#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c3p n LYS 3 N 0.00 -0.16 -3.62 1.61 5.02 -1.26 -1.50 118.16 118.25 2c3p n LYS 3 Ca 0.00 -2.20 0.02 0.00 -2.02 0.00 0.00 58.31 54.11 2c3p n LYS 3 Cb 0.00 -0.65 -0.06 0.00 -0.02 0.00 0.00 35.03 34.31 2c3p n LYS 3 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2c3p s LYS 4 N -4.79 0.06 0.17 1.97 2.20 -0.98 -4.82 119.74 113.55 2c3p s LYS 4 Ca 0.57 0.10 -0.10 0.00 -0.36 0.00 0.00 55.97 56.18 2c3p s LYS 4 Cb -0.03 0.01 -0.07 0.00 -1.51 0.00 0.00 37.83 36.24 2c3p s LYS 4 CO 0.38 -0.01 0.49 -1.64 -0.36 0.00 0.00 175.35 174.21 2c3p s MET 5 N 1.11 3.80 -0.06 4.03 -1.94 -1.26 -0.88 119.30 124.10 2c3p s MET 5 Ca -0.08 0.25 -0.29 0.00 -1.71 0.00 0.00 55.69 53.86 2c3p s MET 5 Cb -0.02 -2.81 0.10 0.00 2.01 0.00 0.00 34.83 34.11 2c3p s MET 5 CO -0.10 0.43 0.86 0.00 -0.01 0.00 0.00 175.02 176.19 2c3p s MET 6 N -2.41 0.82 -0.28 2.03 0.00 -0.43 -4.97 119.30 114.06 2c3p s MET 6 Ca 0.41 -0.00 -0.08 0.00 0.00 0.00 0.00 55.69 56.02 2c3p s MET 6 Cb -0.13 0.38 -0.01 0.00 0.00 0.00 0.00 34.83 35.07 2c3p s MET 6 CO 0.21 -0.30 0.10 0.95 0.00 0.00 0.00 175.02 175.98 2c3p s THR 7 N -1.91 4.32 0.37 3.16 -4.23 -1.26 -0.42 115.64 115.68 2c3p s THR 7 Ca -0.02 -0.38 -0.08 0.00 -1.18 0.00 0.00 61.69 60.03 2c3p s THR 7 Cb -0.01 -3.13 0.03 0.00 1.34 0.00 0.00 72.50 70.73 2c3p s THR 7 CO -0.01 0.19 0.63 0.42 -0.54 0.00 0.00 174.62 175.31 2c3p s THR 8 N 1.59 0.00 0.40 3.99 -4.23 -0.82 -4.90 115.64 111.67 2c3p s THR 8 Ca 0.05 -1.31 0.07 0.00 -1.18 0.00 0.00 61.69 59.32 2c3p s THR 8 Cb -0.16 -2.80 0.00 0.00 1.34 0.00 0.00 72.50 70.88 2c3p s THR 8 CO 0.04 0.00 0.55 1.51 -0.54 0.00 0.00 174.62 176.18 2c3p s ASP 9 N -3.17 5.76 0.29 3.99 3.84 -1.25 -1.52 116.67 124.62 2c3p s ASP 9 Ca 0.24 -0.29 0.04 0.00 -0.00 0.00 0.00 52.55 52.54 2c3p s ASP 9 Cb -0.03 -0.91 0.68 0.00 -1.38 0.00 0.00 42.92 41.28 2c3p s ASP 9 CO 0.17 -0.65 1.78 1.23 -0.00 0.00 0.00 175.17 177.70 2c3p h GLY 10 N 0.70 1.72 0.84 2.12 0.00 -1.26 0.49 103.07 107.68 2c3p h GLY 10 Ca -0.42 -0.36 0.01 0.00 0.00 0.00 0.00 47.33 46.55 2c3p h GLY 10 CO 0.49 -0.02 -0.11 3.43 0.00 0.00 0.00 176.54 180.32 2c3p h ASN 11 N 0.79 -0.31 -0.38 0.19 -0.26 -1.64 -1.13 115.58 112.84 2c3p h ASN 11 Ca 0.55 0.03 -0.12 0.00 -0.56 0.00 0.00 56.30 56.21 2c3p h ASN 11 Cb 0.80 0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 38.16 2c3p h ASN 11 CO -0.36 -0.18 -0.19 0.74 -1.06 0.00 0.00 177.43 176.39 2c3p h THR 12 N -0.25 1.27 -0.54 2.81 2.02 -1.70 0.15 112.91 116.67 2c3p h THR 12 Ca 0.01 -1.31 0.02 0.00 0.77 0.00 0.00 66.41 65.90 2c3p h THR 12 Cb 0.24 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.75 2c3p h THR 12 CO -0.04 0.45 0.34 0.00 0.37 0.00 0.00 175.52 176.63 2c3p h ALA 13 N 1.03 0.70 0.09 6.16 0.00 -0.74 0.19 119.26 126.67 2c3p h ALA 13 Ca 0.11 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.74 2c3p h ALA 13 Cb 0.72 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2c3p h ALA 13 CO 0.05 0.08 -1.16 1.79 0.00 0.00 0.00 179.25 180.01 2c3p h THR 14 N 0.69 1.56 -0.24 0.00 1.35 -0.96 -3.18 112.91 112.13 2c3p h THR 14 Ca 0.21 -3.15 -0.03 0.00 -0.55 0.00 0.00 66.41 62.89 2c3p h THR 14 Cb -0.02 2.90 -0.01 0.00 -1.73 0.00 0.00 68.15 69.29 2c3p h THR 14 CO -0.07 0.91 0.01 0.00 -0.25 0.00 0.00 175.52 176.12 2c3p h ALA 15 N 0.71 1.58 -0.58 6.62 0.00 -0.48 0.77 119.26 127.88 2c3p h ALA 15 Ca -0.10 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.76 2c3p h ALA 15 Cb 1.90 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 19.51 2c3p h ALA 15 CO 0.18 0.31 0.21 1.25 0.00 0.00 0.00 179.25 181.20 2c3p h HIS 16 N 0.34 0.36 0.04 0.00 6.17 -0.94 -0.65 115.15 120.47 2c3p h HIS 16 Ca 0.08 0.03 -0.12 0.00 0.71 0.00 0.00 60.37 61.07 2c3p h HIS 16 Cb 0.22 -0.07 0.01 0.00 2.52 0.00 0.00 27.41 30.09 2c3p h HIS 16 CO 0.00 0.09 -0.49 0.28 0.71 0.00 0.00 177.93 178.52 2c3p h VAL 17 N 0.38 1.53 -0.86 5.26 2.07 -1.32 -3.24 116.25 120.07 2c3p h VAL 17 Ca 0.29 -2.21 0.12 0.00 0.82 0.00 0.00 66.70 65.72 2c3p h VAL 17 Cb 0.36 2.93 -0.08 0.00 -1.52 0.00 0.00 31.29 32.97 2c3p h VAL 17 CO -0.30 0.62 0.48 0.00 0.02 0.00 0.00 177.57 178.39 2c3p h ALA 18 N 0.19 1.27 -0.19 1.67 0.00 -0.65 -1.76 119.26 119.79 2c3p h ALA 18 Ca -0.07 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2c3p h ALA 18 Cb 1.28 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2c3p h ALA 18 CO 0.09 0.04 0.09 -0.92 0.00 0.00 0.00 179.25 178.55 2c3p h TYR 19 N 0.76 0.28 -0.92 0.00 3.20 -1.23 -2.06 116.97 116.99 2c3p h TYR 19 Ca 0.44 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.36 2c3p h TYR 19 Cb 0.50 -0.09 -0.07 0.00 1.54 0.00 0.00 36.73 38.62 2c3p h TYR 19 CO -0.06 0.31 0.58 0.00 -1.64 0.00 0.00 178.16 177.35 2c3p h ALA 20 N 0.94 1.28 -0.01 1.82 0.00 -1.41 -3.11 119.26 118.77 2c3p h ALA 20 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2c3p h ALA 20 Cb 0.14 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2c3p h ALA 20 CO -0.01 0.34 -0.14 -1.33 0.00 0.00 0.00 179.25 178.11 2c3p n MET 21 N -4.58 1.32 -4.37 0.00 2.81 -0.73 -0.80 117.12 110.78 2c3p n MET 21 Ca 0.14 -0.83 -0.27 0.00 -1.81 0.00 0.00 57.70 54.93 2c3p n MET 21 Cb 0.19 -1.48 -0.11 0.00 -0.71 0.00 0.00 33.22 31.11 2c3p n MET 21 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2c3p s SER 22 N -2.25 3.77 -0.15 7.83 0.01 -0.79 -4.83 113.70 117.28 2c3p s SER 22 Ca 0.30 -0.75 0.10 0.00 1.31 0.00 0.00 55.95 56.91 2c3p s SER 22 Cb 0.20 -0.45 -0.16 0.00 0.21 0.00 0.00 66.02 65.82 2c3p s SER 22 CO 0.43 0.11 -0.00 -0.62 0.41 0.00 0.00 173.24 173.56 2c3p n GLU 23 N 0.15 1.33 -4.16 12.44 1.02 0.20 -4.83 120.64 126.78 2c3p n GLU 23 Ca -0.12 0.02 -0.18 0.00 -0.02 0.00 0.00 57.16 56.87 2c3p n GLU 23 Cb 0.56 -1.37 -0.12 0.00 -0.02 0.00 0.00 31.44 30.49 2c3p n GLU 23 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2c3p s VAL 24 N -2.36 1.03 -0.08 2.62 1.01 -0.60 -1.57 120.40 120.45 2c3p s VAL 24 Ca -0.12 -1.26 -0.03 0.00 0.00 0.00 0.00 61.98 60.57 2c3p s VAL 24 Cb 0.05 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.47 2c3p s VAL 24 CO 0.55 -0.24 0.17 0.00 0.00 0.00 0.00 175.10 175.59 2c3p s ALA 25 N -1.27 -0.31 -0.22 5.51 0.00 -0.48 -1.57 121.76 123.43 2c3p s ALA 25 Ca -0.03 0.73 -0.03 0.00 0.00 0.00 0.00 51.96 52.63 2c3p s ALA 25 Cb -0.10 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 2c3p s ALA 25 CO 0.02 -0.22 -0.06 0.00 0.00 0.00 0.00 175.76 175.50 2c3p s ALA 26 N 1.34 2.76 0.26 0.00 0.00 -1.20 -2.12 121.76 122.79 2c3p s ALA 26 Ca -0.08 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.75 2c3p s ALA 26 Cb -0.11 -1.65 -0.05 0.00 0.00 0.00 0.00 23.12 21.30 2c3p s ALA 26 CO -0.06 -0.42 0.01 0.96 0.00 0.00 0.00 175.76 176.25 2c3p s ILE 27 N 1.45 1.10 -0.15 0.00 -4.36 0.32 -4.67 121.20 114.89 2c3p s ILE 27 Ca 0.06 -2.03 -0.11 0.00 -0.26 0.00 0.00 60.65 58.30 2c3p s ILE 27 Cb -0.14 -2.46 0.05 0.00 1.25 0.00 0.00 42.46 41.15 2c3p s ILE 27 CO -0.04 -0.24 0.39 -0.47 0.24 0.00 0.00 174.94 174.82 2c3p s TYR 28 N -3.38 -0.48 0.03 1.37 5.04 -1.26 -1.19 117.35 117.48 2c3p s TYR 28 Ca 0.31 1.11 -0.30 0.00 -2.44 0.00 0.00 57.07 55.74 2c3p s TYR 28 Cb 0.06 0.18 -0.05 0.00 0.35 0.00 0.00 41.96 42.51 2c3p s TYR 28 CO 0.11 -0.26 1.15 -1.25 -1.34 0.00 0.00 175.55 173.96 2c3p s PRO 29 N 0.72 4.45 -0.23 4.97 0.04 -1.26 -4.88 135.00 138.80 2c3p s PRO 29 Ca -0.04 1.67 -0.13 0.00 0.04 0.00 0.00 61.00 62.55 2c3p s PRO 29 Cb -0.05 -3.40 0.07 0.00 0.04 0.00 0.00 34.50 31.16 2c3p s PRO 29 CO -0.05 -0.23 0.57 -1.50 0.04 0.00 0.00 177.00 175.82 2c3p s ILE 30 N 1.20 -0.08 0.34 0.56 2.07 -1.26 -5.00 121.20 119.02 2c3p s ILE 30 Ca 0.57 0.04 -0.28 0.00 -1.41 0.00 0.00 60.65 59.57 2c3p s ILE 30 Cb -0.27 -0.83 -0.10 0.00 0.13 0.00 0.00 42.46 41.39 2c3p s ILE 30 CO 0.28 0.02 1.26 -0.89 -1.91 0.00 0.00 174.94 173.70 2c3p s THR 31 N 1.65 2.85 -0.30 4.00 2.01 -1.26 -0.84 115.64 123.74 2c3p s THR 31 Ca -0.09 0.83 0.11 0.00 0.31 0.00 0.00 61.69 62.85 2c3p s THR 31 Cb -0.07 -3.52 0.75 0.00 0.01 0.00 0.00 72.50 69.67 2c3p s THR 31 CO -0.17 0.18 1.78 -0.81 -0.69 0.00 0.00 174.62 174.90 2c3p n PRO 32 N 0.68 3.88 0.04 4.92 -0.04 -1.26 -4.88 135.00 138.32 2c3p n PRO 32 Ca 0.01 -3.10 0.12 0.00 -0.04 0.00 0.00 63.50 60.48 2c3p n PRO 32 Cb 0.43 -2.20 0.16 0.00 -0.04 0.00 0.00 33.50 31.84 2c3p n PRO 32 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2c3p n SER 33 N -0.05 0.62 -0.32 3.54 3.41 -0.02 -4.43 113.62 116.37 2c3p n SER 33 Ca 0.38 -0.06 0.17 0.00 -0.26 0.00 0.00 58.87 59.10 2c3p n SER 33 Cb 1.33 0.34 0.35 0.00 -0.26 0.00 0.00 64.21 65.96 2c3p n SER 33 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2c3p h SER 34 N 0.00 -0.07 -1.00 4.04 0.02 -1.53 -1.12 113.55 113.88 2c3p h SER 34 Ca 0.00 0.23 0.23 0.00 -0.84 0.00 0.00 61.79 61.41 2c3p h SER 34 Cb 0.67 0.33 -0.10 0.00 0.14 0.00 0.00 62.40 63.44 2c3p h SER 34 CO 0.00 -0.26 0.63 0.74 -1.14 0.00 0.00 176.83 176.79 2c3p h THR 35 N 0.12 0.61 -0.19 -2.27 2.02 -1.89 -2.19 112.91 109.12 2c3p h THR 35 Ca 0.63 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 67.60 2c3p h THR 35 Cb 1.37 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2c3p h THR 35 CO -0.75 0.10 0.04 0.24 0.37 0.00 0.00 175.52 175.51 2c3p h MET 36 N 0.55 0.30 -0.38 6.66 2.86 -1.49 0.40 114.93 123.83 2c3p h MET 36 Ca 0.58 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 58.13 2c3p h MET 36 Cb 1.22 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.82 2c3p h MET 36 CO -0.34 0.45 0.19 0.78 1.06 0.00 0.00 176.91 179.05 2c3p h GLY 37 N 0.11 0.58 1.11 8.32 0.00 -1.58 -0.95 103.07 110.66 2c3p h GLY 37 Ca 0.06 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 2c3p h GLY 37 CO 0.00 0.27 0.46 0.83 0.00 0.00 0.00 176.54 178.10 2c3p h GLU 38 N 0.48 1.16 -0.21 4.80 5.08 -1.27 -0.88 114.58 123.74 2c3p h GLU 38 Ca 0.13 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2c3p h GLU 38 Cb 0.10 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 2c3p h GLU 38 CO -0.02 0.85 -0.03 0.93 -1.00 0.00 0.00 179.01 179.75 2c3p h GLU 39 N 1.17 0.40 -0.73 2.33 5.08 -0.68 -0.14 114.58 122.01 2c3p h GLU 39 Ca 0.30 -0.14 0.11 0.00 -1.00 0.00 0.00 59.36 58.63 2c3p h GLU 39 Cb 0.03 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.17 2c3p h GLU 39 CO -0.05 0.61 0.35 0.00 -1.00 0.00 0.00 179.01 178.92 2c3p h ALA 40 N 0.77 1.03 0.11 3.43 0.00 -0.85 0.25 119.26 123.99 2c3p h ALA 40 Ca 0.06 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2c3p h ALA 40 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2c3p h ALA 40 CO 0.02 -0.10 -0.05 0.22 0.00 0.00 0.00 179.25 179.34 2c3p h ASP 41 N 0.56 -0.13 -0.69 0.00 1.82 -0.98 -0.74 116.42 116.26 2c3p h ASP 41 Ca 0.38 -0.15 0.11 0.00 -0.39 0.00 0.00 57.03 56.97 2c3p h ASP 41 Cb 0.46 0.03 -0.08 0.00 0.68 0.00 0.00 39.33 40.43 2c3p h ASP 41 CO -0.31 0.08 0.30 0.44 -1.61 0.00 0.00 179.24 178.13 2c3p h ASP 42 N -0.33 0.33 -0.29 2.28 3.32 0.24 -1.06 116.42 120.90 2c3p h ASP 42 Ca -0.02 0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.01 2c3p h ASP 42 Cb 0.27 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 2c3p h ASP 42 CO 0.03 0.17 -0.20 -0.50 -1.72 0.00 0.00 179.24 177.01 2c3p h TRP 43 N 0.49 0.86 -0.64 4.55 6.55 -0.40 -0.21 115.95 127.14 2c3p h TRP 43 Ca 0.36 -0.19 -0.07 0.00 0.95 0.00 0.00 58.89 59.94 2c3p h TRP 43 Cb 0.46 -0.21 -0.03 0.00 -0.86 0.00 0.00 29.16 28.52 2c3p h TRP 43 CO -0.15 0.90 0.12 0.00 -1.05 0.00 0.00 178.44 178.27 2c3p h ALA 44 N 1.10 0.85 -0.08 1.49 0.00 -0.50 -0.20 119.26 121.93 2c3p h ALA 44 Ca 0.10 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 2c3p h ALA 44 Cb 0.70 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2c3p h ALA 44 CO 0.05 0.59 -0.45 0.00 0.00 0.00 0.00 179.25 179.45 2c3p h ALA 45 N 1.04 1.10 0.00 0.00 0.00 -0.90 -2.66 119.26 117.85 2c3p h ALA 45 Ca 0.20 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2c3p h ALA 45 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2c3p h ALA 45 CO 0.01 0.61 0.00 1.96 0.00 0.00 0.00 179.25 181.83 2c3p h GLN 46 N 0.15 0.00 0.00 0.00 4.20 -0.62 -3.47 115.11 115.37 2c3p h GLN 46 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2c3p h GLN 46 Cb 0.86 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.64 2c3p h GLN 46 CO 0.07 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.64 2c3p n GLY 47 N 0.71 1.10 3.73 3.46 0.00 -0.73 -5.07 105.19 108.39 2c3p n GLY 47 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2c3p n GLY 47 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2c3p s ARG 48 N -0.67 4.16 0.13 1.61 3.52 -0.16 -4.90 118.95 122.63 2c3p s ARG 48 Ca 0.00 2.51 -0.02 0.00 -0.13 0.00 0.00 55.73 58.09 2c3p s ARG 48 Cb 0.00 -3.08 -0.05 0.00 -1.56 0.00 0.00 34.95 30.26 2c3p s ARG 48 CO 0.00 -0.65 0.32 0.15 -0.81 0.00 0.00 175.30 174.32 2c3p s LYS 49 N 0.44 3.54 0.36 5.12 -0.14 -1.26 -4.24 119.74 123.56 2c3p s LYS 49 Ca 0.68 -0.26 0.02 0.00 -1.36 0.00 0.00 55.97 55.05 2c3p s LYS 49 Cb -0.47 -2.91 0.07 0.00 -1.68 0.00 0.00 37.83 32.84 2c3p s LYS 49 CO 0.38 0.50 0.49 0.27 -0.76 0.00 0.00 175.35 176.24 2c3p n ASN 50 N -0.01 0.85 0.10 2.83 0.23 0.71 -4.81 115.26 115.17 2c3p n ASN 50 Ca -0.04 -1.68 0.07 0.00 -0.53 0.00 0.00 54.58 52.41 2c3p n ASN 50 Cb 0.52 -0.30 0.38 0.00 -2.08 0.00 0.00 39.78 38.29 2c3p n ASN 50 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 2c3p n ILE 51 N -1.99 1.30 0.62 1.53 -5.35 0.01 -0.53 119.36 114.95 2c3p n ILE 51 Ca 0.09 0.56 0.11 0.00 -0.27 0.00 0.00 62.75 63.24 2c3p n ILE 51 Cb 0.31 -1.53 0.25 0.00 -1.74 0.00 0.00 39.64 36.94 2c3p n ILE 51 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2c3p n PHE 52 N -1.97 0.39 -1.32 4.28 3.01 -1.26 -4.92 117.46 115.67 2c3p n PHE 52 Ca -0.00 -0.19 -0.03 0.00 1.01 0.00 0.00 57.45 58.23 2c3p n PHE 52 Cb 0.06 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.52 2c3p n PHE 52 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2c3p n GLY 53 N 1.39 0.53 3.47 1.37 0.00 0.31 -5.04 105.19 107.23 2c3p n GLY 53 Ca 0.18 -0.89 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 2c3p n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c3p s GLN 54 N -2.71 1.69 0.29 1.61 -1.52 -1.26 -4.76 119.66 113.01 2c3p s GLN 54 Ca 0.00 -1.63 -0.22 0.00 -1.95 0.00 0.00 55.36 51.56 2c3p s GLN 54 Cb 0.00 -1.85 -0.09 0.00 -0.22 0.00 0.00 33.01 30.85 2c3p s GLN 54 CO 0.00 0.36 0.84 0.95 -0.25 0.00 0.00 175.29 177.19 2c3p s THR 55 N -2.16 4.41 0.40 -0.19 -4.23 -1.26 -0.20 115.64 112.40 2c3p s THR 55 Ca 0.27 1.51 -0.27 0.00 -1.18 0.00 0.00 61.69 62.02 2c3p s THR 55 Cb -0.06 -3.88 -0.09 0.00 1.34 0.00 0.00 72.50 69.80 2c3p s THR 55 CO 0.14 0.10 1.40 -0.22 -0.54 0.00 0.00 174.62 175.49 2c3p s LEU 56 N -2.20 4.24 -0.43 4.79 2.96 -1.26 -4.95 118.68 121.84 2c3p s LEU 56 Ca 0.49 2.87 -0.18 0.00 -0.22 0.00 0.00 54.13 57.09 2c3p s LEU 56 Cb -0.16 -3.81 0.02 0.00 0.50 0.00 0.00 46.19 42.74 2c3p s LEU 56 CO 0.21 -0.92 0.47 -0.89 -1.32 0.00 0.00 176.35 173.89 2c3p s THR 57 N -1.18 5.05 -0.04 3.68 2.01 -0.61 -4.91 115.64 119.64 2c3p s THR 57 Ca 0.56 -0.30 0.07 0.00 0.31 0.00 0.00 61.69 62.32 2c3p s THR 57 Cb -0.43 -4.07 -0.01 0.00 0.01 0.00 0.00 72.50 68.00 2c3p s THR 57 CO 0.56 -0.46 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.16 2c3p s ILE 58 N 2.23 1.96 0.00 1.82 1.01 -1.26 -1.39 121.20 125.57 