11 -1.65 -0.44 114.38 119.41 2c3y h ARG 1133Ca 0.21 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 60.01 2c3y h ARG 1133Cb 0.41 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.44 2c3y h ARG 1133CO -0.05 0.00 -2.01 1.19 0.10 0.00 0.00 179.97 179.20 2c3y n PHE 1134N -3.16 0.00 -0.28 4.08 3.01 -0.50 -0.31 117.46 120.29 2c3y n PHE 1134Ca -0.02 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.47 2c3y n PHE 1134Cb 0.16 -0.66 0.25 0.00 -0.01 0.00 0.00 39.48 39.22 2c3y n PHE 1134CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2c3y h ALA 1135N -0.33 1.52 -0.38 4.37 0.00 -0.83 -2.30 119.26 121.31 2c3y h ALA 1135Ca -0.43 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2c3y h ALA 1135Cb 1.50 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2c3y h ALA 1135CO -0.17 0.36 0.20 -0.39 0.00 0.00 0.00 179.25 179.25 2c3y h VAL 1136N 1.01 1.12 -0.49 0.00 -1.51 -1.33 -1.38 116.25 113.67 2c3y h VAL 1136Ca 0.37 -0.32 -0.11 0.00 -1.23 0.00 0.00 66.70 65.40 2c3y h VAL 1136Cb 0.16 0.62 -0.02 0.00 -2.13 0.00 0.00 31.29 29.92 2c3y h VAL 1136CO -0.13 0.14 -0.14 0.25 -1.23 0.00 0.00 177.57 176.46 2c3y h LEU 1137N 0.53 0.94 -1.44 4.19 7.12 -1.65 -1.49 115.31 123.50 2c3y h LEU 1137Ca 0.14 -0.32 -0.01 0.00 0.13 0.00 0.00 57.88 57.83 2c3y h LEU 1137Cb 0.03 -0.26 -0.02 0.00 -0.53 0.00 0.00 40.66 39.88 2c3y h LEU 1137CO -0.02 1.07 0.27 -0.78 -0.13 0.00 0.00 178.44 178.85 2c3y h ASP 1138N 0.83 0.57 1.12 1.25 3.58 -1.15 0.55 116.42 123.16 2c3y h ASP 1138Ca 0.13 -0.03 -0.18 0.00 0.42 0.00 0.00 57.03 57.36 2c3y h ASP 1138Cb 0.68 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.56 2c3y h ASP 1138CO 0.05 0.45 -0.88 0.03 -2.88 0.00 0.00 179.24 176.01 2c3y h ARG 1139N 0.66 0.00 0.06 0.28 3.08 -1.05 -3.13 114.38 114.27 2c3y h ARG 1139Ca 0.17 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.87 2c3y h ARG 1139Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 2c3y h ARG 1139CO -0.03 0.87 -2.00 0.43 -1.07 0.00 0.00 179.97 178.17 2c3y n SER 1140N -3.31 2.02 -3.36 7.04 7.64 -0.60 -4.70 113.62 118.34 2c3y n SER 1140Ca 0.00 0.20 -0.26 0.00 1.01 0.00 0.00 58.87 59.83 2c3y n SER 1140Cb 0.89 -0.79 -0.08 0.00 -1.01 0.00 0.00 64.21 63.22 2c3y n SER 1140CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2c3y n PHE 1141N -3.75 0.95 -0.25 1.43 3.01 0.19 -5.00 117.46 114.04 2c3y n PHE 1141Ca -0.38 -3.75 0.03 0.00 1.01 0.00 0.00 57.45 54.36 2c3y n PHE 1141Cb 0.93 -0.32 0.11 0.00 -0.01 0.00 0.00 39.48 40.20 2c3y n PHE 1141CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 2c3y h PRO 1142N 4.50 0.04 -0.04 -1.08 0.11 -1.60 0.78 132.00 134.70 2c3y h PRO 1142Ca 0.15 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 2c3y h PRO 1142Cb 0.82 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.92 2c3y h PRO 1142CO 0.57 0.02 0.00 0.93 -0.21 0.00 0.00 178.00 179.31 2c3y h GLU 1143N 0.04 0.07 -0.71 1.05 5.08 -1.91 -2.06 114.58 116.13 2c3y h GLU 1143Ca 0.37 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.66 2c3y h GLU 1143Cb 0.61 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 2c3y h GLU 1143CO -0.71 0.35 0.25 -0.44 -1.00 0.00 0.00 179.01 177.46 2c3y h ASP 1144N -0.22 1.01 0.20 1.42 3.45 -1.86 -2.92 116.42 117.51 2c3y h ASP 1144Ca 0.01 -0.19 -0.00 0.00 0.43 0.00 0.00 57.03 57.28 2c3y h ASP 1144Cb 0.32 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.81 