2c3p s ILE 58 Ca 0.13 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 59.75 2c3p s ILE 58 Cb -0.17 -1.65 -0.00 0.00 0.01 0.00 0.00 42.46 40.65 2c3p s ILE 58 CO 0.14 0.55 -0.01 -0.13 0.00 0.00 0.00 174.94 175.49 2c3p s ARG 59 N -0.30 0.11 -0.15 2.79 1.81 -0.90 -5.00 118.95 117.30 2c3p s ARG 59 Ca 0.01 -0.12 -0.16 0.00 -1.72 0.00 0.00 55.73 53.75 2c3p s ARG 59 Cb -0.12 -0.06 -0.04 0.00 -0.45 0.00 0.00 34.95 34.28 2c3p s ARG 59 CO 0.02 0.01 0.38 -2.00 -0.68 0.00 0.00 175.30 173.03 2c3p s GLU 60 N -0.23 4.27 0.21 3.54 2.12 -1.26 -0.52 118.70 126.83 2c3p s GLU 60 Ca -0.02 0.24 0.02 0.00 0.36 0.00 0.00 54.97 55.57 2c3p s GLU 60 Cb -0.02 -3.45 0.04 0.00 0.26 0.00 0.00 34.13 30.96 2c3p s GLU 60 CO -0.00 0.16 0.28 -1.33 -0.54 0.00 0.00 175.26 173.83 2c3p n MET 61 N 3.78 0.65 0.11 4.30 2.81 -0.34 -4.92 117.12 123.51 2c3p n MET 61 Ca -0.09 -0.93 0.12 0.00 -1.81 0.00 0.00 57.70 54.99 2c3p n MET 61 Cb 0.52 -0.14 0.19 0.00 -0.71 0.00 0.00 33.22 33.07 2c3p n MET 61 CO 0.00 0.00 0.00 -0.56 1.51 0.00 0.00 175.97 176.92 2c3p h GLN 62 N 0.00 0.00 -2.34 0.03 -0.00 -1.93 -3.47 115.11 107.41 2c3p h GLN 62 Ca -0.09 0.00 0.19 0.00 -0.00 0.00 0.00 58.65 58.75 2c3p h GLN 62 Cb 0.39 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.81 2c3p h GLN 62 CO 0.12 0.00 0.58 -1.54 -0.00 0.00 0.00 178.83 177.99 2c3p s SER 63 N -4.90 -0.07 0.44 0.06 1.04 -1.26 -2.08 113.70 106.93 2c3p s SER 63 Ca 0.06 -0.51 0.24 0.00 0.48 0.00 0.00 55.95 56.22 2c3p s SER 63 Cb 0.11 0.45 0.94 0.00 0.10 0.00 0.00 66.02 67.62 2c3p s SER 63 CO 0.70 -0.87 1.84 -0.33 0.98 0.00 0.00 173.24 175.56 2c3p h GLU 64 N 2.00 0.00 -0.39 4.02 3.07 -1.93 -0.84 114.58 120.51 2c3p h GLU 64 Ca -0.26 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.48 2c3p h GLU 64 Cb 1.22 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.12 2c3p h GLU 64 CO 0.31 0.22 -0.21 0.00 -1.40 0.00 0.00 179.01 177.94 2c3p h ALA 65 N 1.78 0.55 -0.50 3.43 0.00 -1.85 0.11 119.26 122.78 2c3p h ALA 65 Ca -0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 2c3p h ALA 65 Cb 0.73 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2c3p h ALA 65 CO 0.03 0.52 0.09 0.78 0.00 0.00 0.00 179.25 180.67 2c3p h GLY 66 N 0.64 0.88 1.03 0.00 0.00 -1.79 -2.00 103.07 101.84 2c3p h GLY 66 Ca 0.09 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 2c3p h GLY 66 CO 0.06 0.54 0.45 0.00 0.00 0.00 0.00 176.54 177.59 2c3p h ALA 67 N 0.98 1.12 -0.59 3.60 0.00 -0.86 -1.79 119.26 121.73 2c3p h ALA 67 Ca 0.15 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2c3p h ALA 67 Cb 0.38 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2c3p h ALA 67 CO 0.01 0.66 0.05 0.00 0.00 0.00 0.00 179.25 179.97 2c3p h ALA 68 N 1.24 0.98 -0.21 0.00 0.00 -0.55 0.18 119.26 120.90 2c3p h ALA 68 Ca 0.30 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 2c3p h ALA 68 Cb 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2c3p h ALA 68 CO -0.04 0.63 -0.41 0.78 0.00 0.00 0.00 179.25 180.20 2c3p h GLY 69 N 1.01 0.54 1.09 0.00 0.00 -1.03 -1.53 103.07 103.15 2c3p h GLY 69 Ca 0.18 -0.54 -0.14 0.00 0.00 0.00 0.00 47.33 46.83 2c3p h GLY 69 CO 0.02 0.49 -0.30 0.00 0.00 0.00 0.00 176.54 176.74 2c3p h ALA 70 N 1.15 0.58 -0.69 3.60 0.00 -1.01 -0.98 119.26 121.90 2c3p h ALA 70 Ca 0.03 -0.42 0.01 0.00 0.00 0.00 0.00 54.91 54.53 2c3p h ALA 70 Cb 0.90 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2c3p h ALA 70 CO 0.08 0.62 0.45 0.28 0.00 0.00 0.00 179.25 180.68 2c3p h VAL 71 N 0.73 1.18 -0.69 0.00 2.07 -0.80 0.61 116.25 119.36 2c3p h VAL 71 Ca 0.08 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 2c3p h VAL 71 Cb 0.88 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2c3p h VAL 71 CO 0.08 0.18 0.29 -0.74 0.02 0.00 0.00 177.57 177.39 2c3p h HIS 72 N 0.93 1.03 -0.41 1.57 6.17 -1.03 -1.16 115.15 122.25 2c3p h HIS 72 Ca 0.25 -0.07 -0.05 0.00 0.71 0.00 0.00 60.37 61.21 2c3p h HIS 72 Cb -0.10 -0.31 -0.02 0.00 2.52 0.00 0.00 27.41 29.51 2c3p h HIS 72 CO -0.02 0.79 0.05 0.78 0.71 0.00 0.00 177.93 180.24 2c3p h GLY 73 N 0.97 0.74 0.98 5.26 0.00 -0.40 0.29 103.07 110.91 2c3p h GLY 73 Ca 0.23 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 2c3p h GLY 73 CO -0.02 0.47 0.22 0.00 0.00 0.00 0.00 176.54 177.20 2c3p h ALA 74 N 0.92 0.45 -0.44 3.60 0.00 -0.65 -0.20 119.26 122.94 2c3p h ALA 74 Ca 0.12 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2c3p h ALA 74 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2c3p h ALA 74 CO 0.01 -0.05 -0.05 -0.07 0.00 0.00 0.00 179.25 179.09 2c3p h LEU 75 N 0.46 0.81 -1.60 0.00 3.38 -1.10 -1.49 115.31 115.78 2c3p h LEU 75 Ca 0.13 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2c3p h LEU 75 Cb 0.01 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2c3p h LEU 75 CO -0.02 0.96 -0.05 0.00 0.09 0.00 0.00 178.44 179.41 2c3p h ALA 76 N 0.88 1.68 -0.29 1.53 0.00 -0.74 -1.10 119.26 121.23 2c3p h ALA 76 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c3p h ALA 76 Cb 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2c3p h ALA 76 CO 0.03 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.52 2c3p n ALA 77 N -2.50 2.51 -1.13 0.00 0.00 -0.10 -0.47 120.51 118.82 2c3p n ALA 77 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2c3p n ALA 77 Cb 0.19 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.66 2c3p n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3p n GLY 78 N 0.89 0.69 3.22 0.00 0.00 -0.42 -4.71 105.19 104.87 2c3p n GLY 78 Ca 0.10 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 2c3p n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p s ALA 79 N -2.00 2.00 0.11 4.61 0.00 -0.61 -4.76 121.76 121.10 2c3p s ALA 79 Ca 0.00 -0.94 -0.31 0.00 0.00 0.00 0.00 51.96 50.71 2c3p s ALA 79 Cb 0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 23.12 22.37 2c3p s ALA 79 CO 0.00 0.36 1.73 -0.51 0.00 0.00 0.00 175.76 177.33 2c3p s LEU 80 N -0.01 4.38 0.03 0.00 1.43 -1.26 -3.81 118.68 119.44 2c3p s LEU 80 Ca -0.06 2.63 0.03 0.00 -1.03 0.00 0.00 54.13 55.70 2c3p s LEU 80 Cb -0.14 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.49 2c3p s LEU 80 CO 0.04 -0.94 -0.10 -0.89 0.23 0.00 0.00 176.35 174.70 2c3p s THR 81 N 2.51 0.75 0.18 5.49 2.01 -1.26 -0.63 115.64 124.69 2c3p s THR 81 Ca 0.77 -0.88 -0.01 0.00 0.31 0.00 0.00 61.69 61.88 2c3p s THR 81 Cb -0.43 -0.72 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 2c3p s THR 81 CO 0.34 -0.13 0.09 0.28 -0.69 0.00 0.00 174.62 174.51 2c3p s THR 82 N -0.92 0.13 0.15 -0.82 -1.32 -0.61 -2.75 115.64 109.49 2c3p s THR 82 Ca -0.03 -1.97 -0.18 0.00 -1.21 0.00 0.00 61.69 58.31 2c3p s THR 82 Cb -0.08 -2.32 0.04 0.00 -1.51 0.00 0.00 72.50 68.63 2c3p s THR 82 CO 0.01 -0.20 0.47 0.28 -2.21 0.00 0.00 174.62 172.97 2c3p s THR 83 N -4.05 0.05 -0.07 5.08 -1.32 -1.13 -3.26 115.64 110.94 2c3p s THR 83 Ca 0.33 -0.48 0.03 0.00 -1.21 0.00 0.00 61.69 60.35 2c3p s THR 83 Cb 0.07 -1.20 0.01 0.00 -1.51 0.00 0.00 72.50 69.87 2c3p s THR 83 CO 0.08 -0.21 -0.14 -0.36 -2.21 0.00 0.00 174.62 171.78 2c3p s PHE 84 N -3.80 1.61 0.10 9.09 0.40 -1.26 -0.98 117.98 123.13 2c3p s PHE 84 Ca 0.04 -0.61 -0.04 0.00 -0.60 0.00 0.00 56.93 55.72 2c3p s PHE 84 Cb 0.01 -1.16 0.02 0.00 0.51 0.00 0.00 43.02 42.40 2c3p s PHE 84 CO -0.11 -0.29 0.21 -2.37 0.70 0.00 0.00 175.22 173.36 2c3p n THR 85 N 3.76 0.00 -3.66 0.64 5.66 -0.71 -4.63 114.28 115.35 2c3p n THR 85 Ca -0.22 -0.25 -0.00 0.00 -3.05 0.00 0.00 64.05 60.53 2c3p n THR 85 Cb 0.52 0.25 -0.01 0.00 -1.55 0.00 0.00 70.33 69.54 2c3p n THR 85 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2c3p s ALA 86 N -1.28 -2.05 0.00 1.79 0.00 -1.26 -2.08 121.76 116.88 2c3p s ALA 86 Ca 0.04 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.57 2c3p s ALA 86 Cb -0.01 0.42 0.00 0.00 0.00 0.00 0.00 23.12 23.53 2c3p s ALA 86 CO 0.03 -1.03 0.00 0.45 0.00 0.00 0.00 175.76 175.21 2c3p n SER 87 N -0.46 0.00 -0.27 0.00 2.88 -1.26 -0.19 113.62 114.33 2c3p n SER 87 Ca -0.07 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.65 2c3p n SER 87 Cb 0.62 0.00 0.48 0.00 -0.75 0.00 0.00 64.21 64.56 2c3p n SER 87 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 2c3p h GLN 88 N 0.00 0.45 -0.32 -1.46 1.08 -1.90 -1.22 115.11 111.74 2c3p h GLN 88 Ca 0.00 -0.03 -0.17 0.00 -1.45 0.00 0.00 58.65 57.00 2c3p h GLN 88 Cb 0.00 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.33 2c3p h GLN 88 CO 0.00 0.30 -0.46 0.78 -0.95 0.00 0.00 178.83 178.50 2c3p h GLY 89 N 0.47 0.97 1.09 3.46 0.00 -1.00 -2.80 103.07 105.26 2c3p h GLY 89 Ca 0.49 -1.07 -0.04 0.00 0.00 0.00 0.00 47.33 46.72 2c3p h GLY 89 CO -0.21 0.96 0.35 -2.00 0.00 0.00 0.00 176.54 175.64 2c3p h LEU 90 N 0.68 1.06 -0.77 3.11 5.85 0.00 -2.31 115.31 122.94 2c3p h LEU 90 Ca 0.03 -0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.66 2c3p h LEU 90 Cb 1.07 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.77 2c3p h LEU 90 CO 0.11 0.91 0.47 -0.07 -0.34 0.00 0.00 178.44 179.52 2c3p h LEU 91 N 1.14 0.74 -1.50 2.25 3.38 -1.24 -0.40 115.31 119.69 2c3p h LEU 91 Ca 0.27 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2c3p h LEU 91 Cb 0.16 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2c3p h LEU 91 CO -0.03 0.49 0.00 -0.07 0.09 0.00 0.00 178.44 178.92 2c3p h LEU 92 N 0.88 0.00 0.00 1.67 3.38 -1.17 -2.43 115.31 117.64 2c3p h LEU 92 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2c3p h LEU 92 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2c3p h LEU 92 CO -0.15 0.00 -0.88 0.24 0.09 0.00 0.00 178.44 177.74 2c3p h MET 93 N 0.00 0.00 -0.89 1.13 2.86 -0.80 -3.38 114.93 113.85 2c3p h MET 93 Ca 0.00 0.00 0.22 0.00 -2.06 0.00 0.00 59.70 57.86 2c3p h MET 93 Cb 0.30 0.00 -0.16 0.00 0.06 0.00 0.00 31.60 31.79 2c3p h MET 93 CO 0.00 0.00 -0.04 0.82 1.06 0.00 0.00 176.91 178.75 2c3p h ILE 94 N 0.00 0.15 -0.89 -1.22 2.04 -0.93 0.27 117.51 116.93 2c3p h ILE 94 Ca 0.00 -0.01 0.03 0.00 1.00 0.00 0.00 64.86 65.87 2c3p h ILE 94 Cb 0.99 0.10 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 2c3p h ILE 94 CO 0.00 0.01 0.58 -0.65 0.00 0.00 0.00 178.15 178.09 2c3p h PRO 95 N 0.04 1.11 0.00 2.37 0.11 -1.80 -1.42 132.00 132.42 2c3p h PRO 95 Ca 0.50 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.48 2c3p h PRO 95 Cb 0.92 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.77 2c3p h PRO 95 CO -0.84 0.73 -0.31 -0.91 -0.21 0.00 0.00 178.00 176.47 2c3p h ASN 96 N 1.14 0.00 -0.52 -2.05 2.35 -1.31 -3.13 115.58 112.06 2c3p h ASN 96 Ca 0.35 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.08 2c3p h ASN 96 Cb -0.02 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2c3p h ASN 96 CO -0.11 0.31 0.23 0.24 -1.65 0.00 0.00 177.43 176.45 2c3p h MET 97 N 0.00 0.76 -0.95 0.81 2.86 0.03 0.24 114.93 118.68 2c3p h MET 97 Ca -0.00 -0.12 0.07 0.00 -2.06 0.00 0.00 59.70 57.59 2c3p h MET 97 Cb 0.97 -0.13 -0.06 0.00 0.06 0.00 0.00 31.60 32.43 2c3p h MET 97 CO 0.04 0.64 0.61 1.88 1.06 0.00 0.00 176.91 181.15 2c3p h TYR 98 N 0.69 1.10 -0.21 -0.22 -1.99 -1.44 -0.65 116.97 114.26 2c3p h TYR 98 Ca 0.18 0.03 -0.10 0.00 2.00 0.00 0.00 58.73 60.83 2c3p h TYR 98 Cb 0.15 -0.36 -0.00 0.00 2.00 0.00 0.00 36.73 38.52 2c3p h TYR 98 CO -0.00 0.55 -0.26 0.87 -0.00 0.00 0.00 178.16 179.32 2c3p h LYS 99 N 1.06 0.55 -0.49 4.88 1.79 -1.43 0.19 116.57 123.12 2c3p h LYS 99 Ca 0.42 -0.31 -0.07 0.00 -2.18 0.00 0.00 60.65 58.51 2c3p h LYS 99 Cb 0.24 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 2c3p h LYS 99 CO -0.17 0.90 0.03 0.82 -1.08 0.00 0.00 179.45 179.95 2c3p h ILE 100 N 0.22 1.24 0.17 1.86 2.04 0.27 0.53 117.51 123.83 2c3p h ILE 100 Ca 0.03 -0.95 -0.31 0.00 1.00 0.00 0.00 64.86 64.62 2c3p h ILE 100 Cb 0.83 0.83 0.01 0.00 -0.74 0.00 0.00 36.82 37.75 2c3p h ILE 100 CO 0.06 0.34 -1.48 0.77 0.00 0.00 0.00 178.15 177.84 2c3p h SER 101 N 0.74 0.56 -0.17 1.72 4.64 -1.20 -1.76 113.55 118.09 2c3p h SER 101 Ca 0.15 -0.68 -0.01 0.00 -0.47 0.00 0.00 61.79 60.78 2c3p h SER 101 Cb 0.41 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2c3p h SER 101 CO 0.01 1.55 0.09 1.23 -0.87 0.00 0.00 176.83 178.84 2c3p h GLY 102 N 1.10 0.29 -2.54 -0.77 0.00 -0.39 -0.67 103.07 100.09 2c3p h GLY 102 Ca -0.24 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.97 2c3p h GLY 102 CO 0.21 0.12 0.00 1.18 0.00 0.00 0.00 176.54 178.04 2c3p n GLU 103 N -4.46 3.16 -3.90 4.80 1.02 0.16 -4.97 120.64 116.44 2c3p n GLU 103 Ca 0.00 -2.25 -0.40 0.00 -0.02 0.00 0.00 57.16 54.49 2c3p n GLU 103 Cb 0.11 -1.76 0.03 0.00 -0.02 0.00 0.00 31.44 29.80 2c3p n GLU 103 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2c3p n LEU 104 N 0.84 -1.37 -4.62 -4.62 4.77 -0.26 -4.96 117.00 106.78 2c3p n LEU 104 Ca 0.20 -1.17 -0.34 0.00 -0.03 0.00 0.00 56.01 54.67 2c3p n LEU 104 Cb 0.73 -1.93 -0.10 0.00 -2.33 0.00 0.00 43.42 39.78 2c3p n LEU 104 CO 0.19 0.65 -0.31 -0.76 -1.33 0.00 0.00 177.39 175.82 2c3p s LEU 105 N -6.95 3.51 -0.87 2.23 1.43 -0.67 -4.72 118.68 112.65 2c3p s LEU 105 Ca 0.46 0.06 -0.06 0.00 -1.03 0.00 0.00 54.13 53.56 2c3p s LEU 105 Cb -0.22 -1.82 -0.09 0.00 0.03 0.00 0.00 46.19 44.08 2c3p s LEU 105 CO 0.93 0.30 2.46 -0.81 0.23 0.00 0.00 176.35 179.45 2c3p n PRO 106 N 2.69 2.31 -3.18 1.29 -0.04 -1.26 -2.65 135.00 134.16 2c3p n PRO 106 Ca -0.18 -1.45 -0.27 0.00 -0.04 0.00 0.00 63.50 61.56 2c3p n PRO 106 Cb 0.53 -2.39 -0.02 0.00 -0.04 0.00 0.00 33.50 31.58 2c3p n PRO 106 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2c3p s GLY 107 N 2.84 1.64 -0.08 0.55 0.00 -1.26 -4.56 107.32 106.45 2c3p s GLY 107 Ca 0.49 -0.63 -0.00 0.00 0.00 0.00 0.00 44.72 44.58 2c3p s GLY 107 CO -0.03 -0.52 -0.05 0.14 0.00 0.00 0.00 173.10 172.64 2c3p s VAL 108 N -2.30 0.71 -0.19 1.40 1.01 -1.11 -0.20 120.40 119.73 2c3p s VAL 108 Ca 0.44 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 62.22 2c3p s VAL 108 Cb -0.10 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 2c3p s VAL 108 CO 0.35 0.30 0.03 -0.36 0.00 0.00 0.00 175.10 175.42 2c3p s PHE 109 N 1.48 3.15 -0.29 5.22 2.99 0.54 -2.82 117.98 128.24 2c3p s PHE 109 Ca -0.01 -0.14 -0.09 0.00 0.00 0.00 0.00 56.93 56.68 2c3p s PHE 109 Cb -0.13 -2.07 -0.02 0.00 0.00 0.00 0.00 43.02 40.79 2c3p s PHE 109 CO -0.04 -0.01 0.14 -1.01 -0.00 0.00 0.00 175.22 174.30 2c3p s HIS 110 N 0.62 3.16 -0.13 0.36 3.76 -0.16 -0.37 115.29 122.54 2c3p s HIS 110 Ca 0.01 -0.43 0.01 0.00 -0.15 0.00 0.00 55.06 54.51 2c3p s HIS 110 Cb -0.13 -2.33 -0.01 0.00 1.11 0.00 0.00 32.58 31.22 2c3p s HIS 110 CO 0.02 -0.39 -0.17 0.08 -0.85 0.00 0.00 174.74 173.43 2c3p s VAL 111 N 1.64 2.63 -0.57 -0.90 1.01 0.69 -1.73 120.40 123.16 2c3p s VAL 111 Ca 0.05 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 61.03 2c3p s VAL 111 Cb -0.16 -2.08 0.08 0.00 0.00 0.00 0.00 36.38 34.21 2c3p s VAL 111 CO 0.06 0.53 0.73 0.42 0.00 0.00 0.00 175.10 176.85 2c3p s THR 112 N 0.51 4.73 0.03 3.92 -4.23 -0.88 -2.02 115.64 117.69 2c3p s THR 112 Ca -0.11 -0.62 -0.31 0.00 -1.18 0.00 0.00 61.69 59.46 2c3p s THR 112 Cb -0.16 -4.46 -0.10 0.00 1.34 0.00 0.00 72.50 69.12 2c3p s THR 112 CO 0.05 -1.06 1.91 0.00 -0.54 0.00 0.00 174.62 174.97 2c3p n ALA 113 N 6.58 1.52 -2.90 3.99 0.00 -0.07 -4.47 120.51 125.16 2c3p n ALA 113 Ca -0.07 0.26 -0.12 0.00 0.00 0.00 0.00 53.44 53.51 2c3p n ALA 113 Cb 0.44 -2.61 -0.11 0.00 0.00 0.00 0.00 19.45 17.17 2c3p n ALA 113 