2c3y h ASP 1144CO 0.00 0.93 -0.17 0.00 -1.57 0.00 0.00 179.24 178.44 2c3y h ALA 1145N 1.12 -0.36 -0.06 3.45 0.00 -0.79 0.35 119.26 122.97 2c3y h ALA 1145Ca 0.23 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2c3y h ALA 1145Cb 0.26 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2c3y h ALA 1145CO -0.01 -0.72 -0.06 1.57 0.00 0.00 0.00 179.25 180.03 2c3y h LYS 1146N -0.38 0.09 -0.01 0.00 2.10 -1.38 0.41 116.57 117.40 2c3y h LYS 1146Ca -0.01 -0.01 -0.21 0.00 -2.00 0.00 0.00 60.65 58.42 2c3y h LYS 1146Cb 0.35 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.66 2c3y h LYS 1146CO -0.02 0.16 -0.88 -0.09 -2.00 0.00 0.00 179.45 176.62 2c3y h ARG 1147N 0.09 0.33 -0.04 0.07 2.43 -1.26 -2.16 114.38 113.83 2c3y h ARG 1147Ca 0.02 -0.34 -0.18 0.00 -0.81 0.00 0.00 59.98 58.67 2c3y h ARG 1147Cb 0.17 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2c3y h ARG 1147CO 0.01 1.03 -0.76 -0.07 -1.51 0.00 0.00 179.97 178.66 2c3y h LEU 1148N 0.19 0.36 -0.47 3.80 3.38 0.02 -1.27 115.31 121.32 2c3y h LEU 1148Ca -0.06 -0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.50 2c3y h LEU 1148Cb 1.50 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 2c3y h LEU 1148CO 0.15 0.99 -0.50 0.03 0.09 0.00 0.00 178.44 179.19 2c3y h ARG 1149N 0.19 0.69 -0.36 1.13 3.08 -0.97 -0.98 114.38 117.17 2c3y h ARG 1149Ca -0.03 -0.41 -0.09 0.00 0.07 0.00 0.00 59.98 59.52 2c3y h ARG 1149Cb 1.34 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.41 2c3y h ARG 1149CO 0.12 1.03 -0.13 0.00 -1.07 0.00 0.00 179.97 179.93 2c3y h ALA 1150N 0.89 1.10 -0.39 0.04 0.00 -1.28 -1.34 119.26 118.27 2c3y h ALA 1150Ca 0.02 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 2c3y h ALA 1150Cb 1.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2c3y h ALA 1150CO 0.10 0.56 0.02 0.37 0.00 0.00 0.00 179.25 180.31 2c3y h GLN 1151N 0.59 0.68 -0.56 0.00 4.15 -0.93 -1.44 115.11 117.60 2c3y h GLN 1151Ca 0.10 -0.20 0.01 0.00 0.77 0.00 0.00 58.65 59.32 2c3y h GLN 1151Cb 0.56 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.16 2c3y h GLN 1151CO 0.04 0.76 0.37 0.28 -1.93 0.00 0.00 178.83 178.34 2c3y h VAL 1152N 0.51 1.14 -0.39 2.39 2.07 -0.87 0.12 116.25 121.23 2c3y h VAL 1152Ca 0.11 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 2c3y h VAL 1152Cb 0.43 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2c3y h VAL 1152CO 0.02 0.14 0.19 0.00 0.02 0.00 0.00 177.57 177.93 2c3y h ALA 1153N 1.20 1.60 -0.08 1.67 0.00 -1.05 -1.83 119.26 120.77 2c3y h ALA 1153Ca 0.20 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 2c3y h ALA 1153Cb -0.08 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.55 2c3y h ALA 1153CO -0.05 0.33 -0.59 1.25 0.00 0.00 0.00 179.25 180.20 2c3y h HIS 1154N 0.55 0.74 -0.20 0.00 6.17 -0.50 -2.79 115.15 119.12 2c3y h HIS 1154Ca 0.14 -0.35 0.05 0.00 0.71 0.00 0.00 60.37 60.92 2c3y h HIS 1154Cb 0.06 -0.11 -0.05 0.00 2.52 0.00 0.00 27.41 29.84 2c3y h HIS 1154CO 0.00 1.14 -0.11 0.93 0.71 0.00 0.00 177.93 180.61 2c3y h GLU 1155N 0.12 -0.09 0.00 5.26 5.08 -0.29 -1.44 114.58 123.22 2c3y h GLU 1155Ca -0.05 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 2c3y h GLU 1155Cb 1.25 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 2c3y h GLU 1155CO 0.12 -0.06 -0.31 1.37 -1.00 0.00 0.00 179.01 179.13 2c3y h LEU 1156N -0.09 0.00 -0.16 1.33 8.10 -1.43 -0.71 115.31 122.34 2c3y h LEU 1156Ca 0.11 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 58.08 2c3y h LEU 1156Cb 0.26 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.47 2c3y h LEU 1156CO -0.26 0.31 0.00 -0.78 -4.11 0.00 0.00 178.44 173.61 2c3y h ASP 1157N 0.00 0.28 -0.48 0.17 3.58 -1.08 -0.85 116.42 118.04 2c3y h ASP 1157Ca -0.00 -0.30 -0.07 0.00 0.42 0.00 0.00 57.03 57.08 2c3y h ASP 1157Cb 0.61 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.57 2c3y h ASP 1157CO 0.04 0.51 0.02 0.58 -2.88 0.00 0.00 179.24 177.51 2c3y h VAL 1158N 0.04 1.26 -0.69 2.25 2.07 -1.02 -2.52 116.25 117.64 2c3y h VAL 1158Ca 0.05 -1.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.48 2c3y h VAL 1158Cb 0.37 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 2c3y h VAL 1158CO 0.01 0.36 0.20 -0.09 0.02 0.00 0.00 177.57 178.07 2c3y h ARG 1159N 0.69 1.09 -0.68 1.57 2.43 -1.08 -1.47 114.38 116.93 2c3y h ARG 1159Ca 0.14 -0.24 -0.05 0.00 -0.81 0.00 0.00 59.98 59.02 2c3y h ARG 1159Cb 0.48 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 2c3y h ARG 1159CO 0.02 0.95 0.25 0.35 -1.51 0.00 0.00 179.97 180.03 2c3y h PHE 1160N 1.02 1.06 -0.60 2.20 3.57 -1.06 -0.74 116.94 122.39 2c3y h PHE 1160Ca 0.22 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2c3y h PHE 1160Cb 0.32 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 2c3y h PHE 1160CO 0.03 0.84 0.34 0.87 -2.23 0.00 0.00 178.31 178.16 2c3y h LYS 1161N 0.98 0.82 -0.16 1.11 1.57 -1.12 0.47 116.57 120.24 2c3y h LYS 1161Ca 0.22 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.82 2c3y h LYS 1161Cb 0.24 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2c3y h LYS 1161CO -0.01 0.59 -0.37 0.93 -0.57 0.00 0.00 179.45 180.02 2c3y h GLU 1162N 0.83 0.34 -0.10 3.15 5.08 -0.42 -0.06 114.58 123.40 2c3y h GLU 1162Ca 0.22 -0.15 -0.18 0.00 -1.00 0.00 0.00 59.36 58.25 2c3y h GLU 1162Cb -0.00 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2c3y h GLU 1162CO -0.04 0.67 -0.68 -0.07 -1.00 0.00 0.00 179.01 177.89 2c3y h LEU 1163N 0.29 0.51 -0.92 1.33 3.38 -0.06 -0.85 115.31 119.00 2c3y h LEU 1163Ca 0.03 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.58 2c3y h LEU 1163Cb 0.79 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2c3y h LEU 1163CO 0.06 1.05 -0.35 -0.33 0.09 0.00 0.00 178.44 178.96 2c3y h GLU 1164N 0.31 0.37 -0.25 1.13 5.08 -0.66 -0.74 114.58 119.82 2c3y h GLU 1164Ca -0.02 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2c3y h GLU 1164Cb 1.24 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2c3y h GLU 1164CO 0.12 0.67 0.14 1.25 -1.00 0.00 0.00 179.01 180.19 2c3y h HIS 1165N 0.32 0.33 -0.65 4.33 2.76 -0.57 -1.61 115.15 120.06 2c3y h HIS 1165Ca 0.04 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.14 2c3y h HIS 1165Cb 0.76 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.59 2c3y h HIS 1165CO 0.02 0.27 0.16 0.52 -1.30 0.00 0.00 177.93 177.60 2c3y h MET 1166N 0.30 1.02 0.00 5.26 2.86 -0.74 -2.55 114.93 121.08 2c3y h MET 1166Ca 0.09 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 2c3y h MET 1166Cb 0.04 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.56 2c3y h MET 1166CO -0.02 0.90 -0.02 0.00 1.06 0.00 0.00 176.91 178.83 2c3y h ALA 1167N 1.20 1.01 -0.02 6.32 0.00 -0.71 -3.02 119.26 124.06 2c3y h ALA 1167Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2c3y h ALA 