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2c3p s ARG 114 N 3.89 0.44 0.64 0.00 3.52 -0.95 -0.68 118.95 125.80 2c3p s ARG 114 Ca 0.88 -0.66 -0.18 0.00 -0.13 0.00 0.00 55.73 55.64 2c3p s ARG 114 Cb -0.52 -0.16 -0.02 0.00 -1.56 0.00 0.00 34.95 32.70 2c3p s ARG 114 CO 0.43 0.02 1.22 0.00 -0.81 0.00 0.00 175.30 176.16 2c3p n ALA 115 N 1.63 0.92 -2.55 6.12 0.00 0.26 -3.58 120.51 123.31 2c3p n ALA 115 Ca -0.22 -0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.88 2c3p n ALA 115 Cb 0.55 -2.28 -0.05 0.00 0.00 0.00 0.00 19.45 17.67 2c3p n ALA 115 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2c3p s ILE 116 N -1.42 5.06 -0.13 0.00 -1.09 -1.26 -4.65 121.20 117.70 2c3p s ILE 116 Ca 0.81 0.41 -0.29 0.00 -2.23 0.00 0.00 60.65 59.35 2c3p s ILE 116 Cb -0.39 -3.65 -0.02 0.00 -1.58 0.00 0.00 42.46 36.83 2c3p s ILE 116 CO 0.42 0.18 1.17 0.00 -1.23 0.00 0.00 174.94 175.48 2c3p s ALA 117 N -1.52 3.58 0.00 9.38 0.00 -1.26 -4.73 121.76 127.21 2c3p s ALA 117 Ca 0.37 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.79 2c3p s ALA 117 Cb -0.13 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2c3p s ALA 117 CO 0.20 -0.94 0.00 0.00 0.00 0.00 0.00 175.76 175.02 2c3p n ALA 118 N 5.87 0.19 0.23 0.00 0.00 -1.26 -4.87 120.51 120.68 2c3p n ALA 118 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.66 2c3p n ALA 118 Cb 0.46 0.00 0.55 0.00 0.00 0.00 0.00 19.45 20.46 2c3p n ALA 118 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2c3p h HIS 119 N 0.00 0.00 -3.32 0.00 2.07 -1.89 -3.45 115.15 108.56 2c3p h HIS 119 Ca 0.00 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.49 2c3p h HIS 119 Cb 0.00 0.00 -0.11 0.00 2.57 0.00 0.00 27.41 29.87 2c3p h HIS 119 CO 0.00 0.21 0.01 0.00 -3.07 0.00 0.00 177.93 175.09 2c3p s ALA 120 N -3.91 -0.92 0.05 6.11 0.00 -1.26 -4.51 121.76 117.32 2c3p s ALA 120 Ca -0.01 -0.20 -0.14 0.00 0.00 0.00 0.00 51.96 51.60 2c3p s ALA 120 Cb 0.12 0.84 -0.06 0.00 0.00 0.00 0.00 23.12 24.02 2c3p s ALA 120 CO 0.63 -0.78 0.45 -1.17 0.00 0.00 0.00 175.76 174.88 2c3p s LEU 121 N -2.87 4.43 -0.01 0.00 0.20 -1.26 -4.24 118.68 114.93 2c3p s LEU 121 Ca 0.09 0.97 0.00 0.00 0.69 0.00 0.00 54.13 55.88 2c3p s LEU 121 Cb -0.01 -2.83 0.02 0.00 -0.43 0.00 0.00 46.19 42.94 2c3p s LEU 121 CO -0.04 0.24 0.02 -0.55 -0.29 0.00 0.00 176.35 175.73 2c3p s SER 122 N -1.36 0.06 0.00 3.68 0.15 -1.26 -4.99 113.70 109.97 2c3p s SER 122 Ca 0.29 0.02 0.26 0.00 0.70 0.00 0.00 55.95 57.22 2c3p s SER 122 Cb -0.16 -0.05 0.65 0.00 -1.71 0.00 0.00 66.02 64.75 2c3p s SER 122 CO 0.16 -0.07 1.51 2.30 1.20 0.00 0.00 173.24 178.33 2c3p n ILE 123 N 3.72 0.00 -2.07 6.45 -5.35 -1.26 -4.40 119.36 116.45 2c3p n ILE 123 Ca -0.21 -0.24 -0.27 0.00 -0.27 0.00 0.00 62.75 61.76 2c3p n ILE 123 Cb 0.54 0.71 0.10 0.00 -1.74 0.00 0.00 39.64 39.25 2c3p n ILE 123 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2c3p s PHE 124 N -2.27 2.62 -0.11 4.28 0.08 -1.26 -4.42 117.98 116.90 2c3p s PHE 124 Ca 0.28 0.48 -0.29 0.00 0.12 0.00 0.00 56.93 57.53 2c3p s PHE 124 Cb 0.20 -3.44 -0.01 0.00 -0.57 0.00 0.00 43.02 39.19 2c3p s PHE 124 CO 0.44 -1.76 0.96 0.20 -0.10 0.00 0.00 175.22 174.96 2c3p s GLY 125 N -4.62 2.36 0.17 4.36 0.00 -1.23 -0.57 107.32 107.79 2c3p s GLY 125 Ca 0.63 0.31 -0.23 0.00 0.00 0.00 0.00 44.72 45.44 2c3p s GLY 125 CO 0.48 1.82 1.04 0.51 0.00 0.00 0.00 173.10 176.95 2c3p s ASP 126 N 1.09 -0.03 -0.06 1.64 3.84 -1.11 -0.61 116.67 121.42 2c3p s ASP 126 Ca 0.46 -0.59 0.18 0.00 -0.00 0.00 0.00 52.55 52.60 2c3p s ASP 126 Cb -0.18 0.48 0.63 0.00 -1.38 0.00 0.00 42.92 42.46 2c3p s ASP 126 CO 0.18 -0.93 1.52 1.41 -0.00 0.00 0.00 175.17 177.34 2c3p n HIS 127 N -0.65 1.17 -0.33 2.11 8.25 -0.08 -2.25 115.22 123.45 2c3p n HIS 127 Ca -0.04 -0.50 0.02 0.00 -0.26 0.00 0.00 57.72 56.94 2c3p n HIS 127 Cb 0.60 -0.14 0.19 0.00 1.12 0.00 0.00 29.99 31.76 2c3p n HIS 127 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2c3p h GLN 128 N 3.75 1.13 0.08 -0.41 4.20 -1.80 -1.56 115.11 120.50 2c3p h GLN 128 Ca 0.00 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 2c3p h GLN 128 Cb 1.16 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.69 2c3p h GLN 128 CO 0.13 0.74 -0.04 0.38 -0.67 0.00 0.00 178.83 179.38 2c3p h ASP 129 N 1.16 -0.10 0.14 1.46 -0.00 -1.77 -2.62 116.42 114.69 2c3p h ASP 129 Ca 0.38 -0.43 -0.04 0.00 -0.00 0.00 0.00 57.03 56.93 2c3p h ASP 129 Cb 0.05 0.02 -0.01 0.00 -0.00 0.00 0.00 39.33 39.40 2c3p h ASP 129 CO -0.12 0.41 -0.17 0.16 -0.00 0.00 0.00 179.24 179.52 2c3p h ILE 130 N -0.64 1.15 0.00 4.15 -0.00 -1.82 -1.56 117.51 118.79 2c3p h ILE 130 Ca -0.01 -0.70 -0.07 0.00 -0.00 0.00 0.00 64.86 64.08 2c3p h ILE 130 Cb 0.52 1.31 -0.01 0.00 -0.00 0.00 0.00 36.82 38.64 2c3p h ILE 130 CO 0.02 0.21 -0.34 1.88 -0.00 0.00 0.00 178.15 179.92 2c3p h TYR 131 N 0.07 0.00 0.00 0.16 0.99 -1.31 -2.31 116.97 114.57 2c3p h TYR 131 Ca 0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.74 2c3p h TYR 131 Cb 0.35 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.08 2c3p h TYR 131 CO 0.00 0.34 0.00 0.00 -0.00 0.00 0.00 178.16 178.50 2c3p h ALA 132 N 1.66 1.00 -0.29 3.88 0.00 -0.88 -2.58 119.26 122.06 2c3p h ALA 132 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c3p h ALA 132 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2c3p h ALA 132 CO 0.04 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.29 2c3p n ALA 133 N -1.93 2.34 0.26 0.00 0.00 -0.88 -4.63 120.51 115.67 2c3p n ALA 133 Ca -0.00 -1.43 0.06 0.00 0.00 0.00 0.00 53.44 52.07 2c3p n ALA 133 Cb 0.17 -0.45 0.27 0.00 0.00 0.00 0.00 19.45 19.44 2c3p n ALA 133 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2c3p n ARG 134 N 0.14 0.05 -0.08 0.00 1.85 -0.97 -1.93 116.66 115.71 2c3p n ARG 134 Ca 0.13 0.42 0.10 0.00 -1.00 0.00 0.00 57.85 57.50 2c3p n ARG 134 Cb 0.52 -1.63 0.13 0.00 -1.05 0.00 0.00 32.46 30.43 2c3p n ARG 134 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2c3p n GLN 135 N -1.73 1.97 0.08 2.89 0.00 -1.26 -4.44 117.38 114.89 2c3p n GLN 135 Ca 0.01 -1.87 0.11 0.00 0.00 0.00 0.00 57.00 55.26 2c3p n GLN 135 Cb 0.10 -1.40 0.45 0.00 0.00 0.00 0.00 30.24 29.39 2c3p n GLN 135 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2c3p n THR 136 N 1.13 0.72 -0.26 -0.39 -2.24 -0.81 -4.88 114.28 107.55 2c3p n THR 136 Ca 0.14 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 2c3p n THR 136 Cb 0.50 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.80 2c3p n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3p n GLY 137 N 0.44 0.75 3.80 3.38 0.00 -1.26 -4.02 105.19 108.27 2c3p n GLY 137 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2c3p n GLY 137 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2c3p s PHE 138 N -2.27 3.62 0.51 1.61 0.40 -1.26 -4.72 117.98 115.86 2c3p s PHE 138 Ca 0.00 1.66 -0.18 0.00 -0.60 0.00 0.00 56.93 57.80 2c3p s PHE 138 Cb 0.00 -2.84 -0.07 0.00 0.51 0.00 0.00 43.02 40.62 2c3p s PHE 138 CO 0.00 0.19 1.02 0.00 0.70 0.00 0.00 175.22 177.12 2c3p s ALA 139 N -1.69 2.90 -0.17 5.36 0.00 0.22 -4.80 121.76 123.58 2c3p s ALA 139 Ca 0.51 0.43 -0.01 0.00 0.00 0.00 0.00 51.96 52.88 2c3p s ALA 139 Cb -0.17 -3.20 0.05 0.00 0.00 0.00 0.00 23.12 19.80 2c3p s ALA 139 CO 0.21 -0.35 -0.03 -1.64 0.00 0.00 0.00 175.76 173.95 2c3p s MET 140 N -3.62 1.21 -0.20 0.00 -1.94 0.13 -0.16 119.30 114.72 2c3p s MET 140 Ca 0.64 -0.49 -0.02 0.00 -1.71 0.00 0.00 55.69 54.11 2c3p s MET 140 Cb -0.14 -2.00 0.00 0.00 2.01 0.00 0.00 34.83 34.71 2c3p s MET 140 CO 0.26 -0.48 -0.10 -1.17 -0.01 0.00 0.00 175.02 173.51 2c3p s LEU 141 N 1.69 2.62 -0.05 -0.03 2.96 -0.59 -0.15 118.68 125.12 2c3p s LEU 141 Ca 0.00 -0.48 -0.08 0.00 -0.22 0.00 0.00 54.13 53.35 2c3p s LEU 141 Cb -0.16 -1.64 -0.05 0.00 0.50 0.00 0.00 46.19 44.85 2c3p s LEU 141 CO -0.07 -0.01 0.23 0.00 -1.32 0.00 0.00 176.35 175.18 2c3p s ALA 142 N 1.37 3.84 0.02 5.97 0.00 0.55 -1.64 121.76 131.87 2c3p s ALA 142 Ca 0.05 -0.55 0.08 0.00 0.00 0.00 0.00 51.96 51.54 2c3p s ALA 142 Cb -0.14 -2.07 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 2c3p s ALA 142 CO -0.06 0.61 -0.24 -1.54 0.00 0.00 0.00 175.76 174.53 2c3p s SER 143 N -1.30 3.29 0.00 0.00 1.04 -0.54 -4.69 113.70 111.51 2c3p s SER 143 Ca 0.21 -0.51 0.08 0.00 0.48 0.00 0.00 55.95 56.21 2c3p s SER 143 Cb -0.13 -0.39 0.20 0.00 0.10 0.00 0.00 66.02 65.80 2c3p s SER 143 CO 0.10 0.28 1.14 -1.54 0.98 0.00 0.00 173.24 174.20 2c3p n SER 144 N 1.96 2.56 -3.66 7.02 3.41 -1.26 -4.45 113.62 119.20 2c3p n SER 144 Ca -0.17 -1.94 -0.10 0.00 -0.26 0.00 0.00 58.87 56.41 2c3p n SER 144 Cb 0.52 -0.15 -0.02 0.00 -0.26 0.00 0.00 64.21 64.30 2c3p n SER 144 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2c3p s SER 145 N -0.97 -0.39 0.20 4.04 1.04 -1.26 -3.76 113.70 112.61 2c3p s SER 145 Ca 0.16 -0.33 -0.11 0.00 0.48 0.00 0.00 55.95 56.15 2c3p s SER 145 Cb 0.08 0.65 0.19 0.00 0.10 0.00 0.00 66.02 67.04 2c3p s SER 145 CO 0.11 -1.14 1.81 0.58 0.98 0.00 0.00 173.24 175.59 2c3p h VAL 146 N 2.04 1.01 -0.45 5.02 2.07 -1.92 0.11 116.25 124.12 2c3p h VAL 146 Ca -0.27 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 2c3p h VAL 146 Cb 1.28 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2c3p h VAL 146 CO 0.32 0.13 0.11 -0.61 0.02 0.00 0.00 177.57 177.53 2c3p h GLN 147 N 0.69 0.68 -0.07 1.57 5.75 -1.95 -2.60 115.11 119.18 2c3p h GLN 147 Ca 0.27 -0.12 -0.18 0.00 -0.15 0.00 0.00 58.65 58.46 2c3p h GLN 147 Cb 0.11 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 2c3p h GLN 147 CO -0.15 0.62 -0.74 0.93 -2.65 0.00 0.00 178.83 176.85 2c3p h GLU 148 N 0.66 0.36 -0.68 1.69 5.08 -1.63 -2.58 114.58 117.48 2c3p h GLU 148 Ca 0.15 -0.30 0.09 0.00 -1.00 0.00 0.00 59.36 58.30 2c3p h GLU 148 Cb 0.25 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 2c3p h GLU 148 CO -0.00 0.95 0.33 0.00 -1.00 0.00 0.00 179.01 179.28 2c3p h ALA 149 N 0.97 0.93 0.35 3.43 0.00 -0.44 0.44 119.26 124.93 2c3p h ALA 149 Ca -0.03 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2c3p h ALA 149 Cb 1.31 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2c3p h ALA 149 CO 0.12 -0.08 -0.17 1.25 0.00 0.00 0.00 179.25 180.38 2c3p h HIS 150 N 0.56 -0.43 -0.08 0.00 -0.00 -1.42 -1.21 115.15 112.57 2c3p h HIS 150 Ca 0.34 -0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.69 2c3p h HIS 150 Cb 0.36 0.14 -0.00 0.00 -0.00 0.00 0.00 27.41 27.91 2c3p h HIS 150 CO -0.12 -0.24 0.04 -0.44 -0.00 0.00 0.00 177.93 177.17 2c3p h ASP 151 N -0.51 0.10 -0.16 3.26 3.32 -0.94 -2.80 116.42 118.69 2c3p h ASP 151 Ca -0.05 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.82 2c3p h ASP 151 Cb 0.39 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2c3p h ASP 151 CO 0.08 0.18 -0.12 0.24 -1.72 0.00 0.00 179.24 177.90 2c3p h MET 152 N 0.01 0.52 -0.91 3.56 2.86 -0.19 -1.52 114.93 119.26 2c3p h MET 152 Ca 0.03 -0.15 0.03 0.00 -2.06 0.00 0.00 59.70 57.55 2c3p h MET 152 Cb 0.10 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 2c3p h MET 152 CO -0.00 0.64 0.59 0.00 1.06 0.00 0.00 176.91 179.20 2c3p h ALA 153 N 1.39 1.20 -0.17 6.32 0.00 -1.12 0.17 119.26 127.05 2c3p h ALA 153 Ca 0.09 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2c3p h ALA 153 Cb 0.50 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2c3p h ALA 153 CO 0.03 0.47 -0.16 1.25 0.00 0.00 0.00 179.25 180.84 2c3p h LEU 154 N 1.16 0.44 -0.33 0.00 6.46 -1.14 -2.47 115.31 119.44 2c3p h LEU 154 Ca 0.36 -0.47 0.03 0.00 -0.12 0.00 0.00 57.88 57.68 2c3p h LEU 154 Cb -0.02 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 39.76 2c3p h LEU 154 CO -0.11 0.82 0.14 0.58 -0.62 0.00 0.00 178.44 179.25 2c3p h VAL 155 N 0.06 0.96 -0.50 1.05 2.07 -0.96 -1.76 116.25 117.17 2c3p h VAL 155 Ca 0.03 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.54 2c3p h VAL 155 Cb 0.69 0.63 -0.09 0.00 -1.52 0.00 0.00 31.29 31.00 2c3p h VAL 155 CO 0.04 0.06 -0.08 0.00 0.02 0.00 0.00 177.57 177.61 2c3p h ALA 156 N 1.18 0.39 -0.22 1.67 0.00 -0.57 0.27 119.26 121.98 2c3p h ALA 156 Ca 0.14 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 2c3p h ALA 156 Cb 0.08 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2c3p h ALA 156 CO -0.12 -0.42 0.03 0.45 0.00 0.00 0.00 179.25 179.19 2c3p h HIS 157 N 0.04 0.40 -0.35 0.00 -0.00 -1.20 0.18 115.15 114.21 2c3p h HIS 157 Ca 0.24 -0.06 -0.02 0.00 -0.00 0.00 0.00 60.37 60.53 2c3p h HIS 157 Cb 0.38 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.66 2c3p h HIS 157 CO -0.38 0.52 0.13 -0.07 -0.00 0.00 0.00 177.93 178.13 2c3p h LEU 158 N 0.17 0.50 -0.79 2.43 3.38 -0.87 -1.11 115.31 119.02 2c3p h LEU 158 Ca 0.07 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 2c3p h LEU 158 Cb 0.34 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2c3p h LEU 158 CO 0.01 0.55 -0.24 0.00 0.09 0.00 0.00 178.44 178.85 2c3p h ALA 159 N 0.97 0.97 -0.50 1.53 0.00 -0.44 -1.75 119.26 120.04 2c3p h ALA 159 Ca 0.12 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2c3p h ALA 159 Cb 0.22 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2c3p h ALA 159 CO -0.01 0.60 0.15 0.00 0.00 0.00 0.00 179.25 179.99 2c3p h ALA 160 N 1.17 0.66 -0.56 0.00 0.00 -0.36 0.33 119.26 120.50 2c3p h ALA 160 Ca 0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2c3p h ALA 160 Cb 0.71 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2c3p h ALA 160 CO 0.05 0.32 0.18 0.82 0.00 0.00 0.00 179.25 180.63 2c3p h ILE 161 N 0.68 1.24 0.15 0.00 2.04 -0.94 -1.83 117.51 118.85 2c3p h ILE 161 Ca 0.16 -0.79 -0.28 0.00 1.00 0.00 0.00 64.86 64.95 2c3p h ILE 161 Cb 0.29 0.70 0.01 0.00 -0.74 0.00 0.00 36.82 37.08 2c3p h ILE 161 CO -0.00 0.30 -1.28 -0.08 0.00 0.00 0.00 178.15 177.08 2c3p h GLU 162 N 0.77 0.32 0.05 2.37 4.81 -1.14 -3.37 114.58 118.39 2c3p h GLU 162 Ca 0.18 -0.54 -0.23 0.00 -0.13 0.00 0.00 59.36 58.64 2c3p h GLU 162 Cb 0.27 0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 2c3p h GLU 162 CO -0.01 1.26 -1.09 0.66 -0.73 0.00 0.00 179.01 179.10 2c3p h SER 163 N 0.09 0.15 -0.03 1.04 4.64 -0.37 -3.48 113.55 115.59 2c3p h SER 163 Ca -0.15 -0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 60.99 2c3p h SER 163 Cb 2.00 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 64.03 2c3p h SER 163 CO 0.22 1.13 -0.01 0.59 -0.87 0.00 0.00 176.83 177.88 2c3p n ASN 164 N -3.42 -3.31 -4.42 4.97 3.02 -0.69 -4.94 115.26 106.47 2c3p n ASN 164 Ca -0.03 0.02 -0.34 0.00 -0.03 0.00 0.00 54.58 54.19 2c3p n ASN 164 Cb 0.97 -0.87 -0.13 0.00 -0.61 0.00 0.00 39.78 39.14 2c3p n ASN 164 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2c3p s VAL 165 N -1.95 3.73 0.58 2.41 1.01 -1.26 -3.07 120.40 121.85 2c3p s VAL 165 Ca 0.00 -0.40 -0.20 0.00 0.00 0.00 0.00 61.98 61.39 2c3p s VAL 165 Cb 0.00 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 2c3p s VAL 165 CO 0.00 0.45 1.26 -2.16 0.00 0.00 0.00 175.10 174.65 2c3p s PRO 166 N 0.87 2.97 0.03 2.72 0.04 -1.08 -4.46 135.00 136.09 2c3p s PRO 166 Ca -0.00 1.97 0.07 0.00 0.04 0.00 0.00 61.00 63.08 2c3p s PRO 166 Cb -0.14 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 2c3p s PRO 166 CO 0.02 -1.24 -0.20 -0.06 0.04 0.00 0.00 177.00 175.56 2c3p s PHE 167 N -1.48 2.52 -0.33 0.56 0.40 0.73 -0.61 117.98 119.76 2c3p s PHE 167 Ca 0.76 -0.29 -0.03 0.00 -0.60 0.00 0.00 56.93 56.78 2c3p s PHE 167 Cb -0.34 -1.46 0.06 0.00 0.51 0.00 0.00 43.02 41.79 2c3p s PHE 167 CO 0.38 0.21 0.06 1.41 0.70 0.00 0.00 175.22 177.98 2c3p s MET 168 N -1.32 2.37 -0.22 0.44 -2.45 0.78 -0.34 119.30 118.55 2c3p s MET 168 Ca 0.14 -1.36 -0.14 0.00 -1.25 0.00 0.00 55.69 53.07 2c3p s MET 168 Cb -0.10 -3.30 -0.04 0.00 1.25 0.00 0.00 34.83 32.63 2c3p s MET 168 CO 0.04 -0.72 0.34 -1.58 1.05 0.00 0.00 175.02 174.16 2c3p s HIS 169 N 1.25 3.33 0.07 4.11 2.46 0.50 -1.54 115.29 125.47 2c3p s HIS 169 Ca -0.02 0.49 0.03 0.00 0.47 0.00 0.00 55.06 56.03 2c3p s HIS 169 Cb -0.20 -2.48 -0.03 0.00 -0.13 0.00 0.00 32.58 29.74 2c3p s HIS 169 CO -0.01 -0.04 -0.09 -0.59 -2.47 0.00 0.00 174.74 171.54 2c3p s PHE 170 N 1.42 0.87 0.05 3.88 -0.12 -0.65 -0.22 117.98 123.20 2c3p s PHE 170 Ca 0.16 -0.65 -0.10 0.00 -0.05 0.00 0.00 56.93 56.29 2c3p s PHE 170 Cb -0.15 -0.50 0.01 0.00 -0.63 0.00 0.00 43.02 41.75 2c3p s PHE 170 CO 0.08 -0.07 0.22 -0.59 -0.05 0.00 0.00 175.22 174.81 2c3p s PHE 171 N -2.25 0.03 0.21 3.49 -0.12 -0.85 -1.46 117.98 117.02 2c3p s PHE 171 Ca 0.00 -0.25 -0.31 0.00 -0.05 0.00 0.00 56.93 56.33 2c3p s PHE 171 Cb -0.04 -0.00 -0.10 0.00 -0.63 0.00 0.00 43.02 42.25 2c3p s PHE 171 CO -0.01 -0.46 1.48 -0.51 -0.05 0.00 0.00 175.22 175.67 2c3p s ASP 172 N -2.17 6.64 0.25 1.98 -0.00 -1.26 -0.90 116.67 121.21 2c3p s ASP 172 Ca -0.04 2.62 -0.31 0.00 -0.00 0.00 0.00 52.55 54.82 2c3p s ASP 172 Cb -0.00 -2.61 -0.12 0.00 -0.00 0.00 0.00 42.92 40.19 2c3p s ASP 172 CO -0.05 -0.74 1.63 0.61 -0.00 0.00 0.00 175.17 176.62 2c3p n GLY 173 N 2.86 1.36 5.00 0.21 0.00 0.14 -1.25 105.19 113.50 2c3p n GLY 173 Ca 0.10 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.65 2c3p n GLY 173 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2c3p n PHE 174 N 2.85 0.00 -0.22 1.61 3.72 -1.26 -3.55 117.46 120.61 2c3p n PHE 174 Ca 0.12 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.69 2c3p n PHE 174 Cb 0.35 0.00 0.50 0.00 -0.94 0.00 0.00 39.48 39.39 2c3p n PHE 174 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 2c3p h ARG 175 N 0.00 0.41 0.00 -1.08 9.65 -1.94 -0.89 114.38 120.52 2c3p h ARG 175 Ca 0.00 -0.02 -0.09 0.00 -1.10 0.00 0.00 59.98 58.77 2c3p h ARG 175 Cb 0.00 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 2c3p h ARG 175 CO 0.00 0.27 -1.34 2.41 2.80 0.00 0.00 179.97 184.12 2c3p n THR 176 N -4.50 0.34 -0.12 0.20 -1.04 -0.38 -4.38 114.28 104.39 2c3p n THR 176 Ca 0.18 -0.12 -0.01 0.00 -2.04 0.00 0.00 64.05 62.05 2c3p n THR 176 Cb 0.63 -0.79 0.25 0.00 -1.82 0.00 0.00 70.33 68.60 2c3p n THR 176 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2c3p h SER 177 N -0.02 0.72 -0.35 8.00 4.64 -1.32 -2.18 113.55 123.04 2c3p h SER 177 Ca -0.13 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2c3p h SER 177 Cb 1.20 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2c3p h SER 177 CO -0.03 0.64 0.00 1.41 -0.87 0.00 0.00 176.83 177.98 2c3p n HIS 178 N -4.34 0.70 -3.40 4.77 8.25 -0.35 -2.13 115.22 118.72 2c3p n HIS 178 Ca 0.05 -0.63 -0.38 0.00 -0.26 0.00 0.00 57.72 56.50 2c3p n HIS 178 Cb 0.15 -0.14 -0.06 0.00 1.12 0.00 0.00 29.99 31.06 2c3p n HIS 178 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2c3p s GLU 179 N -1.65 4.08 -0.16 -0.41 2.12 -1.17 -4.65 118.70 116.86 2c3p s GLU 179 Ca 0.32 0.51 -0.10 0.00 0.36 0.00 0.00 54.97 56.05 2c3p s GLU 179 Cb 0.21 -3.27 -0.05 0.00 0.26 0.00 0.00 34.13 31.28 2c3p s GLU 179 CO 0.14 0.57 0.19 0.42 -0.54 0.00 0.00 175.26 176.04 2c3p s ILE 180 N -0.74 5.39 -0.00 -3.70 1.01 0.12 -3.43 121.20 119.85 2c3p s ILE 180 Ca 0.26 0.32 -0.07 0.00 0.00 0.00 0.00 60.65 61.16 2c3p s ILE 180 Cb -0.17 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.80 2c3p s ILE 180 CO 0.14 0.49 0.13 -1.10 0.00 0.00 0.00 174.94 174.60 2c3p s GLN 181 N -0.10 0.45 -0.20 2.79 -1.52 -0.57 -0.78 119.66 119.72 2c3p s GLN 181 Ca 0.13 -0.35 -0.28 0.00 -1.95 0.00 0.00 55.36 52.91 2c3p s GLN 181 Cb -0.12 0.19 -0.00 0.00 -0.22 0.00 0.00 33.01 32.85 2c3p s GLN 181 CO 0.02 -0.10 0.95 0.21 -0.25 0.00 0.00 175.29 176.12 2c3p s LYS 182 N -1.25 4.28 0.32 2.91 2.20 -1.04 -1.95 119.74 125.22 2c3p s LYS 182 Ca -0.13 1.22 0.06 0.00 -0.36 0.00 0.00 55.97 56.76 2c3p s LYS 182 Cb -0.07 -3.61 -0.02 0.00 -1.51 0.00 0.00 37.83 32.61 2c3p s LYS 182 CO 0.01 -0.50 0.23 0.44 -0.36 0.00 0.00 175.35 175.17 2c3p n ILE 183 N 5.07 0.00 -5.16 5.43 -5.35 0.44 -4.83 119.36 114.96 2c3p n ILE 183 Ca 0.09 -2.20 -0.32 0.00 -0.27 0.00 0.00 62.75 60.05 2c3p n ILE 183 Cb 0.47 1.03 -0.16 0.00 -1.74 0.00 0.00 39.64 39.24 2c3p n ILE 183 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2c3p s GLU 184 N -3.27 2.80 0.17 6.28 2.12 -1.26 -1.32 118.70 124.21 2c3p s GLU 184 Ca 0.32 -0.85 0.10 0.00 0.36 0.00 0.00 54.97 54.90 2c3p s GLU 184 Cb 0.02 -2.28 -0.04 0.00 0.26 0.00 0.00 34.13 32.08 2c3p s GLU 184 CO 0.23 0.32 -0.23 0.14 -0.54 0.00 0.00 175.26 175.18 2c3p s VAL 185 N -0.00 2.15 0.31 3.70 -7.23 -0.06 -4.95 120.40 114.32 2c3p s VAL 185 Ca -0.08 -1.91 -0.05 0.00 -1.81 0.00 0.00 61.98 58.14 2c3p s VAL 185 Cb -0.15 -1.98 -0.05 0.00 0.56 0.00 0.00 36.38 34.76 2c3p s VAL 185 CO 0.05 -0.12 0.58 -0.76 -0.31 0.00 0.00 175.10 174.54 2c3p s LEU 186 N -2.49 4.02 0.67 1.32 1.43 -1.26 -2.32 118.68 120.04 2c3p s LEU 186 Ca 0.17 0.72 -0.14 0.00 -1.03 0.00 0.00 54.13 53.85 2c3p s LEU 186 Cb -0.08 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.59 2c3p s LEU 186 CO 0.08 -0.24 1.08 -1.81 0.23 0.00 0.00 176.35 175.69 2c3p s ASP 187 N -3.31 5.23 0.39 2.29 1.01 -0.56 -4.95 116.67 116.78 2c3p s ASP 187 Ca 0.44 1.85 0.13 0.00 0.71 0.00 0.00 52.55 55.67 2c3p s ASP 187 Cb -0.11 -2.53 0.81 0.00 1.01 0.00 0.00 42.92 42.10 2c3p s ASP 187 CO 0.31 -1.54 1.89 1.88 0.21 0.00 0.00 175.17 177.92 2c3p h TYR 188 N -0.20 0.04 -0.14 4.23 -1.99 -1.98 -2.51 116.97 114.42 2c3p h TYR 188 Ca -0.46 -0.01 -0.08 0.00 2.00 0.00 0.00 58.73 60.18 2c3p h TYR 188 Cb 1.23 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.94 2c3p h TYR 188 CO 0.58 0.32 -0.28 0.00 -0.00 0.00 0.00 178.16 178.77 2c3p h ALA 189 N 1.68 1.27 -0.39 3.88 0.00 -1.97 0.24 119.26 123.97 2c3p h ALA 189 Ca 0.00 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 2c3p h ALA 189 Cb 0.52 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2c3p h ALA 189 CO 0.04 0.49 -0.37 -0.44 0.00 0.00 0.00 179.25 178.97 2c3p h ASP 190 N 0.23 0.99 -0.26 0.00 5.19 -1.81 -1.61 116.42 119.14 2c3p h ASP 190 Ca 0.03 -0.45 -0.03 0.00 -0.62 0.00 0.00 57.03 55.97 2c3p h ASP 190 Cb 0.62 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.85 2c3p h ASP 190 CO 0.05 1.24 0.04 0.24 -3.12 0.00 0.00 179.24 177.69 2c3p h MET 191 N 0.76 0.43 -0.94 3.56 2.86 -1.27 -2.70 114.93 117.64 2c3p h MET 191 Ca 0.07 -0.12 0.09 0.00 -2.06 0.00 0.00 59.70 57.68 2c3p h MET 191 Cb 0.96 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 32.50 2c3p h MET 191 CO 0.09 0.56 0.60 0.00 1.06 0.00 0.00 176.91 179.22 2c3p h ALA 192 N 0.86 1.56 0.00 6.32 0.00 -0.84 -1.88 119.26 125.28 2c3p h ALA 192 Ca 0.08 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2c3p h ALA 192 Cb 0.34 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2c3p h ALA 192 CO 0.01 0.25 -0.18 0.66 0.00 0.00 0.00 179.25 179.99 2c3p h SER 193 N 0.97 0.00 1.37 0.00 4.64 -0.96 -2.53 113.55 117.04 2c3p h SER 193 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2c3p h SER 193 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2c3p h SER 193 CO -0.19 0.18 -0.12 0.18 -0.87 0.00 0.00 176.83 176.00 2c3p n LEU 194 N -3.70 0.82 -4.72 5.97 4.32 -0.71 -4.88 117.00 114.11 2c3p n LEU 194 Ca -0.02 0.51 -0.42 0.00 -0.02 0.00 0.00 56.01 56.07 2c3p n LEU 194 Cb 0.30 -0.28 -0.03 0.00 -1.62 0.00 0.00 43.42 41.78 2c3p n LEU 194 CO 0.32 -0.16 1.26 -0.69 -1.22 0.00 0.00 177.39 176.90 2c3p s VAL 195 N -3.12 2.49 -0.48 4.08 1.01 -0.96 -4.92 120.40 118.51 2c3p s VAL 195 Ca 0.10 0.35 -0.28 0.00 0.00 0.00 0.00 61.98 62.15 2c3p s VAL 195 Cb 0.12 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2c3p s VAL 195 CO 0.62 0.03 1.53 0.21 0.00 0.00 0.00 175.10 177.49 2c3p s ASN 196 N 1.13 6.06 0.25 3.32 3.84 -1.26 -4.87 114.94 123.41 2c3p s ASN 196 Ca 0.71 0.62 -0.02 0.00 0.21 0.00 0.00 52.86 54.38 2c3p s ASN 196 Cb -0.45 -2.54 0.30 0.00 -0.55 0.00 0.00 41.25 38.01 2c3p s ASN 196 CO 0.32 -1.70 1.71 1.56 -2.79 0.00 0.00 177.10 176.20 2c3p h GLN 197 N 11.68 0.74 -0.53 0.43 1.08 -1.96 -2.00 115.11 124.55 2c3p h GLN 197 Ca -0.28 -0.24 -0.02 0.00 -1.45 0.00 0.00 58.65 56.66 2c3p h GLN 197 Cb 1.12 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.46 2c3p h GLN 197 CO 1.13 0.82 0.26 -0.22 -0.95 0.00 0.00 178.83 179.87 2c3p h LYS 198 N 0.67 0.76 -0.38 1.46 3.64 -2.00 -1.22 116.57 119.51 2c3p h LYS 198 Ca 0.12 -0.11 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 2c3p h LYS 198 Cb 0.57 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 2c3p h LYS 198 CO 0.04 0.63 0.06 0.00 -2.27 0.00 0.00 179.45 177.91 2c3p h ALA 199 N 1.10 0.51 -0.64 5.00 0.00 -1.87 -1.76 119.26 121.60 2c3p h ALA 199 Ca 0.18 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.94 2c3p h ALA 199 Cb 0.11 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 2c3p h ALA 199 CO -0.02 0.22 0.35 1.25 0.00 0.00 0.00 179.25 181.04 2c3p h LEU 200 N 0.48 0.51 -0.92 0.00 5.85 -1.11 -0.43 115.31 119.68 2c3p h LEU 200 Ca 0.12 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 2c3p h LEU 200 Cb 0.36 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2c3p h LEU 200 CO 0.01 0.33 -0.04 0.00 -0.34 0.00 0.00 178.44 178.39 2c3p h ALA 201 N 1.34 1.10 -0.51 1.25 0.00 -1.03 -1.77 119.26 119.65 2c3p h ALA 201 Ca 0.29 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2c3p h ALA 201 Cb 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2c3p h ALA 201 CO -0.19 0.56 -0.02 0.93 0.00 0.00 0.00 179.25 180.54 2c3p h GLU 202 N 0.69 0.88 0.13 0.00 5.08 -0.46 -1.21 114.58 119.68 2c3p h GLU 202 Ca 0.13 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 2c3p h GLU 202 Cb 0.49 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2c3p h GLU 202 CO 0.03 0.89 -0.06 0.35 -1.00 0.00 0.00 179.01 179.21 2c3p h PHE 203 N 0.81 -0.16 -0.38 4.33 3.57 -0.65 -1.30 116.94 123.16 2c3p h PHE 203 Ca 0.15 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.72 2c3p h PHE 203 Cb 0.51 0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.24 2c3p h PHE 203 CO 0.03 -0.02 -0.01 0.00 -2.23 0.00 0.00 178.31 176.08 2c3p h ARG 204 N -0.26 0.09 0.00 1.11 -0.00 -1.18 -2.80 114.38 111.33 2c3p h ARG 204 Ca -0.02 -0.01 -0.07 0.00 -0.50 0.00 0.00 59.98 59.39 2c3p h ARG 204 Cb 0.21 -0.02 -0.01 0.00 0.00 0.00 0.00 29.97 30.15 2c3p h ARG 204 CO 0.03 0.06 -0.33 0.00 0.00 0.00 0.00 179.97 179.73 2c3p h ALA 205 N 1.34 1.28 -0.00 0.04 0.00 -0.99 -2.93 119.26 117.99 2c3p h ALA 205 Ca 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2c3p h ALA 205 Cb 0.26 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2c3p h ALA 205 CO -0.32 0.41 -0.34 0.36 0.00 0.00 0.00 179.25 179.36 2c3p n LYS 206 N -3.89 0.52 -1.26 0.00 2.85 -0.51 -4.96 118.16 110.91 2c3p n LYS 206 Ca -0.02 -0.30 -0.30 0.00 -1.05 0.00 0.00 58.31 56.64 2c3p n LYS 206 Cb 0.40 -1.49 0.13 0.00 -0.65 0.00 0.00 35.03 33.42 2c3p n LYS 206 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2c3p s SER 207 N -2.68 3.63 0.34 -5.58 0.01 -1.09 -4.96 113.70 103.36 2c3p s SER 207 Ca 0.20 1.45 -0.29 0.00 1.31 0.00 0.00 55.95 58.62 2c3p s SER 207 Cb 0.19 -2.14 -0.11 0.00 0.21 0.00 0.00 66.02 64.17 2c3p s SER 207 CO 0.58 -2.53 1.50 -0.04 0.41 0.00 0.00 173.24 173.16 2c3p s MET 208 N -4.97 4.14 -0.30 12.44 -1.94 0.38 -4.95 119.30 124.11 2c3p s MET 208 Ca 0.63 2.53 -0.16 0.00 -1.71 0.00 0.00 55.69 56.97 2c3p s MET 208 Cb -0.17 -3.00 0.19 0.00 2.01 0.00 0.00 34.83 33.85 2c3p s MET 208 CO 0.56 -0.52 1.16 1.21 -0.01 0.00 0.00 175.02 177.42 2c3p s ASN 209 N 0.03 -0.23 0.00 3.03 3.84 -1.26 -4.76 114.94 115.59 2c3p s ASN 209 Ca 0.56 0.35 0.08 0.00 0.21 0.00 0.00 52.86 54.06 2c3p s ASN 209 Cb -0.46 1.12 0.34 0.00 -0.55 0.00 0.00 41.25 41.70 2c3p s ASN 209 CO 0.57 -0.05 1.24 -0.81 -2.79 0.00 0.00 177.10 175.25 2c3p n PRO 210 N 3.49 0.01 0.09 0.43 -0.04 -1.26 -1.12 135.00 136.61 2c3p n PRO 210 Ca -0.16 0.35 -0.03 0.00 -0.04 0.00 0.00 63.50 63.61 2c3p n PRO 210 Cb 0.56 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.48 2c3p n PRO 210 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2c3p h GLU 211 N 0.00 0.00 -1.02 0.54 4.57 -1.99 -3.37 114.58 113.31 2c3p h GLU 211 Ca 0.00 0.00 -0.39 0.00 -1.18 0.00 0.00 59.36 57.79 2c3p h GLU 211 Cb 0.13 0.00 -0.27 0.00 -0.16 0.00 0.00 28.75 28.45 2c3p h GLU 211 CO 0.00 0.81 -0.81 -2.39 -1.18 0.00 0.00 179.01 175.44 2c3p n HIS 212 N -3.34 -1.77 -1.62 0.92 1.44 -0.76 -5.15 115.22 104.95 2c3p n HIS 212 Ca 0.01 -2.71 -0.32 0.00 -2.01 0.00 0.00 57.72 52.69 2c3p n HIS 212 Cb 0.85 0.59 0.05 0.00 0.12 0.00 0.00 29.99 31.60 2c3p n HIS 212 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 2c3p s PRO 213 N -0.37 2.84 0.24 -1.40 0.04 -0.27 -4.54 135.00 131.54 2c3p s PRO 213 Ca 0.33 1.10 -0.06 0.00 0.04 0.00 0.00 61.00 62.42 2c3p s PRO 213 Cb 0.22 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.76 2c3p s PRO 213 CO -0.16 -1.18 0.31 -3.38 0.04 0.00 0.00 177.00 172.63 2c3p s HIS 214 N -2.81 0.84 -0.16 0.56 -3.43 -1.26 -5.04 115.29 103.99 2c3p s HIS 214 Ca 0.61 -1.11 -0.03 0.00 -0.80 0.00 0.00 55.06 53.72 2c3p s HIS 214 Cb -0.16 -0.21 -0.02 0.00 -1.43 0.00 0.00 32.58 30.76 2c3p s HIS 214 CO 0.50 -0.84 -0.05 0.08 -2.00 0.00 0.00 174.74 172.43 2c3p s VAL 215 N -3.98 3.67 0.14 -5.38 1.01 -1.26 -5.00 120.40 109.60 2c3p s VAL 215 Ca 0.31 -0.43 0.10 0.00 0.00 0.00 0.00 61.98 61.96 2c3p s VAL 215 Cb 0.03 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 2c3p s VAL 215 CO 0.12 0.49 -0.23 0.00 0.00 0.00 0.00 175.10 175.48 2c3p s ARG 216 N 0.53 1.32 -0.19 2.72 1.70 -1.26 -4.83 118.95 118.96 2c3p s ARG 216 Ca -0.04 -1.34 -0.00 0.00 -0.47 0.00 0.00 55.73 53.87 2c3p s ARG 216 Cb -0.15 -1.64 -0.00 0.00 -0.57 0.00 0.00 34.95 32.59 2c3p s ARG 216 CO 0.03 0.37 0.16 0.41 -1.08 0.00 0.00 175.30 175.19 2c3p n GLY 217 N 0.71 0.33 3.90 3.88 0.00 -1.26 -5.05 105.19 107.70 2c3p n GLY 217 Ca -0.16 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 2c3p n GLY 217 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c3p s THR 218 N -3.06 3.11 -0.21 2.61 -4.23 -1.26 -5.05 115.64 107.55 2c3p s THR 218 Ca 0.00 0.24 -0.08 0.00 -1.18 0.00 0.00 61.69 60.67 2c3p s THR 218 Cb -0.00 -3.34 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 2c3p s THR 218 CO 0.11 -0.42 0.09 0.00 -0.54 0.00 0.00 174.62 173.87 2c3p s ALA 219 N -3.34 3.42 0.07 3.99 0.00 -1.26 -5.10 121.76 119.54 2c3p s ALA 219 Ca 0.58 -0.87 0.09 0.00 0.00 0.00 0.00 51.96 51.77 2c3p s ALA 219 Cb -0.11 -2.08 -0.03 0.00 0.00 0.00 0.00 23.12 20.90 2c3p s ALA 219 CO 0.50 -0.07 -0.25 -0.65 0.00 0.00 0.00 175.76 175.28 2c3p s GLN 220 N 0.84 1.72 0.76 0.00 -0.21 -1.26 -5.13 119.66 116.38 2c3p s GLN 220 Ca 0.05 -1.16 -0.04 0.00 0.02 0.00 0.00 55.36 54.22 2c3p s GLN 220 Cb -0.13 -1.99 0.13 0.00 1.00 0.00 0.00 33.01 32.02 2c3p s GLN 220 CO 0.02 0.50 1.05 -0.80 -2.12 0.00 0.00 175.29 173.94 2c3p s ASN 221 N -1.51 4.21 0.58 5.90 0.01 -1.26 -4.80 114.94 118.06 2c3p s ASN 221 Ca 0.13 -0.13 0.28 0.00 -0.71 0.00 0.00 52.86 52.43 2c3p s ASN 221 Cb -0.10 -0.25 1.58 0.00 0.41 0.00 0.00 41.25 42.89 2c3p s ASN 221 CO 0.04 -1.96 2.06 -0.65 -1.51 0.00 0.00 177.10 175.08 2c3p h PRO 222 N -0.72 0.00 -0.36 -0.60 0.11 -2.01 -2.35 132.00 126.08 2c3p h PRO 222 Ca -0.39 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.70 2c3p h PRO 222 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2c3p h PRO 222 CO 0.43 0.00 0.14 0.38 -0.21 0.00 0.00 178.00 178.73 2c3p h ASP 223 N 0.00 0.45 0.00 -2.05 3.04 -2.05 -3.37 116.42 112.44 2c3p h ASP 223 Ca 0.12 -0.04 0.00 0.00 -3.24 0.00 0.00 57.03 53.87 2c3p h ASP 223 Cb 0.62 -0.11 0.00 0.00 -1.04 0.00 0.00 39.33 38.79 2c3p h ASP 223 CO -0.00 0.42 -0.06 2.30 -2.04 0.00 0.00 179.24 179.86 2c3p n ILE 224 N -4.39 0.00 -0.02 4.15 -5.35 -1.03 -4.87 119.36 107.84 2c3p n ILE 224 Ca 0.02 -0.24 -0.09 0.00 -0.27 0.00 0.00 62.75 62.17 2c3p n ILE 224 Cb 0.14 0.92 -0.02 0.00 -1.74 0.00 0.00 39.64 38.94 2c3p n ILE 224 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 2c3p h TYR 225 N 0.00 -0.51 -0.53 4.28 3.20 -1.59 -1.59 116.97 120.23 2c3p h TYR 225 Ca 0.00 0.03 0.10 0.00 3.14 0.00 0.00 58.73 62.00 2c3p h TYR 225 Cb 0.00 0.25 -0.08 0.00 1.54 0.00 0.00 36.73 38.44 2c3p h TYR 225 CO 0.00 -0.27 0.04 0.35 -1.64 0.00 0.00 178.16 176.64 2c3p h PHE 226 N -0.22 0.04 -0.42 -3.82 -0.00 -1.86 -0.37 116.94 110.29 2c3p h PHE 226 Ca 0.12 0.04 0.00 0.00 -0.00 0.00 0.00 57.97 58.13 2c3p h PHE 226 Cb 0.40 0.06 -0.02 0.00 -0.00 0.00 0.00 35.95 36.39 2c3p h PHE 226 CO -0.33 -0.09 0.27 1.96 -0.00 0.00 0.00 178.31 180.12 2c3p h GLN 227 N 0.16 0.56 -0.41 1.11 7.50 -1.79 -2.27 115.11 119.97 2c3p h GLN 227 Ca 0.27 -0.04 0.01 0.00 0.50 0.00 0.00 58.65 59.39 2c3p h GLN 227 Cb 0.41 -0.12 -0.02 0.00 0.05 0.00 0.00 27.48 27.80 2c3p h GLN 227 CO -0.42 0.39 0.27 0.78 -1.50 0.00 0.00 178.83 178.35 2c3p h GLY 228 N 0.56 0.57 1.76 3.46 0.00 -0.27 -1.85 103.07 107.31 2c3p h GLY 228 Ca 0.15 -0.21 -0.14 0.00 0.00 0.00 0.00 47.33 47.13 2c3p h GLY 228 CO -0.03 0.20 -0.59 -0.09 0.00 0.00 0.00 176.54 176.03 2c3p h ARG 229 N 0.54 0.25 0.00 4.80 9.65 -0.60 -3.20 114.38 125.82 2c3p h ARG 229 Ca 0.15 -0.17 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2c3p h ARG 229 Cb -0.05 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.55 2c3p h ARG 229 CO -0.03 0.77 -0.36 0.39 2.80 0.00 0.00 179.97 183.54 2c3p n GLU 230 N -3.88 0.14 0.18 0.20 -0.58 -0.80 -4.12 120.64 111.79 2c3p n GLU 230 Ca -0.02 0.07 0.13 0.00 -0.42 0.00 0.00 57.16 56.91 2c3p n GLU 230 Cb 0.61 -1.61 0.63 0.00 -0.57 0.00 0.00 31.44 30.50 2c3p n GLU 230 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2c3p h ALA 231 N 2.75 1.00 -0.00 0.62 0.00 -1.36 -1.84 119.26 120.43 2c3p h ALA 231 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c3p h ALA 231 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2c3p h ALA 231 CO 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 179.25 178.90 2c3p n ALA 232 N -1.84 3.25 -0.36 0.00 0.00 -1.26 -4.45 120.51 115.85 2c3p n ALA 232 Ca -0.00 -0.35 0.03 0.00 0.00 0.00 0.00 53.44 53.11 2c3p n ALA 232 Cb 0.13 -1.16 0.09 0.00 0.00 0.00 0.00 19.45 18.52 2c3p n ALA 232 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2c3p n ASN 233 N -1.14 -0.48 -0.35 0.00 3.02 -0.69 -0.11 115.26 115.50 2c3p n ASN 233 Ca 0.09 1.69 0.12 0.00 -0.03 0.00 0.00 54.58 56.45 2c3p n ASN 233 Cb 0.34 -0.45 0.31 0.00 -0.61 0.00 0.00 39.78 39.36 2c3p n ASN 233 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2c3p h PRO 234 N 0.00 0.76 -0.66 3.52 0.11 -1.83 -1.28 132.00 132.61 2c3p h PRO 234 Ca 0.41 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.41 2c3p h PRO 234 Cb 0.65 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.57 2c3p h PRO 234 CO -0.99 0.50 0.18 1.88 -0.21 0.00 0.00 178.00 179.36 2c3p h TYR 235 N 0.78 1.09 0.00 0.65 0.05 -0.83 -2.57 116.97 116.13 2c3p h TYR 235 Ca 0.57 -0.12 -0.06 0.00 0.05 0.00 0.00 58.73 59.17 2c3p h TYR 235 Cb 0.87 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 38.29 2c3p h TYR 235 CO -0.01 0.90 -0.27 1.88 -1.05 0.00 0.00 178.16 179.61 2c3p h TYR 236 N 0.97 0.00 -0.07 4.88 -1.99 -1.13 -2.72 116.97 116.92 2c3p h TYR 236 Ca 0.21 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.81 2c3p h TYR 236 Cb 0.34 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 2c3p h TYR 236 CO 0.03 0.27 -0.55 -0.07 -0.00 0.00 0.00 178.16 177.84 2c3p h LEU 237 N 0.00 0.22 0.00 3.88 3.38 -0.92 -3.26 115.31 118.60 2c3p h LEU 237 Ca -0.00 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 2c3p h LEU 237 Cb 0.90 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 2c3p h LEU 237 CO 0.04 0.72 -0.63 0.11 0.09 0.00 0.00 178.44 178.76 2c3p h LYS 238 N 0.15 0.00 -0.74 1.13 1.57 -1.33 -3.38 116.57 113.97 2c3p h LYS 238 Ca 0.00 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.86 2c3p h LYS 238 Cb 1.01 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.25 2c3p h LYS 238 CO 0.08 0.08 0.41 -0.39 -0.57 0.00 0.00 179.45 179.07 2c3p h VAL 239 N 0.00 0.92 -0.33 0.50 -1.51 -1.53 -2.16 116.25 112.15 2c3p h VAL 239 Ca -0.02 -0.25 0.06 0.00 -1.23 0.00 0.00 66.70 65.27 2c3p h VAL 239 Cb 1.10 0.14 -0.06 0.00 -2.13 0.00 0.00 31.29 30.35 2c3p h VAL 239 CO 0.01 0.13 -0.03 -0.65 -1.23 0.00 0.00 177.57 175.80 2c3p h PRO 240 N 0.72 0.05 -0.26 5.19 0.11 -1.77 0.10 132.00 136.14 2c3p h PRO 240 Ca 0.35 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.41 2c3p h PRO 240 Cb 0.29 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.37 2c3p h PRO 240 CO -0.22 0.03 -0.03 0.78 -0.21 0.00 0.00 178.00 178.35 2c3p h GLY 241 N 0.05 0.43 1.35 -0.55 0.00 -1.74 -0.90 103.07 101.70 2c3p h GLY 241 Ca 0.16 -0.24 -0.14 0.00 0.00 0.00 0.00 47.33 47.10 2c3p h GLY 241 CO -0.30 0.23 -0.38 -2.22 0.00 0.00 0.00 176.54 173.88 2c3p h ILE 242 N 0.38 1.29 -0.41 2.60 2.04 -0.60 -0.57 117.51 122.24 2c3p h ILE 242 Ca 0.08 -1.54 -0.07 0.00 1.00 0.00 0.00 64.86 64.33 2c3p h ILE 242 Cb 0.31 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 2c3p h ILE 242 CO 0.01 0.50 -0.02 0.58 0.00 0.00 0.00 178.15 179.22 2c3p h VAL 243 N 0.59 1.26 -0.26 1.67 2.07 -0.32 -1.47 116.25 119.79 2c3p h VAL 243 Ca 0.05 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 2c3p h VAL 243 Cb 0.91 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 2c3p h VAL 243 CO 0.08 0.36 0.16 0.00 0.02 0.00 0.00 177.57 178.19 2c3p h ALA 244 N 0.88 0.33 -0.88 1.67 0.00 -1.01 0.07 119.26 120.32 2c3p h ALA 244 Ca 0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2c3p h ALA 244 Cb 0.51 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2c3p h ALA 244 CO 0.03 -0.17 0.53 1.05 0.00 0.00 0.00 179.25 180.69 2c3p h GLU 245 N 0.33 1.19 0.00 0.00 4.11 -0.96 -1.01 114.58 118.24 2c3p h GLU 245 Ca 0.09 -0.11 -0.13 0.00 0.07 0.00 0.00 59.36 59.29 2c3p h GLU 245 Cb 0.01 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 2c3p h GLU 245 CO -0.02 0.83 -0.60 1.88 0.07 0.00 0.00 179.01 181.17 2c3p h TYR 246 N 1.20 0.00 -0.74 2.06 -1.99 -0.95 0.33 116.97 116.89 2c3p h TYR 246 Ca 0.31 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 61.00 2c3p h TYR 246 Cb -0.05 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.64 2c3p h TYR 246 CO -0.00 0.60 0.31 0.52 -0.00 0.00 0.00 178.16 179.59 2c3p h MET 247 N 0.00 1.10 -0.23 4.88 2.86 -0.40 0.13 114.93 123.27 2c3p h MET 247 Ca -0.01 -0.19 -0.20 0.00 -2.06 0.00 0.00 59.70 57.24 2c3p h MET 247 Cb 1.10 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.58 2c3p h MET 247 CO 0.08 0.89 -0.63 1.96 1.06 0.00 0.00 176.91 180.27 2c3p h GLN 248 N 1.06 0.83 -0.54 1.72 4.20 -0.63 -0.54 115.11 121.20 2c3p h GLN 248 Ca 0.25 -0.58 -0.08 0.00 0.06 0.00 0.00 58.65 58.30 2c3p h GLN 248 Cb 0.19 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 2c3p h GLN 248 CO -0.02 1.20 0.03 0.87 -0.67 0.00 0.00 178.83 180.24 2c3p h LYS 249 N 0.61 0.93 -0.45 1.46 1.57 -0.17 -1.57 116.57 118.95 2c3p h LYS 249 Ca -0.01 -0.28 -0.13 0.00 -1.87 0.00 0.00 60.65 58.35 2c3p h LYS 249 Cb 1.25 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2c3p h LYS 249 CO 0.14 0.93 -0.24 0.28 -0.57 0.00 0.00 179.45 179.99 2c3p h VAL 250 N 0.81 1.27 -0.85 0.50 2.07 -0.99 -3.04 116.25 116.03 2c3p h VAL 250 Ca 0.16 -1.40 0.01 0.00 0.82 0.00 0.00 66.70 66.28 2c3p h VAL 250 Cb 0.49 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2c3p h VAL 250 CO 0.02 0.48 0.56 0.00 0.02 0.00 0.00 177.57 178.65 2c3p h ALA 251 N 0.91 1.38 0.00 1.67 0.00 -0.79 -0.17 119.26 122.26 2c3p h ALA 251 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2c3p h ALA 251 Cb 0.81 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2c3p h ALA 251 CO 0.07 0.57 0.00 0.66 0.00 0.00 0.00 179.25 180.55 2c3p h SER 252 N 1.16 0.00 0.09 0.00 4.64 -1.17 1.36 113.55 119.62 2c3p h SER 252 Ca 0.31 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.37 2c3p h SER 252 Cb -0.12 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 61.92 2c3p h SER 252 CO -0.07 0.00 -2.17 0.18 -0.87 0.00 0.00 176.83 173.90 2c3p n LEU 253 N -2.42 0.12 -0.02 5.97 4.77 -0.22 -4.64 117.00 120.56 2c3p n LEU 253 Ca 0.00 0.06 0.01 0.00 -0.03 0.00 0.00 56.01 56.05 2c3p n LEU 253 Cb 0.15 0.32 -0.08 0.00 -2.33 0.00 0.00 43.42 41.48 2c3p n LEU 253 CO 0.17 0.34 -0.71 0.35 -1.33 0.00 0.00 177.39 176.21 2c3p n THR 254 N -2.66 0.28 -0.58 -5.08 -2.24 -0.35 -4.93 114.28 98.72 2c3p n THR 254 Ca -0.23 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 2c3p n THR 254 Cb 0.98 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 2c3p n THR 254 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3p n GLY 255 N 2.11 0.87 3.33 3.38 0.00 0.46 -5.02 105.19 110.31 2c3p n GLY 255 Ca -0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 2c3p n GLY 255 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c3p s ARG 256 N -0.39 2.72 0.21 1.61 0.52 -1.25 -5.03 118.95 117.34 2c3p s ARG 256 Ca 0.00 -1.20 -0.13 0.00 -0.52 0.00 0.00 55.73 53.88 2c3p s ARG 256 Cb 0.00 -3.68 -0.07 0.00 0.52 0.00 0.00 34.95 31.72 2c3p s ARG 256 CO 0.00 -0.75 0.59 -1.12 0.02 0.00 0.00 175.30 174.04 2c3p s SER 257 N 1.65 6.78 0.04 0.23 0.01 -1.26 -4.24 113.70 116.90 2c3p s SER 257 Ca 0.01 1.09 -0.03 0.00 1.31 0.00 0.00 55.95 58.33 2c3p s SER 257 Cb -0.20 -2.29 -0.02 0.00 0.21 0.00 0.00 66.02 63.71 2c3p s SER 257 CO 0.05 -0.01 0.03 -0.31 0.41 0.00 0.00 173.24 173.41 2c3p s TYR 258 N -1.66 0.32 0.26 2.43 1.51 -1.26 -5.12 117.35 113.82 2c3p s TYR 258 Ca 0.44 -0.70 0.05 0.00 -1.01 0.00 0.00 57.07 55.84 2c3p s TYR 258 Cb -0.13 -0.23 -0.05 0.00 -0.11 0.00 0.00 41.96 41.43 2c3p s TYR 258 CO 0.20 -0.35 -0.02 0.15 -1.11 0.00 0.00 175.55 174.42 2c3p s LYS 259 N -2.89 1.44 0.36 -0.62 1.02 -1.26 -4.72 119.74 113.08 2c3p s LYS 259 Ca -0.03 -1.74 0.08 0.00 0.02 0.00 0.00 55.97 54.31 2c3p s LYS 259 Cb 0.00 -0.85 0.79 0.00 -0.52 0.00 0.00 37.83 37.26 2c3p s LYS 259 CO -0.06 -0.05 1.91 -0.07 -0.92 0.00 0.00 175.35 176.16 2c3p h LEU 260 N 2.37 0.64 -7.62 3.17 3.38 -1.94 -3.39 115.31 111.93 2c3p h LEU 260 Ca -0.39 0.02 -0.42 0.00 0.09 0.00 0.00 57.88 57.18 2c3p h LEU 260 Cb 1.23 -0.11 -0.36 0.00 0.09 0.00 0.00 40.66 41.51 2c3p h LEU 260 CO 0.66 0.37 -0.77 -0.36 0.09 0.00 0.00 178.44 178.43 2c3p s PHE 261 N -5.66 0.68 -0.00 1.13 0.08 -1.26 -0.75 117.98 112.20 2c3p s PHE 261 Ca -0.10 -0.18 0.05 0.00 0.12 0.00 0.00 56.93 56.82 2c3p s PHE 261 Cb 0.21 -0.70 -0.03 0.00 -0.57 0.00 0.00 43.02 41.92 2c3p s PHE 261 CO 0.78 -0.25 -0.15 -0.51 -0.10 0.00 0.00 175.22 174.99 2c3p s ASP 262 N 1.37 3.99 -0.08 1.36 -0.00 -0.41 -4.76 116.67 118.15 2c3p s ASP 262 Ca -0.04 -0.30 0.01 0.00 -0.00 0.00 0.00 52.55 52.22 2c3p s ASP 262 Cb -0.13 -0.77 -0.03 0.00 -0.00 0.00 0.00 42.92 41.99 2c3p s ASP 262 CO -0.02 0.30 -0.09 -0.47 -0.00 0.00 0.00 175.17 174.88 2c3p s TYR 263 N -0.86 2.88 0.05 4.23 6.14 -1.26 0.62 117.35 129.16 2c3p s TYR 263 Ca 0.14 -0.14 0.03 0.00 0.64 0.00 0.00 57.07 57.73 2c3p s TYR 263 Cb -0.11 -1.74 -0.03 0.00 0.42 0.00 0.00 41.96 40.51 2c3p s TYR 263 CO 0.04 0.19 -0.09 0.14 0.64 0.00 0.00 175.55 176.46 2c3p s VAL 264 N -0.50 0.68 0.00 3.14 -7.23 -0.43 -5.00 120.40 111.06 2c3p s VAL 264 Ca 0.07 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 2c3p s VAL 264 Cb -0.12 -0.81 0.00 0.00 0.56 0.00 0.00 36.38 36.01 2c3p s VAL 264 CO 0.02 -0.40 0.00 0.61 -0.31 0.00 0.00 175.10 175.02 2c3p n GLY 265 N 1.27 -0.53 3.68 2.32 0.00 -1.26 -0.85 105.19 109.82 2c3p n GLY 265 Ca -0.21 -2.22 -0.45 0.00 0.00 0.00 0.00 46.02 43.14 2c3p n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p n ALA 266 N -0.60 1.68 0.30 4.61 0.00 -0.66 -4.84 120.51 120.99 2c3p n ALA 266 Ca 0.00 0.36 0.18 0.00 0.00 0.00 0.00 53.44 53.98 2c3p n ALA 266 Cb 0.00 -2.48 0.88 0.00 0.00 0.00 0.00 19.45 17.85 2c3p n ALA 266 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2c3p h PRO 267 N 7.56 0.00 -0.38 0.00 0.11 -1.95 -1.70 132.00 135.65 2c3p h PRO 267 Ca -0.46 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.40 2c3p h PRO 267 Cb 1.24 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.18 2c3p h PRO 267 CO 0.93 0.00 -0.39 -0.40 -0.21 0.00 0.00 178.00 177.93 2c3p n ASP 268 N -2.85 3.17 -4.76 -2.05 5.75 -1.26 -4.78 116.55 109.77 2c3p n ASP 268 Ca -0.01 -3.83 -0.39 0.00 -0.01 0.00 0.00 54.79 50.55 2c3p n ASP 268 Cb 0.15 -0.53 0.01 0.00 -1.03 0.00 0.00 41.12 39.72 2c3p n ASP 268 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2c3p s ALA 269 N -3.38 3.18 -0.10 2.12 0.00 -0.64 -4.89 121.76 118.05 2c3p s ALA 269 Ca 0.45 1.35 0.15 0.00 0.00 0.00 0.00 51.96 53.91 2c3p s ALA 269 Cb 0.40 -3.54 -0.22 0.00 0.00 0.00 0.00 23.12 19.76 2c3p s ALA 269 CO -0.02 -1.07 0.19 0.39 0.00 0.00 0.00 175.76 175.25 2c3p n GLU 270 N -0.21 1.04 -4.11 0.00 1.02 0.20 -2.51 120.64 116.07 2c3p n GLU 270 Ca 0.05 -0.07 -0.33 0.00 -0.02 0.00 0.00 57.16 56.79 2c3p n GLU 270 Cb 0.43 -1.40 -0.16 0.00 -0.02 0.00 0.00 31.44 30.29 2c3p n GLU 270 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2c3p s ARG 271 N -2.72 2.91 -0.02 3.49 0.52 -1.13 -0.00 118.95 121.99 2c3p s ARG 271 Ca -0.07 -0.89 0.05 0.00 -0.52 0.00 0.00 55.73 54.30 2c3p s ARG 271 Cb 0.07 -2.61 -0.01 0.00 0.52 0.00 0.00 34.95 32.92 2c3p s ARG 271 CO 0.66 -0.25 -0.17 0.08 0.02 0.00 0.00 175.30 175.64 2c3p s VAL 272 N 1.27 1.36 -0.09 3.52 1.01 -0.20 -1.88 120.40 125.39 2c3p s VAL 272 Ca 0.03 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 2c3p s VAL 272 Cb -0.14 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2c3p s VAL 272 CO -0.12 0.39 0.05 -0.63 0.00 0.00 0.00 175.10 174.79 2c3p s ILE 273 N -0.30 4.73 -0.20 2.22 1.01 -0.47 -0.40 121.20 127.79 2c3p s ILE 273 Ca 0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.57 2c3p s ILE 273 Cb -0.08 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.37 2c3p s ILE 273 CO -0.00 0.60 -0.11 -0.69 0.00 0.00 0.00 174.94 174.74 2c3p s VAL 274 N -0.95 2.86 0.28 2.92 1.01 0.68 -0.03 120.40 127.16 2c3p s VAL 274 Ca 0.14 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 2c3p s VAL 274 Cb -0.12 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 2c3p s VAL 274 CO 0.03 0.47 0.33 -0.55 0.00 0.00 0.00 175.10 175.39 2c3p s SER 275 N 1.32 0.62 -0.06 3.32 0.15 -0.84 -0.62 113.70 117.57 2c3p s SER 275 Ca 0.04 -1.40 -0.09 0.00 0.70 0.00 0.00 55.95 55.21 2c3p s SER 275 Cb -0.14 0.54 0.02 0.00 -1.71 0.00 0.00 66.02 