1167Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2c3y h ALA 1167CO -0.00 0.03 -0.45 0.00 0.00 0.00 0.00 179.25 178.83 2c3y n ALA 1168N -2.11 3.50 -1.49 0.00 0.00 -0.65 -4.99 120.51 114.77 2c3y n ALA 1168Ca -0.00 -0.63 -0.32 0.00 0.00 0.00 0.00 53.44 52.49 2c3y n ALA 1168Cb 0.28 -0.81 0.05 0.00 0.00 0.00 0.00 19.45 18.97 2c3y n ALA 1168CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2c3y s THR 1169N -2.46 3.56 -0.12 0.00 -1.32 -1.08 -4.96 115.64 109.25 2c3y s THR 1169Ca 0.19 0.62 0.15 0.00 -1.21 0.00 0.00 61.69 61.45 2c3y s THR 1169Cb 0.18 -3.18 0.28 0.00 -1.51 0.00 0.00 72.50 68.28 2c3y s THR 1169CO 0.56 -0.55 1.14 -0.46 -2.21 0.00 0.00 174.62 173.10 2c3y n ASN 1170N -2.77 1.90 -4.25 8.08 0.23 -1.26 -4.88 115.26 112.31 2c3y n ASN 1170Ca 0.09 -3.06 -0.43 0.00 -0.53 0.00 0.00 54.58 50.64 2c3y n ASN 1170Cb 0.53 -0.41 -0.04 0.00 -2.08 0.00 0.00 39.78 37.77 2c3y n ASN 1170CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2c3y s ILE 1171N -2.49 4.99 0.04 1.53 1.01 -1.26 -5.05 121.20 119.96 2c3y s ILE 1171Ca 0.29 -2.71 -0.08 0.00 0.00 0.00 0.00 60.65 58.15 2c3y s ILE 1171Cb 0.26 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 2c3y s ILE 1171CO 0.00 -0.99 0.33 -0.36 0.00 0.00 0.00 174.94 173.92 2c3y s PHE 1172N -0.01 3.58 -0.50 3.97 0.08 -1.26 -5.03 117.98 118.81 2c3y s PHE 1172Ca 0.18 0.67 -0.19 0.00 0.12 0.00 0.00 56.93 57.71 2c3y s PHE 1172Cb -0.13 -2.07 0.05 0.00 -0.57 0.00 0.00 43.02 40.30 2c3y s PHE 1172CO -0.07 0.57 0.62 -1.21 -0.10 0.00 0.00 175.22 175.03 2c3y s GLU 1173N -1.80 3.13 -0.87 0.44 2.02 -1.26 -4.97 118.70 115.38 2c3y s GLU 1173Ca 0.30 -0.84 -0.31 0.00 0.02 0.00 0.00 54.97 54.13 2c3y s GLU 1173Cb -0.14 -4.08 -0.19 0.00 0.10 0.00 0.00 34.13 29.82 2c3y s GLU 1173CO 0.17 -1.19 2.61 0.45 0.02 0.00 0.00 175.26 177.32 2c3y n SER 1174N 6.15 0.70 -4.68 -0.19 2.88 -1.26 -4.68 113.62 112.54 2c3y n SER 1174Ca -0.06 0.10 -0.42 0.00 -1.33 0.00 0.00 58.87 57.15 2c3y n SER 1174Cb 0.46 -1.04 -0.03 0.00 -0.75 0.00 0.00 64.21 62.85 2c3y n SER 1174CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2c3y s PHE 1175N 9.35 2.28 -0.36 0.66 5.36 -1.26 -4.98 117.98 129.02 2c3y s PHE 1175Ca 1.28 0.25 -0.07 0.00 -0.96 0.00 0.00 56.93 57.43 2c3y s PHE 1175Cb -1.08 -3.98 0.05 0.00 -0.34 0.00 0.00 43.02 37.67 2c3y s PHE 1175CO 0.46 -3.99 0.15 0.00 -1.46 0.00 0.00 175.22 170.38 2c3y s ALA 1176N 2.96 3.13 0.00 11.12 0.00 -1.26 -4.76 121.76 132.95 2c3y s ALA 1176Ca 0.75 -1.88 0.00 0.00 0.00 0.00 0.00 51.96 50.83 2c3y s ALA 1176Cb -0.39 -2.39 0.00 0.00 0.00 0.00 0.00 23.12 20.34 2c3y s ALA 1176CO 0.33 -1.44 0.10 -2.30 0.00 0.00 0.00 175.76 172.44 2c3y n PRO 1177N 4.84 0.00 0.00 0.00 -0.02 -1.26 -5.04 135.00 133.52 2c3y n PRO 1177Ca -0.11 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 2c3y n PRO 1177Cb 0.44 -0.60 0.00 0.00 -0.02 0.00 0.00 33.50 33.32 2c3y n PRO 1177CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c3y n ALA 1178N -2.57 0.00 -0.26 3.55 0.00 -1.26 -5.05 120.51 114.91 2c3y n ALA 1178Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2c3y n ALA 1178Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2c3y n ALA 1178CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3y n GLY 1179N 0.00 -0.81 3.25 0.00 0.00 -1.26 -4.97 105.19 101.39 2c3y n GLY 1179Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2c3y n GLY 