64.73 2c3p s SER 275 CO -0.06 -1.07 0.23 -0.32 1.20 0.00 0.00 173.24 173.21 2c3p s MET 276 N -3.68 0.36 0.41 5.44 1.75 -1.26 -1.42 119.30 120.90 2c3p s MET 276 Ca 0.34 0.14 0.00 0.00 -1.25 0.00 0.00 55.69 54.92 2c3p s MET 276 Cb 0.02 0.16 0.00 0.00 2.84 0.00 0.00 34.83 37.86 2c3p s MET 276 CO 0.17 -0.06 0.00 0.41 -0.65 0.00 0.00 175.02 174.88 2c3p n GLY 277 N 2.50 -2.11 0.36 2.11 0.00 -1.26 -4.38 105.19 102.41 2c3p n GLY 277 Ca -0.15 -1.77 0.17 0.00 0.00 0.00 0.00 46.02 44.27 2c3p n GLY 277 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2c3p h SER 278 N 0.00 0.00 -0.40 1.61 4.64 -1.78 -0.45 113.55 117.17 2c3p h SER 278 Ca 0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2c3p h SER 278 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2c3p h SER 278 CO 0.00 0.00 0.27 0.77 -0.87 0.00 0.00 176.83 177.00 2c3p h SER 279 N 0.00 0.33 -0.86 4.97 4.64 -1.86 -2.42 113.55 118.34 2c3p h SER 279 Ca 0.10 -0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.55 2c3p h SER 279 Cb 0.94 -0.07 -0.07 0.00 -0.31 0.00 0.00 62.40 62.90 2c3p h SER 279 CO -0.00 0.22 0.56 0.00 -0.87 0.00 0.00 176.83 176.74 2c3p h GLU 281 N 0.69 0.04 -0.60 0.00 4.39 -1.63 -1.43 114.58 116.03 2c3p h GLU 281 Ca 0.42 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 60.08 2c3p h GLU 281 Cb 0.65 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.27 2c3p h GLU 281 CO -0.18 0.31 0.26 1.15 -1.16 0.00 0.00 179.01 179.38 2c3p h THR 282 N -0.24 1.22 -0.57 1.13 2.02 -1.35 -1.36 112.91 113.77 2c3p h THR 282 Ca 0.01 -0.68 0.02 0.00 0.77 0.00 0.00 66.41 66.52 2c3p h THR 282 Cb 0.29 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 2c3p h THR 282 CO 0.00 0.27 0.36 0.40 0.37 0.00 0.00 175.52 176.92 2c3p h ILE 283 N 0.83 1.10 -0.75 3.11 2.04 -1.08 -1.82 117.51 120.94 2c3p h ILE 283 Ca 0.20 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 2c3p h ILE 283 Cb 0.18 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 2c3p h ILE 283 CO -0.02 0.13 0.36 -0.08 0.00 0.00 0.00 178.15 178.54 2c3p h GLU 284 N 0.72 1.07 -0.59 2.37 4.81 -0.80 -0.13 114.58 122.03 2c3p h GLU 284 Ca 0.22 -0.16 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2c3p h GLU 284 Cb -0.03 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.13 2c3p h GLU 284 CO -0.07 0.83 0.39 1.49 -0.73 0.00 0.00 179.01 180.92 2c3p h GLU 285 N 1.05 0.76 -0.02 1.92 4.81 -0.82 -1.43 114.58 120.85 2c3p h GLU 285 Ca 0.26 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 59.25 2c3p h GLU 285 Cb 0.11 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2c3p h GLU 285 CO -0.03 0.51 -0.82 0.28 -0.73 0.00 0.00 179.01 178.21 2c3p h VAL 286 N 0.79 1.43 -0.60 0.32 2.07 -0.57 -3.04 116.25 116.64 2c3p h VAL 286 Ca 0.22 -2.39 -0.06 0.00 0.82 0.00 0.00 66.70 65.30 2c3p h VAL 286 Cb -0.06 2.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 2c3p h VAL 286 CO -0.05 0.71 0.16 0.40 0.02 0.00 0.00 177.57 178.80 2c3p h ILE 287 N 0.18 1.25 -0.31 4.57 2.04 -0.15 -0.47 117.51 124.61 2c3p h ILE 287 Ca -0.04 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 64.95 2c3p h ILE 287 Cb 1.43 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 2c3p h ILE 287 CO 0.13 0.33 0.18 0.78 0.00 0.00 0.00 178.15 179.57 2c3p h ASN 288 N 0.87 0.28 0.53 1.72 2.35 -1.31 0.27 115.58 120.28 2c3p h ASN 288 Ca 0.19 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 2c3p h ASN 288 Cb 0.33 -0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.66 2c3p h ASN 288 CO -0.00 0.21 -0.25 -0.74 -1.65 0.00 0.00 177.43 174.99 2c3p h HIS 289 N 0.36 -0.65 -0.41 1.19 2.76 -1.38 -2.46 115.15 114.56 2c3p h HIS 289 Ca 0.13 -0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.15 2c3p h HIS 289 Cb 0.01 0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2c3p h HIS 289 CO -0.08 -0.38 -0.27 -0.07 -1.30 0.00 0.00 177.93 175.83 2c3p h LEU 290 N -0.77 0.89 -1.37 0.26 3.38 -0.99 -2.94 115.31 113.76 2c3p h LEU 290 Ca -0.07 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 2c3p h LEU 290 Cb 0.57 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2c3p h LEU 290 CO 0.12 1.10 -0.15 0.00 0.09 0.00 0.00 178.44 179.59 2c3p h ALA 291 N 0.96 1.48 0.00 1.53 0.00 -0.52 -1.09 119.26 121.62 2c3p h ALA 291 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2c3p h ALA 291 Cb 0.82 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2c3p h ALA 291 CO 0.07 0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.69 2c3p h ALA 292 N 1.63 1.00 -0.37 0.00 0.00 -1.25 0.33 119.26 120.60 2c3p h ALA 292 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2c3p h ALA 292 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2c3p h ALA 292 CO 0.02 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.90 2c3p n LYS 293 N -2.89 2.34 0.00 0.00 5.02 -0.47 -4.95 118.16 117.21 2c3p n LYS 293 Ca 0.00 -2.03 0.00 0.00 -2.02 0.00 0.00 58.31 54.26 2c3p n LYS 293 Cb 0.23 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 2c3p n LYS 293 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c3p n GLY 294 N 1.43 0.18 3.75 0.72 0.00 0.11 -5.07 105.19 106.31 2c3p n GLY 294 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2c3p n GLY 294 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c3p s GLU 295 N -0.93 4.25 -1.19 1.61 2.02 -0.87 -4.92 118.70 118.67 2c3p s GLU 295 Ca 0.00 2.33 -0.10 0.00 0.02 0.00 0.00 54.97 57.22 2c3p s GLU 295 Cb 0.00 -3.10 0.21 0.00 0.10 0.00 0.00 34.13 31.35 2c3p s GLU 295 CO 0.00 -0.44 1.47 1.63 0.02 0.00 0.00 175.26 177.94 2c3p n LYS 296 N 2.27 3.61 -4.35 1.61 4.76 -1.26 -4.20 118.16 120.60 2c3p n LYS 296 Ca 0.07 -4.01 -0.19 0.00 -2.87 0.00 0.00 58.31 51.31 2c3p n LYS 296 Cb 0.40 -2.84 -0.10 0.00 -1.84 0.00 0.00 35.03 30.65 2c3p n LYS 296 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2c3p s ILE 297 N 0.09 1.79 0.33 -0.18 -4.36 -1.26 -0.63 121.20 116.98 2c3p s ILE 297 Ca 0.38 -2.16 -0.11 0.00 -0.26 0.00 0.00 60.65 58.50 2c3p s ILE 297 Cb -0.01 -2.01 0.02 0.00 1.25 0.00 0.00 42.46 41.71 2c3p s ILE 297 CO -0.00 -0.53 0.59 -0.83 0.24 0.00 0.00 174.94 174.41 2c3p s GLY 298 N -3.20 0.78 -0.05 6.27 0.00 -0.79 -1.66 107.32 108.68 2c3p s GLY 298 Ca 0.21 -1.02 -0.03 0.00 0.00 0.00 0.00 44.72 43.88 2c3p s GLY 298 CO 0.07 -0.62 0.12 -2.27 0.00 0.00 0.00 173.10 170.40 2c3p s LEU 299 N -3.11 1.28 -0.28 0.66 2.96 -0.03 -1.37 118.68 118.80 2c3p s LEU 299 Ca 0.22 0.24 -0.07 0.00 -0.22 0.00 0.00 54.13 54.31 2c3p s LEU 299 Cb -0.02 0.36 -0.00 0.00 0.50 0.00 0.00 46.19 47.02 2c3p s LEU 299 CO 0.14 -0.08 0.08 -0.63 -1.32 0.00 0.00 176.35 174.54 2c3p s ILE 300 N 0.45 4.08 -0.23 6.68 1.01 0.95 -1.31 121.20 132.82 2c3p s ILE 300 Ca -0.03 -0.51 -0.21 0.00 0.00 0.00 0.00 60.65 59.90 2c3p s ILE 300 Cb -0.05 -3.03 -0.02 0.00 0.01 0.00 0.00 42.46 39.37 2c3p s ILE 300 CO -0.02 0.17 0.67 -0.54 0.00 0.00 0.00 174.94 175.22 2c3p s LYS 301 N 1.54 4.15 -0.27 2.79 1.02 0.20 -2.00 119.74 127.18 2c3p s LYS 301 Ca 0.04 0.64 -0.25 0.00 0.02 0.00 0.00 55.97 56.43 2c3p s LYS 301 Cb -0.16 -3.63 -0.00 0.00 -0.52 0.00 0.00 37.83 33.52 2c3p s LYS 301 CO 0.03 -0.38 0.84 0.08 -0.92 0.00 0.00 175.35 174.99 2c3p s VAL 302 N 2.39 4.79 -0.09 3.17 1.01 -0.51 -1.28 120.40 129.87 2c3p s VAL 302 Ca 0.29 1.44 -0.09 0.00 0.00 0.00 0.00 61.98 63.62 2c3p s VAL 302 Cb -0.16 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 2c3p s VAL 302 CO 0.09 -0.18 -0.18 0.54 0.00 0.00 0.00 175.10 175.37 2c3p n ARG 303 N 6.16 0.28 -3.03 2.72 3.00 0.07 -4.61 116.66 121.25 2c3p n ARG 303 Ca 0.05 0.14 -0.43 0.00 -0.01 0.00 0.00 57.85 57.61 2c3p n ARG 303 Cb 0.48 -1.02 -0.05 0.00 0.00 0.00 0.00 32.46 31.86 2c3p n ARG 303 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2c3p s LEU 304 N -6.54 4.63 0.11 0.55 2.96 -0.76 -0.33 118.68 119.31 2c3p s LEU 304 Ca -0.15 -0.71 0.10 0.00 -0.22 0.00 0.00 54.13 53.16 2c3p s LEU 304 Cb 0.02 -2.59 -0.16 0.00 0.50 0.00 0.00 46.19 43.96 2c3p s LEU 304 CO 0.22 -1.03 1.16 0.22 -1.32 0.00 0.00 176.35 175.59 2c3p h TYR 305 N 9.13 0.00 -2.84 5.38 3.20 -0.87 -3.44 116.97 127.53 2c3p h TYR 305 Ca -0.27 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.42 2c3p h TYR 305 Cb 1.09 0.00 -0.30 0.00 1.54 0.00 0.00 36.73 39.06 2c3p h TYR 305 CO 0.82 0.88 -0.46 1.03 -1.64 0.00 0.00 178.16 178.79 2c3p s ARG 306 N -2.75 0.22 0.55 1.82 1.81 -1.14 -3.55 118.95 115.92 2c3p s ARG 306 Ca 0.00 0.72 -0.20 0.00 -1.72 0.00 0.00 55.73 54.53 2c3p s ARG 306 Cb 0.09 -0.02 -0.05 0.00 -0.45 0.00 0.00 34.95 34.53 2c3p s ARG 306 CO 0.81 -0.22 1.24 -2.14 -0.68 0.00 0.00 175.30 174.30 2c3p s PRO 307 N 1.92 3.18 -0.46 3.54 0.02 -1.26 0.17 135.00 142.11 2c3p s PRO 307 Ca -0.04 1.93 -0.21 0.00 0.02 0.00 0.00 61.00 62.69 2c3p s PRO 307 Cb -0.11 -2.11 0.03 0.00 0.02 0.00 0.00 34.50 32.33 2c3p s PRO 307 CO -0.10 -1.07 0.68 0.12 -0.33 0.00 0.00 177.00 176.31 2c3p s PHE 308 N -1.50 3.03 -0.51 6.54 5.36 -1.23 -4.94 117.98 124.73 2c3p s PHE 308 Ca 0.73 -0.11 -0.16 0.00 -0.96 0.00 0.00 56.93 56.43 2c3p s PHE 308 Cb -0.33 -3.48 0.09 0.00 -0.34 0.00 0.00 43.02 38.96 2c3p s PHE 308 CO 0.37 -0.96 0.48 0.08 -1.46 0.00 0.00 175.22 173.73 2c3p s VAL 309 N 2.94 5.16 0.41 3.12 1.01 -1.26 -4.93 120.40 126.85 2c3p s VAL 309 Ca 0.23 -1.13 0.08 0.00 0.00 0.00 0.00 61.98 61.16 2c3p s VAL 309 Cb -0.15 -4.24 0.28 0.00 0.00 0.00 0.00 36.38 32.27 2c3p s VAL 309 CO 0.18 -0.73 2.04 0.77 0.00 0.00 0.00 175.10 177.36 2c3p h SER 310 N 8.85 0.48 -0.43 3.32 4.64 -1.98 -1.70 113.55 126.74 2c3p h SER 310 Ca -0.29 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.00 2c3p h SER 310 Cb 1.10 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 63.06 2c3p h SER 310 CO 0.95 0.34 0.19 -0.08 -0.87 0.00 0.00 176.83 177.36 2c3p h GLU 311 N 0.57 0.63 -0.00 4.77 4.81 -1.99 -0.81 114.58 122.55 2c3p h GLU 311 Ca 0.18 -0.11 -0.08 0.00 -0.13 0.00 0.00 59.36 59.22 2c3p h GLU 311 Cb 0.03 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2c3p h GLU 311 CO -0.04 0.57 -0.40 0.00 -0.73 0.00 0.00 179.01 178.40 2c3p h ALA 312 N 1.03 1.34 -0.16 2.92 0.00 -1.85 -0.91 119.26 121.63 2c3p h ALA 312 Ca 0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2c3p h ALA 312 Cb 0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2c3p h ALA 312 CO -0.01 0.50 -0.01 0.35 0.00 0.00 0.00 179.25 180.07 2c3p h PHE 313 N 0.00 0.33 -0.30 0.00 3.57 -0.58 -3.04 116.94 116.91 2c3p h PHE 313 Ca -0.00 -0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.35 2c3p h PHE 313 Cb 0.71 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 2c3p h PHE 313 CO 0.00 0.53 -0.18 0.74 -2.23 0.00 0.00 178.31 177.17 2c3p h PHE 314 N 0.03 0.60 -0.02 0.41 -1.00 -0.95 -1.46 116.94 114.54 2c3p h PHE 314 Ca 0.04 -0.11 0.01 0.00 2.81 0.00 0.00 57.97 60.72 2c3p h PHE 314 Cb 0.41 -0.15 -0.00 0.00 3.61 0.00 0.00 35.95 39.82 2c3p h PHE 314 CO 0.04 0.69 0.09 0.00 -1.61 0.00 0.00 178.31 177.52 2c3p h ALA 315 N 1.32 1.24 -0.01 2.45 0.00 -1.07 0.96 119.26 124.15 2c3p h ALA 315 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2c3p h ALA 315 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2c3p h ALA 315 CO 0.04 -0.10 -0.80 0.00 0.00 0.00 0.00 179.25 178.39 2c3p n ALA 316 N -2.11 4.30 -2.66 0.00 0.00 -0.58 -4.93 120.51 114.54 2c3p n ALA 316 Ca -0.02 -0.62 -0.39 0.00 0.00 0.00 0.00 53.44 52.41 2c3p n ALA 316 Cb 0.16 -0.78 -0.07 0.00 0.00 0.00 0.00 19.45 18.76 2c3p n ALA 316 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2c3p s LEU 317 N -2.80 4.13 0.32 0.00 1.98 0.33 -4.67 118.68 117.98 2c3p s LEU 317 Ca 0.12 0.63 -0.29 0.00 -2.89 0.00 0.00 54.13 51.70 2c3p s LEU 317 Cb 0.17 -2.68 -0.10 0.00 0.66 0.00 0.00 46.19 44.24 2c3p s LEU 317 CO 0.75 -0.18 1.34 -2.84 -1.89 0.00 0.00 176.35 173.53 2c3p s PRO 318 N 1.68 4.32 0.47 0.98 0.02 -1.26 -4.89 135.00 136.33 2c3p s PRO 318 Ca 0.23 2.25 0.21 0.00 0.02 0.00 0.00 61.00 63.71 2c3p s PRO 318 Cb -0.15 -3.07 1.17 0.00 0.02 0.00 0.00 34.50 32.46 2c3p s PRO 318 CO 0.09 -0.25 1.99 0.00 -0.33 0.00 0.00 177.00 178.50 2c3p h ALA 319 N 3.68 1.38 0.00 -1.55 0.00 -1.91 -2.37 119.26 118.50 2c3p h ALA 319 Ca -0.48 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2c3p h ALA 319 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2c3p h ALA 319 CO 0.68 0.24 0.00 -1.13 0.00 0.00 0.00 179.25 179.03 2c3p n SER 320 N -3.87 0.00 -4.71 0.00 3.41 -1.26 -4.82 113.62 102.36 2c3p n SER 320 Ca -0.02 -0.38 -0.42 0.00 -0.26 0.00 0.00 58.87 57.79 2c3p n SER 320 Cb 0.28 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.03 2c3p n SER 320 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c3p s ALA 321 N -2.36 3.59 -0.05 7.33 0.00 -0.89 -4.18 121.76 125.19 2c3p s ALA 321 Ca 0.31 1.08 0.04 0.00 0.00 0.00 0.00 51.96 53.39 2c3p s ALA 321 Cb 0.18 -3.55 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 2c3p s ALA 321 CO 0.37 -0.67 0.11 1.63 0.00 0.00 0.00 175.76 177.21 2c3p n LYS 322 N 4.21 1.52 -3.91 0.00 5.02 0.99 -4.81 118.16 121.18 2c3p n LYS 322 Ca 0.12 -0.03 -0.20 0.00 -2.02 0.00 0.00 58.31 56.17 2c3p n LYS 322 Cb 0.43 -1.00 -0.17 0.00 -0.02 0.00 0.00 35.03 34.27 2c3p n LYS 322 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2c3p s VAL 323 N -2.07 0.34 -0.10 -0.18 1.01 -0.60 -0.61 120.40 118.20 2c3p s VAL 323 Ca -0.01 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.06 2c3p s VAL 323 Cb 0.03 -0.45 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2c3p s VAL 323 CO 0.18 0.22 -0.18 -0.63 0.00 0.00 0.00 175.10 174.69 2c3p s ILE 324 N 1.45 1.62 -0.21 2.22 1.01 0.15 -1.03 121.20 126.42 2c3p s ILE 324 Ca -0.03 -0.74 -0.04 0.00 0.00 0.00 0.00 60.65 59.84 2c3p s ILE 324 Cb -0.13 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 2c3p s ILE 324 CO -0.03 0.46 -0.04 -0.89 0.00 0.00 0.00 174.94 174.44 2c3p s THR 325 N 0.72 3.44 -0.24 2.92 2.01 0.47 0.03 115.64 125.00 2c3p s THR 325 Ca -0.12 -0.48 -0.11 0.00 0.31 0.00 0.00 61.69 61.30 2c3p s THR 325 Cb -0.16 -2.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.75 2c3p s THR 325 CO 0.02 0.44 0.17 -0.69 -0.69 0.00 0.00 174.62 173.87 2c3p s VAL 326 N 1.26 5.35 -0.25 3.82 1.01 0.59 -0.23 120.40 131.95 2c3p s VAL 326 Ca 0.03 0.19 -0.11 0.00 0.00 0.00 0.00 61.98 62.10 2c3p s VAL 326 Cb -0.14 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 2c3p s VAL 326 CO -0.01 0.34 0.17 -0.76 0.00 0.00 0.00 175.10 174.84 2c3p s LEU 327 N 1.11 4.08 -0.12 3.92 1.02 0.20 -1.07 118.68 127.82 2c3p s LEU 327 Ca 0.08 0.07 -0.01 0.00 0.02 0.00 0.00 54.13 54.29 2c3p s LEU 327 Cb -0.14 -2.12 -0.02 0.00 0.02 0.00 0.00 46.19 43.94 2c3p s LEU 327 CO 0.05 0.02 -0.10 -1.81 0.02 0.00 0.00 176.35 174.53 2c3p s ASP 328 N 1.30 4.26 -0.84 2.29 1.01 0.15 -4.53 116.67 120.31 2c3p s ASP 328 Ca 0.07 -0.24 -0.03 0.00 0.71 0.00 0.00 52.55 53.06 2c3p s ASP 328 Cb -0.14 -1.56 0.22 0.00 1.01 0.00 0.00 42.92 42.44 2c3p s ASP 328 CO 0.07 0.20 2.29 -1.14 0.21 0.00 0.00 175.17 176.79 2c3p n ARG 329 N 3.32 3.46 -3.83 8.23 0.63 -1.26 -2.59 116.66 124.62 2c3p n ARG 329 Ca -0.18 -3.36 -0.07 0.00 -0.92 0.00 0.00 57.85 53.32 2c3p n ARG 329 Cb 0.53 -2.33 0.02 0.00 0.45 0.00 0.00 32.46 31.12 2c3p n ARG 329 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 2c3p s THR 330 N -3.40 0.00 -0.06 5.15 -1.32 -1.26 -0.90 115.64 113.84 2c3p s THR 330 Ca 0.52 -0.90 -0.03 0.00 -1.21 0.00 0.00 61.69 60.08 2c3p s THR 330 Cb 0.33 -2.73 0.04 0.00 -1.51 0.00 0.00 72.50 68.63 2c3p s THR 330 CO -0.25 0.00 0.11 -0.75 -2.21 0.00 0.00 174.62 171.52 2c3p s LYS 331 N -2.52 -0.01 -0.45 7.08 2.20 -1.26 -4.83 119.74 119.96 2c3p s LYS 331 Ca 0.16 0.44 0.03 0.00 -0.36 0.00 0.00 55.97 56.24 2c3p s LYS 331 Cb -0.05 -0.34 0.12 0.00 -1.51 0.00 0.00 37.83 36.05 2c3p s LYS 331 CO 0.09 -0.28 0.18 -1.21 -0.36 0.00 0.00 175.35 173.77 2c3p s GLU 332 N 2.00 1.81 0.21 4.03 2.02 -1.26 -5.05 118.70 122.45 2c3p s GLU 332 Ca 0.01 -2.27 -0.32 0.00 0.02 0.00 0.00 54.97 52.41 2c3p s GLU 332 Cb -0.12 -3.32 -0.15 0.00 0.10 0.00 0.00 34.13 30.65 2c3p s GLU 332 CO -0.05 -1.04 1.24 -2.30 0.02 0.00 0.00 175.26 173.13 2c3p n PRO 333 N 3.67 1.51 0.00 0.39 -0.02 -1.26 -1.70 135.00 137.59 2c3p n PRO 333 Ca 0.04 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2c3p n PRO 333 Cb 0.37 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2c3p n PRO 333 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c3p n GLY 334 N 1.99 2.87 3.80 -1.23 0.00 -1.26 -5.01 105.19 106.36 2c3p n GLY 334 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2c3p n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p s ALA 335 N -2.03 2.76 -1.61 4.61 0.00 -0.69 -4.90 121.76 119.90 2c3p s ALA 335 Ca 0.00 0.51 0.20 0.00 0.00 0.00 0.00 51.96 52.67 2c3p s ALA 335 Cb 0.00 -3.26 1.07 0.00 0.00 0.00 0.00 23.12 20.93 2c3p s ALA 335 CO 0.00 -0.69 1.61 -0.35 0.00 0.00 0.00 175.76 176.33 2c3p n PRO 336 N -1.67 0.40 0.00 0.00 -0.04 -1.26 -4.82 135.00 127.60 2c3p n PRO 336 Ca 0.09 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2c3p n PRO 336 Cb 0.52 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 2c3p n PRO 336 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2c3p n GLY 337 N 0.35 1.95 3.80 0.55 0.00 -1.26 -5.06 105.19 105.52 2c3p n GLY 337 Ca 0.11 -0.48 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 2c3p n GLY 337 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c3p s ASP 338 N 0.00 5.04 0.10 1.61 1.01 -1.26 -4.75 116.67 118.42 2c3p s ASP 338 Ca 0.00 1.71 -0.20 0.00 0.71 0.00 0.00 52.55 54.77 2c3p s ASP 338 Cb 0.00 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 2c3p s ASP 338 CO 0.00 -1.67 1.21 -2.65 0.21 0.00 0.00 175.17 172.27 2c3p n PRO 339 N -3.25 -0.28 -0.33 8.23 -0.02 -1.26 -1.75 135.00 136.35 2c3p n PRO 339 Ca 0.08 1.19 -0.03 0.00 -2.02 0.00 0.00 63.50 62.73 2c3p n PRO 339 Cb 0.53 -1.76 0.09 0.00 -0.02 0.00 0.00 33.50 32.35 2c3p n PRO 339 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2c3p h LEU 340 N 0.00 1.00 -0.40 2.45 5.85 -1.93 -1.10 115.31 121.17 2c3p h LEU 340 Ca 0.10 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.81 2c3p h LEU 340 Cb 0.26 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2c3p h LEU 340 CO -0.59 0.71 0.26 0.22 -0.34 0.00 0.00 178.44 178.70 2c3p h TYR 341 N 1.18 0.49 -0.66 1.25 3.20 -1.76 -1.02 116.97 119.64 2c3p h TYR 341 Ca 0.33 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.17 2c3p h TYR 341 Cb -0.10 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 37.97 2c3p h TYR 341 CO -0.01 0.30 0.26 -0.07 -1.64 0.00 0.00 178.16 177.00 2c3p h LEU 342 N 0.53 0.89 -0.45 2.82 3.38 -0.83 0.08 115.31 121.73 2c3p h LEU 342 Ca 0.15 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2c3p h LEU 342 Cb -0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2c3p h LEU 342 CO -0.04 0.80 0.01 0.44 0.09 0.00 0.00 178.44 179.73 2c3p h ASP 343 N 0.95 0.77 -0.35 -0.43 3.32 -0.76 -0.82 116.42 119.10 2c3p h ASP 343 Ca 0.22 -0.30 -0.06 0.00 0.02 0.00 0.00 57.03 56.91 2c3p h ASP 343 Cb 0.19 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2c3p h ASP 343 CO -0.02 0.89 -0.00 0.58 -1.72 0.00 0.00 179.24 178.96 2c3p h VAL 344 N 0.63 1.26 -0.80 -1.35 2.07 -0.88 -2.02 116.25 115.17 2c3p h VAL 344 Ca 0.13 -0.98 0.08 0.00 0.82 0.00 0.00 66.70 66.75 2c3p h VAL 344 Cb 0.49 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 2c3p h VAL 344 CO 0.02 0.32 0.46 0.00 0.02 0.00 0.00 177.57 178.40 2c3p h SER 346 N 0.81 0.62 -0.41 0.00 4.64 -0.76 -1.69 113.55 116.76 2c3p h SER 346 Ca 0.37 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.62 2c3p h SER 346 Cb 0.28 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2c3p h SER 346 CO -0.22 0.52 0.17 0.00 -0.87 0.00 0.00 176.83 176.44 2c3p h ALA 347 N 1.58 0.53 -0.57 5.18 0.00 -0.44 -1.89 119.26 123.65 2c3p h ALA 347 Ca 0.18 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 2c3p h ALA 347 Cb 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2c3p h ALA 347 CO -0.03 0.12 -0.06 0.74 0.00 0.00 0.00 179.25 180.02 2c3p h PHE 348 N 0.51 1.16 -0.40 0.00 -1.00 -0.96 -1.76 116.94 114.48 2c3p h PHE 348 Ca 0.14 -0.22 -0.13 0.00 2.81 0.00 0.00 57.97 60.56 2c3p h PHE 348 Cb 0.16 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 2c3p h PHE 348 CO -0.00 1.05 -0.29 -0.39 -1.61 0.00 0.00 178.31 177.07 2c3p h VAL 349 N 0.94 1.27 0.00 -0.55 -1.51 -1.19 -2.48 116.25 112.73 2c3p h VAL 349 Ca 0.16 -1.44 -0.11 0.00 -1.23 0.00 0.00 66.70 64.07 2c3p h VAL 349 Cb 0.63 1.27 -0.02 0.00 -2.13 0.00 0.00 31.29 31.04 2c3p h VAL 349 CO 0.04 0.48 -0.53 -0.08 -1.23 0.00 0.00 177.57 176.26 2c3p h GLU 350 N 0.73 0.00 -0.59 5.19 4.81 -1.24 -2.51 114.58 120.98 2c3p h GLU 350 Ca 0.08 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.23 2c3p h GLU 350 Cb 0.84 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 2c3p h GLU 350 CO 0.07 0.53 0.04 -0.09 -0.73 0.00 0.00 179.01 178.83 2c3p h ARG 351 N 0.00 0.99 -5.48 1.92 2.43 -1.20 -3.48 114.38 109.56 2c3p h ARG 351 Ca -0.01 -0.28 -0.33 0.00 -0.81 0.00 0.00 59.98 58.56 2c3p h ARG 351 Cb 0.96 -0.11 0.16 0.00 -0.42 0.00 0.00 29.97 30.56 2c3p h ARG 351 CO 0.07 0.94 -0.71 0.41 -1.51 0.00 0.00 179.97 179.17 2c3p n GLY 352 N -0.57 -0.35 0.00 2.80 0.00 -0.95 -4.98 105.19 101.14 2c3p n GLY 352 Ca 0.03 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2c3p n GLY 352 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3p n GLU 353 N -4.13 0.00 -1.71 1.61 1.02 -1.26 -5.10 120.64 111.08 2c3p n GLU 353 Ca -0.22 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.49 2c3p n GLU 353 Cb 0.64 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 32.04 2c3p n GLU 353 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2c3p n ALA 354 N -3.00 1.88 -3.94 0.62 0.00 -1.26 -4.95 120.51 109.86 2c3p n ALA 354 Ca 0.00 0.40 -0.31 0.00 0.00 0.00 0.00 53.44 53.53 2c3p n ALA 354 Cb 0.00 -2.38 -0.14 0.00 0.00 0.00 0.00 19.45 16.93 2c3p n ALA 354 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2c3p s MET 355 N -0.18 1.89 0.96 0.00 -1.94 -1.26 -5.03 119.30 113.75 2c3p s MET 355 Ca 0.68 -2.36 -0.13 0.00 -1.71 0.00 0.00 55.69 52.17 2c3p s MET 355 Cb -0.58 -3.34 0.17 0.00 2.01 0.00 0.00 34.83 33.09 2c3p s MET 355 CO 0.46 -1.06 1.12 -1.25 -0.01 0.00 0.00 175.02 174.28 2c3p s PRO 356 N 0.15 0.75 -0.04 2.03 0.04 -1.26 -4.93 135.00 131.73 2c3p s PRO 356 Ca 0.15 0.33 -0.30 0.00 0.04 0.00 0.00 61.00 61.22 2c3p s PRO 356 Cb -0.23 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2c3p s PRO 356 CO -0.03 -2.47 1.31 0.21 0.04 0.00 0.00 177.00 176.06 2c3p s LYS 357 N -5.19 4.30 -0.15 4.56 2.47 0.22 -4.88 119.74 121.09 2c3p s LYS 357 Ca 0.65 1.82 -0.03 0.00 -1.56 0.00 0.00 55.97 56.86 2c3p s LYS 357 Cb -0.16 -3.60 -0.02 0.00 -1.46 0.00 0.00 37.83 32.59 2c3p s LYS 357 CO 0.55 -0.54 -0.06 0.42 0.16 0.00 0.00 175.35 175.87 2c3p s ILE 358 N 2.48 3.65 0.11 5.43 1.01 -1.26 0.35 121.20 132.98 2c3p s ILE 358 Ca 0.60 -0.45 0.09 0.00 0.00 0.00 0.00 60.65 60.89 2c3p s ILE 358 Cb -0.28 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 2c3p s ILE 358 CO 0.24 0.50 -0.22 -0.76 0.00 0.00 0.00 174.94 174.70 2c3p s LEU 359 N 0.32 2.31 -0.11 2.97 1.43 0.10 -4.97 118.68 120.75 2c3p s LEU 359 Ca -0.06 -0.71 0.00 0.00 -1.03 0.00 0.00 54.13 52.34 2c3p s LEU 359 Cb -0.15 -0.97 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 2c3p s LEU 359 CO 0.04 0.09 -0.11 0.00 0.23 0.00 0.00 176.35 176.59 2c3p s ALA 360 N -1.15 2.72 0.02 4.21 0.00 -1.26 -0.30 121.76 126.00 2c3p s ALA 360 Ca 0.09 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.18 2c3p s ALA 360 Cb -0.10 -1.20 -0.02 0.00 0.00 0.00 0.00 23.12 21.81 2c3p s ALA 360 CO 0.05 0.36 -0.10 0.20 0.00 0.00 0.00 175.76 176.26 2c3p s GLY 361 N -0.05 0.57 -0.05 0.00 0.00 -0.24 -1.02 107.32 106.53 2c3p s GLY 361 Ca -0.02 -0.60 0.04 0.00 0.00 0.00 0.00 44.72 44.14 2c3p s GLY 361 CO 0.04 -0.58 -0.16 -1.60 0.00 0.00 0.00 173.10 170.80 2c3p s ARG 362 N -0.79 2.53 0.29 2.90 3.52 0.25 -0.68 118.95 126.98 2c3p s ARG 362 Ca 0.00 -0.74 -0.11 0.00 -0.13 0.00 0.00 55.73 54.76 2c3p s ARG 362 Cb -0.06 -2.34 0.00 0.00 -1.56 0.00 0.00 34.95 30.99 2c3p s ARG 362 CO 0.00 0.57 0.52 1.52 -0.81 0.00 0.00 175.30 177.09 2c3p s TYR 363 N -0.59 0.51 -0.89 5.12 1.13 -1.07 -1.64 117.35 119.92 2c3p s TYR 363 Ca 0.08 -0.88 0.00 0.00 -1.41 0.00 0.00 57.07 54.87 2c3p s TYR 363 Cb -0.11 0.20 0.00 0.00 -1.10 0.00 0.00 41.96 40.95 2c3p s TYR 363 CO 0.01 -1.10 0.00 0.41 -2.51 0.00 0.00 175.55 172.36 2c3p n GLY 364 N -0.45 -0.15 3.74 5.49 0.00 -1.26 -4.37 105.19 108.19 2c3p n GLY 364 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2c3p n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c3p s LEU 365 N -4.96 4.37 -1.35 0.99 1.02 -1.26 -2.37 118.68 115.12 2c3p s LEU 365 Ca 0.00 2.75 -0.05 0.00 0.02 0.00 0.00 54.13 56.85 2c3p s LEU 365 Cb 0.00 -3.62 0.02 0.00 0.02 0.00 0.00 46.19 42.61 2c3p s LEU 365 CO 0.00 -0.80 0.94 0.61 0.02 0.00 0.00 176.35 177.12 2c3p n GLY 366 N 2.55 -0.41 2.49 -3.19 0.00 -1.22 -1.66 105.19 103.75 2c3p n GLY 366 Ca 0.09 0.17 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 2c3p n GLY 366 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2c3p n SER 367 N -3.01 -5.67 -4.71 1.61 7.64 0.22 -4.53 113.62 105.18 2c3p n SER 367 Ca -0.14 0.24 -0.41 0.00 1.01 0.00 0.00 58.87 59.57 2c3p n SER 367 Cb 0.61 -4.85 0.00 0.00 -1.01 0.00 0.00 64.21 58.96 2c3p n SER 367 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2c3p n LYS 368 N -2.70 2.05 -1.72 1.43 3.00 -0.66 -4.87 118.16 114.69 2c3p n LYS 368 Ca -0.23 0.72 -0.41 0.00 -0.00 0.00 0.00 58.31 58.40 2c3p n LYS 368 Cb 0.68 -2.38 0.01 0.00 0.00 0.00 0.00 35.03 33.34 2c3p n LYS 368 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2c3p n GLU 369 N 0.24 2.10 -3.74 1.64 -0.58 -1.26 -4.24 120.64 114.81 2c3p n GLU 369 Ca 0.06 0.75 -0.29 0.00 -0.42 0.00 0.00 57.16 57.25 2c3p n GLU 369 Cb 0.38 -2.46 -0.13 0.00 -0.57 0.00 0.00 31.44 28.66 2c3p n GLU 369 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 2c3p s PHE 370 N -1.18 2.16 0.56 -0.32 5.99 -1.26 -4.63 117.98 119.29 2c3p s PHE 370 Ca 0.60 -2.55 0.02 0.00 0.00 0.00 0.00 56.93 55.00 2c3p s PHE 370 Cb -0.50 -2.00 0.04 0.00 0.00 0.00 0.00 43.02 40.57 2c3p s PHE 370 CO 0.59 -0.77 0.78 -1.54 -0.00 0.00 0.00 175.22 174.28 2c3p s SER 371 N 0.19 5.22 0.27 6.13 1.04 -1.26 -4.74 113.70 120.55 2c3p s SER 371 Ca 0.18 -0.09 -0.01 0.00 0.48 0.00 0.00 55.95 56.51 2c3p s SER 371 Cb -0.23 -0.76 0.49 0.00 0.10 0.00 0.00 66.02 65.62 2c3p s SER 371 CO -0.01 -1.18 1.82 -0.65 0.98 0.00 0.00 173.24 174.21 2c3p h PRO 372 N 0.07 0.89 -0.50 4.02 0.11 -1.97 -0.55 132.00 134.07 2c3p h PRO 372 Ca -0.41 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 2c3p h PRO 372 Cb 1.29 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2c3p h PRO 372 CO 0.50 0.59 0.29 0.00 -0.21 0.00 0.00 178.00 179.17 2c3p h ALA 373 N 1.51 1.58 -0.09 -0.75 0.00 -1.92 -0.24 119.26 119.34 2c3p h ALA 373 Ca 0.46 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 55.17 2c3p h ALA 373 Cb 0.44 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2c3p h ALA 373 CO -0.26 0.37 -0.55 0.52 0.00 0.00 0.00 179.25 179.33 2c3p h MET 374 N 0.68 0.25 -0.41 0.00 2.86 -1.48 -0.55 114.93 116.28 2c3p h MET 374 Ca 0.18 -0.16 -0.13 0.00 -2.06 0.00 0.00 59.70 57.53 2c3p h MET 374 Cb -0.01 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 2c3p h MET 374 CO -0.03 0.74 -0.25 0.28 1.06 0.00 0.00 176.91 178.70 2c3p h VAL 375 N 0.19 1.27 -0.40 -2.22 2.07 -0.63 -1.34 116.25 115.19 2c3p h VAL 375 Ca 0.00 -1.39 0.01 0.00 0.82 0.00 0.00 66.70 66.14 2c3p h VAL 375 Cb 1.03 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 2c3p h VAL 375 CO 0.09 0.47 0.25 0.50 0.02 0.00 0.00 177.57 178.89 2c3p h LYS 376 N 0.73 0.49 -0.37 1.57 1.63 -0.65 -0.60 116.57 119.36 2c3p h LYS 376 Ca 0.09 -0.03 0.07 0.00 -0.85 0.00 0.00 60.65 59.93 2c3p h LYS 376 Cb 0.79 -0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 32.25 2c3p h LYS 376 CO 0.07 0.32 -0.03 0.77 -3.45 0.00 0.00 179.45 177.13 2c3p h SER 377 N 0.51 -0.21 -0.97 4.20 0.02 -0.61 0.35 113.55 116.84 2c3p h SER 377 Ca 0.16 0.09 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 2c3p h SER 377 Cb -0.02 0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 2c3p h SER 377 CO -0.06 -0.07 0.64 0.58 -1.14 0.00 0.00 176.83 176.79 2c3p h VAL 378 N 0.07 1.23 -0.15 2.27 2.07 -0.41 0.34 116.25 121.67 2c3p h VAL 378 Ca 0.18 -0.44 -0.22 0.00 0.82 0.00 0.00 66.70 67.03 2c3p h VAL 378 Cb 0.26 -0.18 0.01 0.00 -1.52 0.00 0.00 31.29 29.86 2c3p h VAL 378 CO -0.33 0.24 -0.79 1.88 0.02 0.00 0.00 177.57 178.59 2c3p h TYR 379 N 1.29 1.05 -0.43 1.57 -1.99 -0.51 -3.01 116.97 114.95 2c3p h TYR 379 Ca 0.36 -0.47 -0.06 0.00 2.00 0.00 0.00 58.73 60.56 2c3p h TYR 379 Cb -0.12 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 38.43 2c3p h TYR 379 CO -0.00 1.30 0.01 -0.44 -0.00 0.00 0.00 178.16 179.02 2c3p h ASP 380 N 0.52 0.65 -0.95 3.88 3.32 0.20 -2.09 116.42 121.96 2c3p h ASP 380 Ca -0.05 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 56.86 2c3p h ASP 380 Cb 1.42 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 40.75 2c3p h ASP 380 CO 0.16 0.72 0.63 -1.13 -1.72 0.00 0.00 179.24 177.90 2c3p h ASN 381 N 0.65 1.09 0.53 6.45 -1.24 -0.28 0.12 115.58 122.90 2c3p h ASN 381 Ca 0.13 -0.03 -0.02 0.00 0.71 0.00 0.00 56.30 57.10 2c3p h ASN 381 Cb 0.39 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 39.17 2c3p h ASN 381 CO 0.01 0.79 -0.08 0.24 -1.29 0.00 0.00 177.43 177.10 2c3p h MET 382 N 1.29 0.00 -0.01 6.67 2.86 -1.24 -0.37 114.93 124.13 2c3p h MET 382 Ca 0.35 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.99 2c3p h MET 382 Cb -0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.51 2c3p h MET 382 CO -0.07 0.08 -0.54 -1.13 1.06 0.00 0.00 176.91 176.31 2c3p n SER 383 N -3.39 1.16 0.00 1.22 3.41 -0.89 -4.86 113.62 110.28 2c3p n SER 383 Ca -0.01 -1.08 0.00 0.00 -0.26 0.00 0.00 58.87 57.52 2c3p n SER 383 Cb 0.25 0.75 0.00 0.00 -0.26 0.00 0.00 64.21 64.94 2c3p n SER 383 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c3p n GLY 384 N 1.26 1.03 0.33 5.00 0.00 0.38 -4.96 105.19 108.23 2c3p n GLY 384 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2c3p n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p h ALA 385 N -0.64 1.18 -3.09 4.61 0.00 -1.79 -3.47 119.26 116.06 2c3p h ALA 385 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 2c3p h ALA 385 Cb 0.00 -0.25 0.06 0.00 0.00 0.00 0.00 17.79 17.60 2c3p h ALA 385 CO 0.00 0.32 -0.29 1.63 0.00 0.00 0.00 179.25 180.91 2c3p n LYS 386 N -4.59 -3.36 -1.75 0.00 5.02 -0.20 -4.97 118.16 108.31 2c3p n LYS 386 Ca 0.12 0.35 -0.40 0.00 -2.02 0.00 0.00 58.31 56.36 2c3p n