1179CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c3y n GLY 1180N 0.00 1.43 5.00 -0.02 0.00 -1.26 -4.91 105.19 105.43 2c3y n GLY 1180Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2c3y n GLY 1180CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2c3y n LYS 1181N 0.00 0.00 -2.85 1.61 5.02 -1.26 -4.71 118.16 115.97 2c3y n LYS 1181Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 2c3y n LYS 1181Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2c3y n LYS 1181CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2c3y n ALA 1182N 0.00 -3.03 -1.46 7.82 0.00 -1.26 -4.66 120.51 117.92 2c3y n ALA 1182Ca 0.00 0.52 -0.46 0.00 0.00 0.00 0.00 53.44 53.51 2c3y n ALA 1182Cb 0.00 -1.18 -0.09 0.00 0.00 0.00 0.00 19.45 18.18 2c3y n ALA 1182CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2c3y n ASP 1183N 1.02 1.49 0.00 0.00 9.92 -1.26 -4.64 116.55 123.07 2c3y n ASP 1183Ca -0.04 0.16 0.00 0.00 -0.53 0.00 0.00 54.79 54.39 2c3y n ASP 1183Cb 0.19 -1.20 0.00 0.00 -0.64 0.00 0.00 41.12 39.47 2c3y n ASP 1183CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2c3y n GLY 1184N 6.52 4.16 3.41 0.44 0.00 -1.26 -5.16 105.19 113.29 2c3y n GLY 1184Ca 0.49 -1.60 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 2c3y n GLY 1184CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c3y s SER 1185N 0.00 -0.13 0.01 1.61 1.04 -1.26 -5.13 113.70 109.84 2c3y s SER 1185Ca 0.00 -0.60 -0.03 0.00 0.48 0.00 0.00 55.95 55.80 2c3y s SER 1185Cb 0.00 0.50 -0.01 0.00 0.10 0.00 0.00 66.02 66.61 2c3y s SER 1185CO 0.00 -0.95 0.04 0.54 0.98 0.00 0.00 173.24 173.85 2c3y s VAL 1186N -3.90 0.10 0.18 5.02 0.11 -1.26 -5.14 120.40 115.51 2c3y s VAL 1186Ca 0.11 -0.82 -0.27 0.00 -2.93 0.00 0.00 61.98 58.07 2c3y s VAL 1186Cb 0.01 -0.32 -0.08 0.00 -1.53 0.00 0.00 36.38 34.46 2c3y s VAL 1186CO -0.04 -0.45 0.85 -0.62 -3.33 0.00 0.00 175.10 171.51 2c3y s ASP 1187N -1.42 7.47 0.43 3.54 -1.08 -1.26 -4.93 116.67 119.43 2c3y s ASP 1187Ca -0.15 1.74 0.28 0.00 -0.52 0.00 0.00 52.55 53.90 2c3y s ASP 1187Cb -0.09 -2.54 1.50 0.00 -1.46 0.00 0.00 42.92 40.33 2c3y s ASP 1187CO 0.00 0.15 1.84 2.19 0.52 0.00 0.00 175.17 179.87 2c3y h PHE 1188N 4.50 0.00 -0.00 -5.34 -5.15 -2.02 -1.63 116.94 107.29 2c3y h PHE 1188Ca -0.46 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.31 2c3y h PHE 1188Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.37 2c3y h PHE 1188CO 0.63 0.00 -0.81 0.41 -2.00 0.00 0.00 178.31 176.54 2c3y n GLY 1189N -1.23 -1.09 3.68 6.09 0.00 -1.26 -4.85 105.19 106.52 2c3y n GLY 1189Ca -0.02 -0.51 -0.44 0.00 0.00 0.00 0.00 46.02 45.06 2c3y n GLY 1189CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3y n GLU 1190N -1.50 2.65 -0.98 1.61 1.02 -0.62 -2.13 120.64 120.69 2c3y n GLU 1190Ca 0.05 0.97 0.00 0.00 -0.02 0.00 0.00 57.16 58.15 2c3y n GLU 1190Cb 0.33 -2.87 0.00 0.00 -0.02 0.00 0.00 31.44 28.89 2c3y n GLU 1190CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c3y n GLY 1191N 4.34 0.39 3.77 0.62 0.00 -1.26 -5.00 105.19 108.05 2c3y n GLY 1191Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 2c3y n GLY 1191CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3y s ALA 1192N -1.86 3.20 0.28 4.61 0.00 -0.91 -4.93 121.76 122.16 2c3y s ALA 1192Ca 0.00 1.21 0.06 0.00 0.00 0.00 0.00 51.96 53.23 2c3y s ALA 1192Cb 0.00 -3.48 0.41 0.00 0.00 0.00 0.00 23.12 20.05 2c3y s ALA 1192CO 0.00 -0.85 1.67 0.93 0.00 0.00 0.00 175.76 177.51 2c3y h GLU 1193N 2.52 0.24 -5.50 0.00 3.07 -1.94 -3.45 114.58 109.50 2c3y h GLU 1193Ca -0.50 -0.12 -0.57 0.00 -0.50 0.00 0.00 59.36 57.67 2c3y h GLU 1193Cb 1.25 0.00 -0.13 0.00 -0.84 0.00 0.00 28.75 29.03 2c3y h GLU 1193CO 0.62 0.65 -0.60 -0.06 -1.40 0.00 0.00 179.01 178.21 2c3y s PHE 1194N -4.06 2.31 0.35 4.33 0.40 -1.26 -4.49 117.98 115.56 2c3y s PHE 1194Ca -0.04 -0.77 -0.28 0.00 -0.60 0.00 0.00 56.93 55.23 2c3y s PHE 1194Cb 0.13 -1.59 -0.12 0.00 0.51 0.00 0.00 43.02 41.95 2c3y s PHE 1194CO 0.78 0.29 1.37 0.00 0.70 0.00 0.00 175.22 178.35 2c3y n THR 1196N 0.41 0.00 -4.26 0.00 5.66 -1.26 -4.96 114.28 109.87 2c3y n THR 1196Ca 0.04 -0.38 -0.19 0.00 -3.05 0.00 0.00 64.05 60.47 2c3y n THR 1196Cb 0.37 1.08 -0.11 0.00 -1.55 0.00 0.00 70.33 70.11 2c3y n THR 1196CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2c3y s ARG 1197N -1.41 1.06 0.47 1.09 0.52 -1.26 -5.02 118.95 114.40 2c3y s ARG 1197Ca 0.06 -1.26 0.01 0.00 -0.52 0.00 0.00 55.73 54.02 2c3y s ARG 1197Cb 0.07 -0.99 0.09 0.00 0.52 0.00 0.00 34.95 34.64 2c3y s ARG 1197CO 0.26 0.19 0.64 -0.40 0.02 0.00 0.00 175.30 176.02 2c3y n ASP 1198N 0.53 0.98 -0.97 0.23 3.85 -1.26 -5.00 116.55 114.91 2c3y n ASP 1198Ca -0.15 -1.80 0.04 0.00 -0.71 0.00 0.00 54.79 52.17 2c3y n ASP 1198Cb 0.57 -0.41 0.18 0.00 -1.35 0.00 0.00 41.12 40.11 2c3y n ASP 1198CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2c3y n ASP 1199N -2.88 2.75 -4.85 -1.12 8.00 -1.26 -4.82 116.55 112.36 2c3y n ASP 1199Ca 0.11 -2.27 -0.32 0.00 0.71 0.00 0.00 54.79 53.03 2c3y n ASP 1199Cb 0.39 -0.45 -0.04 0.00 -0.02 0.00 0.00 41.12 41.01 2c3y n ASP 1199CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2c3y s THR 1200N -1.72 4.62 0.15 -3.53 2.01 -1.26 -4.96 115.64 110.94 2c3y s THR 1200Ca 0.26 1.02 0.30 0.00 0.31 0.00 0.00 61.69 63.58 2c3y s THR 1200Cb 0.17 -3.71 0.33 0.00 0.01 0.00 0.00 72.50 69.30 2c3y s THR 1200CO 0.11 -0.56 1.94 -0.65 -0.69 0.00 0.00 174.62 174.77 2c3y h PRO 1201N 1.21 0.00 -0.10 4.92 0.11 -1.97 -2.99 132.00 133.19 2c3y h PRO 1201Ca -0.47 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 2c3y h PRO 1201Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2c3y h PRO 1201CO 0.62 0.09 -0.46 0.52 -0.21 0.00 0.00 178.00 178.57 2c3y h MET 1202N 0.00 0.23 -0.02 1.05 2.86 -1.97 -3.06 114.93 114.03 2c3y h MET 1202Ca -0.00 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2c3y h MET 1202Cb 0.57 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.24 2c3y h MET 1202CO 0.01 0.65 -0.29 -1.33 1.06 0.00 0.00 176.91 177.01 2c3y n MET 1203N -3.99 1.40 -1.95 1.72 2.81 -1.14 -4.95 117.12 111.02 2c3y n MET 1203Ca -0.02 -1.07 -0.41 0.00 -1.81 0.00 0.00 57.70 54.39 2c3y n MET 1203Cb 0.51 -1.48 -0.02 0.00 -0.71 0.00 0.00 33.22 31.53 2c3y n MET 1203CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c3y s ALA 1204N -2.34 3.64 0.08 3.04 0.00 -1.16 -4.94 121.76 120.08 2c3y s ALA 1204Ca 0.23 1.40 -0.01 0.00 0.00 0.00 0.00 51.96 53.58 2c3y s ALA 1204Cb 0.19 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 2c3y s ALA 1204CO 0.48 -0.81 -0.00 1.03 0.00 0.00 0.00 175.76 176.46 2c3y s ARG 1205N -0.62 0.71 0.27 0.00 1.81 -1.26 -5.03 118.95 114.84 2c3y s ARG 1205Ca 0.59 -1.29 0.00 0.00 -1.72 0.00 0.00 55.73 53.31 2c3y s ARG 1205Cb -0.43 0.22 0.63 0.00 -0.45 0.00 0.00 34.95 34.92 2c3y s ARG 1205CO 0.46 -0.16 1.68 -1.35 -0.68 0.00 0.00 175.30 175.25 2c3y h PRO 1206N 3.05 0.28 -0.18 3.54 0.11 -2.04 -1.02 132.00 135.74 2c3y h PRO 1206Ca -0.34 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2c3y h PRO 1206Cb 1.16 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2c3y h PRO 1206CO 0.64 0.19 0.00 -0.25 -0.21 0.00 0.00 178.00 178.36 2c3y n ASP 1207N -5.15 1.57 -4.91 -2.05 8.00 -1.26 -4.93 116.55 107.83 2c3y n ASP 1207Ca 0.19 -1.73 -0.27 0.00 0.71 0.00 0.00 54.79 53.68 2c3y n ASP 1207Cb 0.59 -0.12 0.04 0.00 -0.02 0.00 0.00 41.12 41.62 2c3y n ASP 1207CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2c3y s SER 1208N -1.48 5.43 0.00 -2.24 1.04 -0.39 -4.65 113.70 111.41 2c3y s SER 1208Ca 0.30 0.77 0.00 0.00 0.48 0.00 0.00 55.95 57.51 2c3y s SER 1208Cb 0.16 -1.67 0.00 0.00 0.10 0.00 0.00 66.02 64.62 2c3y s SER 1208CO 0.24 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.86 2c3y n GLY 1209N -2.74 1.60 3.76 7.32 0.00 -1.26 -4.89 105.19 108.99 2c3y n GLY 1209Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 2c3y n GLY 1209CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2c3y s GLU 1210N 0.00 3.00 0.51 1.61 2.12 -1.26 -4.99 118.70 119.68 2c3y s GLU 1210Ca 0.00 1.58 -0.20 0.00 0.36 0.00 0.00 54.97 56.71 2c3y s GLU 1210Cb 0.00 -1.96 -0.07 0.00 0.26 0.00 0.00 34.13 32.36 2c3y s GLU 1210CO 0.00 -1.13 1.09 0.00 -0.54 0.00 0.00 175.26 174.68 2c3y s ALA 1211N -1.95 2.80 0.24 6.30 0.00 -1.26 -5.05 121.76 122.84 2c3y s ALA 1211Ca 0.72 0.74 -0.22 0.00 0.00 0.00 0.00 51.96 53.20 2c3y s ALA 1211Cb -0.24 -3.32 0.04 0.00 0.00 0.00 0.00 23.12 19.60 2c3y s ALA 1211CO 0.34 -0.55 0.75 0.00 0.00 0.00 0.00 175.76 176.30 2c3y s ASP 1213N -2.89 6.71 -0.03 0.00 -1.08 -1.26 -4.77 116.67 113.34 2c3y s ASP 1213Ca 0.10 0.61 0.06 0.00 -0.52 0.00 0.00 52.55 52.80 2c3y s ASP 1213Cb -0.04 -2.52 0.24 0.00 -1.46 0.00 0.00 42.92 39.14 2c3y s ASP 1213CO 0.03 -1.04 1.05 1.67 0.52 0.00 0.00 175.17 177.41 2c3y n GLN 1214N 7.26 1.88 -2.15 4.34 7.27 -1.26 -0.04 117.38 134.67 2c3y n GLN 1214Ca 0.10 -0.93 -0.14 0.00 0.07 0.00 0.00 57.00 56.09 2c3y n GLN 1214Cb 0.48 -1.44 -0.01 0.00 2.41 0.00 0.00 30.24 31.68 2c3y n GLN 1214CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2c3y n ASN 1215N 0.20 -4.45 -1.06 1.69 4.13 -1.26 -4.90 115.26 109.61 2c3y n ASN 1215Ca 0.08 0.04 0.10 0.00 1.68 0.00 0.00 54.58 56.49 2c3y n ASN 1215Cb 0.36 -3.56 0.22 0.00 -1.54 0.00 0.00 39.78 35.27 2c3y n ASN 1215CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2c3y n ARG 1216N -2.41 2.48 0.00 3.52 1.74 -1.26 -4.31 116.66 116.41 2c3y n ARG 1216Ca -0.17 -2.26 0.00 0.00 -0.77 0.00 0.00 57.85 54.65 2c3y n ARG 1216Cb 0.61 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 2c3y n ARG 1216CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c3y n ALA 1217N 1.29 2.10 0.00 7.54 0.00 -1.26 -5.13 120.51 125.05 2c3y n ALA 1217Ca 0.18 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.84 2c3y n ALA 1217Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2c3y n ALA 1217CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3y n GLY 1218N -0.29 0.24 3.66 0.00 0.00 -1.26 -4.53 105.19 103.01 2c3y n GLY 1218Ca 0.00 -1.96 -0.30 0.00 0.00 0.00 0.00 46.02 43.76 2c3y n GLY 1218CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c3y s THR 1219N -1.34 2.42 0.15 2.61 2.01 -1.26 -4.71 115.64 115.52 2c3y s THR 1219Ca 0.00 0.14 -0.19 0.00 0.31 0.00 0.00 61.69 61.95 2c3y s THR 1219Cb 0.00 -2.38 0.03 0.00 0.01 0.00 0.00 72.50 70.17 2c3y s THR 1219CO 0.00 -0.18 1.68 0.28 -0.69 0.00 0.00 174.62 175.71 2c3y h SER 1220N -1.84 -0.35 -0.36 3.53 0.02 -1.99 0.38 113.55 112.95 2c3y h SER 1220Ca -0.49 0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.54 2c3y h SER 1220Cb 1.28 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 64.02 2c3y h SER 1220CO 0.49 -0.13 0.17 1.05 -1.14 0.00 0.00 176.83 177.27 2c3y h GLU 1221N -0.04 0.52 -0.91 3.45 9.09 -1.98 -0.12 114.58 124.58 2c3y h GLU 1221Ca 0.14 -0.08 0.07 0.00 0.05 0.00 0.00 59.36 59.54 2c3y h GLU 1221Cb 0.26 -0.09 -0.07 0.00 -1.65 0.00 0.00 28.75 27.20 2c3y h GLU 1221CO -0.32 0.47 0.57 1.96 0.05 0.00 0.00 179.01 181.74 2c3y h GLN 1222N 0.44 1.00 -0.39 1.06 4.20 -1.77 0.41 115.11 120.06 2c3y h GLN 1222Ca 0.12 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 2c3y h GLN 1222Cb 0.12 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2c3y h GLN 1222CO -0.02 0.66 -0.16 1.96 -0.67 0.00 0.00 178.83 180.60 2c3y h GLN 1223N 1.03 0.80 -0.54 1.46 4.20 -0.64 -1.36 115.11 120.05 2c3y h GLN 1223Ca 0.40 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2c3y h GLN 1223Cb 0.20 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 2c3y h GLN 1223CO -0.18 0.97 0.27 0.78 -0.67 0.00 0.00 178.83 180.00 2c3y h GLY 1224N 0.61 0.82 0.98 3.46 0.00 0.10 -0.95 103.07 108.08 2c3y h GLY 1224Ca 0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 2c3y h GLY 1224CO 0.05 0.37 0.25 -1.80 0.00 0.00 0.00 176.54 175.41 2c3y h ASP 1225N 0.72 0.67 -0.72 0.19 3.58 -0.12 -1.34 116.42 119.40 2c3y h ASP 1225Ca 0.19 -0.13 0.01 0.00 0.42 0.00 0.00 57.03 57.51 2c3y h ASP 1225Cb 0.09 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 40.93 2c3y h ASP 1225CO -0.03 0.61 0.48 0.25 -2.88 0.00 0.00 179.24 177.67 2c3y h LEU 1226N 0.68 0.82 -0.41 2.28 5.85 -0.98 0.13 115.31 123.68 2c3y h LEU 1226Ca 0.18 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.91 2c3y h LEU 1226Cb 0.12 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 2c3y h LEU 1226CO -0.02 0.60 0.18 -1.28 -0.34 0.00 0.00 178.44 177.57 2c3y h SER 1227N 0.97 0.23 -0.18 1.25 0.87 -0.72 0.27 113.55 116.24 2c3y h SER 1227Ca 0.26 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.81 2c3y h SER 1227Cb -0.11 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 2c3y h SER 1227CO -0.06 0.17 -0.00 0.50 -0.53 0.00 0.00 176.83 176.92 2c3y h LYS 1228N 0.37 0.45 0.00 2.24 3.64 -0.59 0.34 116.57 123.01 2c3y h LYS 1228Ca 0.18 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 2c3y h LYS 1228Cb 0.13 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2c3y h LYS 1228CO -0.16 0.48 -0.23 0.00 -2.27 0.00 0.00 179.45 177.27 2c3y h ARG 1229N 0.43 0.00 0.03 1.90 3.08 0.04 -3.35 114.38 116.51 2c3y h ARG 1229Ca 0.10 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.79 2c3y h ARG 1229Cb 0.29 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 2c3y h ARG 1229CO 0.01 0.12 -1.99 0.25 -1.07 0.00 0.00 179.97 177.29 2c3y n THR 1230N -3.09 1.59 -0.20 2.04 -2.24 0.86 -5.08 114.28 108.17 2c3y n THR 1230Ca 0.03 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2c3y n THR 1230Cb 0.59 -1.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.00 2c3y n THR 1230CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79