LYS 386 Cb 0.16 -3.94 0.01 0.00 -0.02 0.00 0.00 35.03 31.24 2c3p n LYS 386 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2c3p n LYS 387 N -2.41 2.22 -4.03 1.97 4.81 -1.26 -5.00 118.16 114.45 2c3p n LYS 387 Ca -0.00 0.79 -0.22 0.00 -0.87 0.00 0.00 58.31 58.00 2c3p n LYS 387 Cb 0.53 -2.56 -0.05 0.00 0.02 0.00 0.00 35.03 32.97 2c3p n LYS 387 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 2c3p s ASN 388 N -0.44 5.12 -1.36 3.14 3.84 -1.26 -4.63 114.94 119.34 2c3p s ASN 388 Ca 0.60 -0.50 -0.12 0.00 0.21 0.00 0.00 52.86 53.05 2c3p s ASN 388 Cb -0.47 -1.03 0.01 0.00 -0.55 0.00 0.00 41.25 39.21 2c3p s ASN 388 CO 0.59 -0.20 0.41 1.41 -2.79 0.00 0.00 177.10 176.52 2c3p n HIS 389 N -1.20 -1.50 -2.95 0.43 8.25 -0.19 -4.93 115.22 113.13 2c3p n HIS 389 Ca -0.05 0.49 -0.19 0.00 -0.26 0.00 0.00 57.72 57.72 2c3p n HIS 389 Cb 0.59 -3.18 0.02 0.00 1.12 0.00 0.00 29.99 28.54 2c3p n HIS 389 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2c3p s PHE 390 N -3.91 2.89 0.13 4.41 -0.12 -0.82 -4.89 117.98 115.67 2c3p s PHE 390 Ca 0.19 -0.22 0.09 0.00 -0.05 0.00 0.00 56.93 56.95 2c3p s PHE 390 Cb -0.09 -2.44 -0.04 0.00 -0.63 0.00 0.00 43.02 39.82 2c3p s PHE 390 CO 0.94 -0.50 -0.21 0.95 -0.05 0.00 0.00 175.22 176.34 2c3p s THR 391 N -2.47 1.88 -0.05 -4.49 -4.23 0.13 -0.58 115.64 105.84 2c3p s THR 391 Ca 0.54 -1.72 -0.02 0.00 -1.18 0.00 0.00 61.69 59.31 2c3p s THR 391 Cb -0.10 -1.75 0.04 0.00 1.34 0.00 0.00 72.50 72.02 2c3p s THR 391 CO 0.35 -0.11 0.10 0.54 -0.54 0.00 0.00 174.62 174.95 2c3p s VAL 392 N -1.43 -0.08 0.00 2.29 0.11 -0.65 -1.23 120.40 119.41 2c3p s VAL 392 Ca 0.11 0.23 0.00 0.00 -2.93 0.00 0.00 61.98 59.40 2c3p s VAL 392 Cb -0.09 -0.18 0.00 0.00 -1.53 0.00 0.00 36.38 34.59 2c3p s VAL 392 CO 0.06 0.10 0.00 0.61 -3.33 0.00 0.00 175.10 172.53 2c3p n GLY 393 N 4.40 1.32 3.23 6.54 0.00 -1.26 -4.37 105.19 115.05 2c3p n GLY 393 Ca -0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.66 2c3p n GLY 393 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2c3p s ILE 394 N -2.00 0.59 -0.41 -0.61 -4.36 -1.26 -4.94 121.20 108.21 2c3p s ILE 394 Ca 0.00 -1.97 -0.08 0.00 -0.26 0.00 0.00 60.65 58.34 2c3p s ILE 394 Cb 0.00 -2.12 0.08 0.00 1.25 0.00 0.00 42.46 41.67 2c3p s ILE 394 CO 0.00 -0.47 0.24 -0.70 0.24 0.00 0.00 174.94 174.25 2c3p s GLU 395 N -3.94 2.53 -0.98 0.37 2.12 -1.26 -4.67 118.70 112.88 2c3p s GLU 395 Ca 0.24 -1.49 -0.16 0.00 0.36 0.00 0.00 54.97 53.93 2c3p s GLU 395 Cb 0.06 -3.73 0.17 0.00 0.26 0.00 0.00 34.13 30.89 2c3p s GLU 395 CO 0.04 -0.95 1.11 0.34 -0.54 0.00 0.00 175.26 175.26 2c3p s ASP 396 N 2.04 6.81 0.00 -1.70 3.68 -1.26 -1.82 116.67 124.42 2c3p s ASP 396 Ca 0.03 -2.50 0.09 0.00 2.13 0.00 0.00 52.55 52.30 2c3p s ASP 396 Cb -0.23 -2.34 0.26 0.00 -1.45 0.00 0.00 42.92 39.16 2c3p s ASP 396 CO 0.01 -0.83 1.22 -0.90 0.13 0.00 0.00 175.17 174.80 2c3p n ASP 397 N 5.50 1.55 -0.12 -0.34 5.75 -1.26 -1.27 116.55 126.36 2c3p n ASP 397 Ca 0.24 -2.00 -0.26 0.00 -0.01 0.00 0.00 54.79 52.77 2c3p n ASP 397 Cb 0.47 -0.19 -0.09 0.00 -1.03 0.00 0.00 41.12 40.27 2c3p n ASP 397 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 2c3p n VAL 398 N 0.35 1.36 0.38 2.12 0.31 -1.26 -4.67 118.33 116.91 2c3p n VAL 398 Ca 0.10 -0.36 0.04 0.00 -0.01 0.00 0.00 64.34 64.11 2c3p n VAL 398 Cb 0.24 -1.79 0.03 0.00 -0.91 0.00 0.00 33.84 31.41 2c3p n VAL 398 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2c3p n THR 399 N -4.03 0.00 -3.67 2.52 -2.24 -1.26 -5.02 114.28 100.59 2c3p n THR 399 Ca -0.48 -0.48 -0.24 0.00 -2.27 0.00 0.00 64.05 60.58 2c3p n THR 399 Cb 0.86 1.16 0.06 0.00 -2.10 0.00 0.00 70.33 70.31 2c3p n THR 399 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3p n GLY 400 N 0.60 -0.45 0.13 3.38 0.00 -0.39 -4.92 105.19 103.53 2c3p n GLY 400 Ca 0.05 0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.36 2c3p n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c3p n THR 401 N -4.61 0.00 -2.82 2.61 -2.24 -1.25 -4.99 114.28 100.97 2c3p n THR 401 Ca -0.10 -0.07 -0.37 0.00 -2.27 0.00 0.00 64.05 61.25 2c3p n THR 401 Cb 0.60 0.89 -0.06 0.00 -2.10 0.00 0.00 70.33 69.65 2c3p n THR 401 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2c3p s SER 402 N -2.85 7.29 0.04 3.42 1.04 -1.26 -0.69 113.70 120.70 2c3p s SER 402 Ca 0.12 1.78 -0.23 0.00 0.48 0.00 0.00 55.95 58.10 2c3p s SER 402 Cb 0.17 -2.56 -0.06 0.00 0.10 0.00 0.00 66.02 63.68 2c3p s SER 402 CO 0.75 -0.06 0.70 -0.76 0.98 0.00 0.00 173.24 174.85 2c3p s LEU 403 N -2.07 4.45 0.49 2.42 1.43 -0.37 -4.88 118.68 120.16 2c3p s LEU 403 Ca 0.49 1.35 -0.22 0.00 -1.03 0.00 0.00 54.13 54.73 2c3p s LEU 403 Cb -0.18 -3.11 -0.07 0.00 0.03 0.00 0.00 46.19 42.86 2c3p s LEU 403 CO 0.23 0.07 1.19 -2.16 0.23 0.00 0.00 176.35 175.91 2c3p s PRO 404 N -0.22 3.57 -0.16 1.29 0.04 -1.26 -4.74 135.00 133.52 2c3p s PRO 404 Ca 0.35 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.22 2c3p s PRO 404 Cb -0.20 -2.31 0.03 0.00 0.04 0.00 0.00 34.50 32.06 2c3p s PRO 404 CO 0.21 -0.72 -0.13 0.08 0.04 0.00 0.00 177.00 176.48 2c3p s VAL 405 N -1.54 1.55 -0.61 -0.36 1.01 -1.26 -4.79 120.40 114.40 2c3p s VAL 405 Ca 0.67 -0.70 -0.22 0.00 0.00 0.00 0.00 61.98 61.72 2c3p s VAL 405 Cb -0.30 -1.51 0.07 0.00 0.00 0.00 0.00 36.38 34.64 2c3p s VAL 405 CO 0.36 0.38 0.89 -0.62 0.00 0.00 0.00 175.10 176.10 2c3p s ASP 406 N 1.48 6.21 0.00 3.32 3.68 -1.26 -4.91 116.67 125.19 2c3p s ASP 406 Ca 0.03 -0.93 0.15 0.00 2.13 0.00 0.00 52.55 53.93 2c3p s ASP 406 Cb -0.14 -2.39 0.89 0.00 -1.45 0.00 0.00 42.92 39.83 2c3p s ASP 406 CO -0.10 -1.30 1.37 0.59 0.13 0.00 0.00 175.17 175.86 2c3p n ASN 407 N 7.31 0.00 -0.37 -0.34 3.02 -1.26 -2.37 115.26 121.25 2c3p n ASN 407 Ca -0.04 -0.93 0.12 0.00 -0.03 0.00 0.00 54.58 53.70 2c3p n ASN 407 Cb 0.45 0.00 0.51 0.00 -0.61 0.00 0.00 39.78 40.13 2c3p n ASN 407 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c3p n ALA 408 N -0.83 2.57 -1.62 5.41 0.00 -1.26 -4.91 120.51 119.86 2c3p n ALA 408 Ca 0.11 -0.39 -0.43 0.00 0.00 0.00 0.00 53.44 52.73 2c3p n ALA 408 Cb 0.05 -1.19 -0.00 0.00 0.00 0.00 0.00 19.45 18.31 2c3p n ALA 408 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2c3p n PHE 409 N -0.07 1.48 -2.09 0.00 -0.00 -1.00 -4.89 117.46 110.88 2c3p n PHE 409 Ca 0.17 0.61 -0.37 0.00 -0.00 0.00 0.00 57.45 57.86 2c3p n PHE 409 Cb 0.26 -2.28 0.02 0.00 -0.00 0.00 0.00 39.48 37.48 2c3p n PHE 409 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2c3p s ALA 410 N -1.16 2.74 0.23 3.13 0.00 -1.26 -4.94 121.76 120.49 2c3p s ALA 410 Ca 0.60 1.01 -0.31 0.00 0.00 0.00 0.00 51.96 53.25 2c3p s ALA 410 Cb -0.61 -3.44 -0.11 0.00 0.00 0.00 0.00 23.12 18.96 2c3p s ALA 410 CO 0.59 -0.98 1.65 0.34 0.00 0.00 0.00 175.76 177.36 2c3p s ASP 411 N -1.45 6.42 -0.01 0.00 -1.08 -1.26 -4.90 116.67 114.39 2c3p s ASP 411 Ca 0.72 2.84 0.09 0.00 -0.52 0.00 0.00 52.55 55.68 2c3p s ASP 411 Cb -0.30 -2.61 0.25 0.00 -1.46 0.00 0.00 42.92 38.79 2c3p s ASP 411 CO 0.35 -0.92 1.20 0.35 0.52 0.00 0.00 175.17 176.67 2c3p n THR 412 N 3.43 1.06 -2.07 1.71 -2.24 -1.26 -5.02 114.28 109.89 2c3p n THR 412 Ca 0.13 -1.05 -0.38 0.00 -2.27 0.00 0.00 64.05 60.48 2c3p n THR 412 Cb 0.36 0.46 0.01 0.00 -2.10 0.00 0.00 70.33 69.06 2c3p n THR 412 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2c3p s THR 413 N -1.10 2.70 0.80 4.28 -4.23 -1.26 -4.83 115.64 112.00 2c3p s THR 413 Ca 0.19 0.54 -0.15 0.00 -1.18 0.00 0.00 61.69 61.08 2c3p s THR 413 Cb 0.10 -3.28 -0.03 0.00 1.34 0.00 0.00 72.50 70.63 2c3p s THR 413 CO 0.12 0.01 0.34 -2.65 -0.54 0.00 0.00 174.62 171.90 2c3p n PRO 414 N -0.57 0.10 -1.70 3.99 -0.02 -1.26 -4.84 135.00 130.70 2c3p n PRO 414 Ca 0.08 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 61.21 2c3p n PRO 414 Cb 0.46 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.19 2c3p n PRO 414 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2c3p n LYS 415 N -0.59 2.81 -0.18 -0.52 4.81 -1.26 -2.55 118.16 120.68 2c3p n LYS 415 Ca 0.08 1.02 0.00 0.00 -0.87 0.00 0.00 58.31 58.54 2c3p n LYS 415 Cb 0.51 -2.91 0.00 0.00 0.02 0.00 0.00 35.03 32.65 2c3p n LYS 415 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2c3p n GLY 416 N 4.20 0.91 3.70 3.14 0.00 -1.26 -4.79 105.19 111.08 2c3p n GLY 416 Ca 0.18 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2c3p n GLY 416 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c3p s THR 417 N -2.00 5.03 -0.23 2.61 2.01 -1.06 -4.40 115.64 117.59 2c3p s THR 417 Ca 0.00 1.38 -0.10 0.00 0.31 0.00 0.00 61.69 63.28 2c3p s THR 417 Cb 0.00 -4.02 -0.05 0.00 0.01 0.00 0.00 72.50 68.44 2c3p s THR 417 CO 0.00 0.19 0.15 -0.63 -0.69 0.00 0.00 174.62 173.64 2c3p s ILE 418 N 1.23 5.28 -0.11 1.82 1.01 0.58 -4.95 121.20 126.07 2c3p s ILE 418 Ca 0.35 0.15 -0.00 0.00 0.00 0.00 0.00 60.65 61.15 2c3p s ILE 418 Cb -0.17 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 2c3p s ILE 418 CO 0.15 0.36 -0.09 -1.10 0.00 0.00 0.00 174.94 174.26 2c3p s GLN 419 N 0.96 3.15 0.08 2.79 -0.21 -1.26 -1.44 119.66 123.73 2c3p s GLN 419 Ca 0.07 -0.61 0.05 0.00 0.02 0.00 0.00 55.36 54.89 2c3p s GLN 419 Cb -0.13 -2.65 -0.03 0.00 1.00 0.00 0.00 33.01 31.20 2c3p s GLN 419 CO 0.04 0.40 -0.14 0.00 -2.12 0.00 0.00 175.29 173.47 2c3p s GLN 421 N -1.94 0.63 -0.09 0.00 -0.21 -0.73 -0.97 119.66 116.36 2c3p s GLN 421 Ca -0.00 -0.14 0.02 0.00 0.02 0.00 0.00 55.36 55.26 2c3p s GLN 421 Cb -0.09 -0.65 0.01 0.00 1.00 0.00 0.00 33.01 33.29 2c3p s GLN 421 CO 0.02 0.01 -0.14 -0.06 -2.12 0.00 0.00 175.29 173.00 2c3p s PHE 422 N 0.44 1.75 -0.40 0.91 0.40 -0.24 -1.09 117.98 119.75 2c3p s PHE 422 Ca -0.05 -0.74 -0.13 0.00 -0.60 0.00 0.00 56.93 55.41 2c3p s PHE 422 Cb -0.09 -1.27 0.03 0.00 0.51 0.00 0.00 43.02 42.20 2c3p s PHE 422 CO -0.00 -0.37 0.26 -1.58 0.70 0.00 0.00 175.22 174.23 2c3p s TRP 423 N 0.80 3.25 0.38 0.36 0.52 0.60 0.03 118.94 124.88 2c3p s TRP 423 Ca -0.11 -0.86 0.08 0.00 0.02 0.00 0.00 56.10 55.22 2c3p s TRP 423 Cb -0.16 -2.61 -0.07 0.00 -1.15 0.00 0.00 33.47 29.49 2c3p s TRP 423 CO 0.02 -0.66 0.00 0.20 0.02 0.00 0.00 176.95 176.53 2c3p s GLY 424 N 1.74 2.33 0.05 0.98 0.00 0.98 -0.46 107.32 112.94 2c3p s GLY 424 Ca 0.03 -2.17 0.03 0.00 0.00 0.00 0.00 44.72 42.61 2c3p s GLY 424 CO 0.08 -2.03 0.03 -2.27 0.00 0.00 0.00 173.10 168.91 2c3p s LEU 425 N -3.71 3.62 -0.01 0.66 2.96 -1.26 -0.55 118.68 120.39 2c3p s LEU 425 Ca 0.35 -0.05 -0.38 0.00 -0.22 0.00 0.00 54.13 53.83 2c3p s LEU 425 Cb 0.06 -2.24 -0.17 0.00 0.50 0.00 0.00 46.19 44.33 2c3p s LEU 425 CO 0.18 0.21 1.38 0.61 -1.32 0.00 0.00 176.35 177.41 2c3p n GLY 426 N 0.81 0.40 2.42 7.98 0.00 0.14 -1.76 105.19 115.18 2c3p n GLY 426 Ca -0.11 0.76 -0.18 0.00 0.00 0.00 0.00 46.02 46.49 2c3p n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p n ALA 427 N 2.91 -0.41 0.38 4.61 0.00 -1.26 -4.72 120.51 122.02 2c3p n ALA 427 Ca 0.21 0.21 0.10 0.00 0.00 0.00 0.00 53.44 53.96 2c3p n ALA 427 Cb 0.15 -1.89 0.26 0.00 0.00 0.00 0.00 19.45 17.98 2c3p n ALA 427 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2c3p n ASP 428 N -1.15 2.97 -0.06 0.00 5.68 -0.73 -4.94 116.55 118.32 2c3p n ASP 428 Ca -0.20 -1.95 -0.01 0.00 -0.50 0.00 0.00 54.79 52.14 2c3p n ASP 428 Cb 0.63 -0.30 -0.00 0.00 -1.14 0.00 0.00 41.12 40.30 2c3p n ASP 428 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2c3p n GLY 429 N 1.40 0.40 0.08 6.12 0.00 -1.26 -4.02 105.19 107.90 2c3p n GLY 429 Ca 0.19 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2c3p n GLY 429 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2c3p h THR 430 N 0.00 1.00 -0.56 2.61 2.02 -1.92 -2.14 112.91 113.92 2c3p h THR 430 Ca -0.02 -0.21 0.01 0.00 0.77 0.00 0.00 66.41 66.96 2c3p h THR 430 Cb 0.34 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2c3p h THR 430 CO 0.02 0.05 0.37 0.58 0.37 0.00 0.00 175.52 176.92 2c3p h VAL 431 N -0.18 1.14 -0.60 3.16 2.07 -1.95 -1.71 116.25 118.18 2c3p h VAL 431 Ca -0.01 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 2c3p h VAL 431 Cb 0.16 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 2c3p h VAL 431 CO 0.01 0.14 0.35 1.23 0.02 0.00 0.00 177.57 179.33 2c3p h GLY 432 N 0.76 0.87 2.00 2.17 0.00 -1.95 -1.08 103.07 105.84 2c3p h GLY 432 Ca 0.21 -0.36 -0.15 0.00 0.00 0.00 0.00 47.33 47.03 2c3p h GLY 432 CO -0.05 0.34 -0.71 0.00 0.00 0.00 0.00 176.54 176.13 2c3p h ALA 433 N 1.57 0.79 -0.31 3.60 0.00 -0.92 -1.91 119.26 122.07 2c3p h ALA 433 Ca 0.22 -0.65 -0.16 0.00 0.00 0.00 0.00 54.91 54.32 2c3p h ALA 433 Cb -0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2c3p h ALA 433 CO -0.04 0.89 -0.45 -0.91 0.00 0.00 0.00 179.25 178.74 2c3p h ASN 434 N 0.00 0.92 0.12 0.00 2.35 -0.60 0.16 115.58 118.54 2c3p h ASN 434 Ca -0.01 -0.51 -0.09 0.00 -0.55 0.00 0.00 56.30 55.15 2c3p h ASN 434 Cb 1.29 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 2c3p h ASN 434 CO 0.09 1.25 -0.29 0.11 -1.65 0.00 0.00 177.43 176.94 2c3p h LYS 435 N 0.62 0.27 -0.06 0.81 1.57 -1.17 -0.31 116.57 118.30 2c3p h LYS 435 Ca 0.03 -0.10 -0.23 0.00 -1.87 0.00 0.00 60.65 58.48 2c3p h LYS 435 Cb 1.05 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 33.35 2c3p h LYS 435 CO 0.10 0.55 -0.88 1.96 -0.57 0.00 0.00 179.45 180.61 2c3p h GLN 436 N 0.24 0.59 -0.39 3.15 1.08 -1.13 -2.48 115.11 116.17 2c3p h GLN 436 Ca 0.03 -0.56 -0.07 0.00 -1.45 0.00 0.00 58.65 56.61 2c3p h GLN 436 Cb 0.65 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 28.20 2c3p h GLN 436 CO 0.05 1.18 -0.06 0.00 -0.95 0.00 0.00 178.83 179.05 2c3p h ALA 437 N 0.65 1.18 -0.52 3.87 0.00 -0.26 0.34 119.26 124.51 2c3p h ALA 437 Ca -0.08 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 2c3p h ALA 437 Cb 1.51 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 2c3p h ALA 437 CO 0.17 0.53 -0.13 0.82 0.00 0.00 0.00 179.25 180.64 2c3p h ILE 438 N 0.60 1.27 -0.08 0.00 2.04 -1.01 -1.77 117.51 118.56 2c3p h ILE 438 Ca 0.12 -1.29 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 2c3p h ILE 438 Cb 0.46 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2c3p h ILE 438 CO 0.02 0.45 -0.01 0.11 0.00 0.00 0.00 178.15 178.73 2c3p h LYS 439 N 0.88 0.14 0.09 2.37 6.56 -0.95 -1.28 116.57 124.37 2c3p h LYS 439 Ca 0.13 -0.05 0.01 0.00 -1.06 0.00 0.00 60.65 59.69 2c3p h LYS 439 Cb 0.70 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.33 2c3p h LYS 439 CO 0.05 0.43 -0.16 0.82 -2.06 0.00 0.00 179.45 178.53 2c3p h ILE 440 N -0.16 0.62 -0.67 1.86 2.04 -0.92 -1.20 117.51 119.08 2c3p h ILE 440 Ca 0.02 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 2c3p h ILE 440 Cb 0.37 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2c3p h ILE 440 CO 0.01 0.00 0.24 0.40 0.00 0.00 0.00 178.15 178.80 2c3p h ILE 441 N -0.32 1.24 -0.06 -0.67 2.04 -1.36 -2.52 117.51 115.86 2c3p h ILE 441 Ca 0.03 -0.77 -0.17 0.00 1.00 0.00 0.00 64.86 64.94 2c3p h ILE 441 Cb 0.34 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 2c3p h ILE 441 CO -0.10 0.31 -0.71 1.23 0.00 0.00 0.00 178.15 178.88 2c3p h GLY 442 N 1.05 0.33 1.82 5.37 0.00 -1.03 -2.63 103.07 107.98 2c3p h GLY 442 Ca 0.22 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2c3p h GLY 442 CO -0.02 0.41 -0.13 1.22 0.00 0.00 0.00 176.54 178.02 2c3p n ASP 443 N -3.82 0.79 -0.04 0.19 10.43 -0.47 -4.02 116.55 119.62 2c3p n ASP 443 Ca -0.03 0.48 0.05 0.00 2.57 0.00 0.00 54.79 57.85 2c3p n ASP 443 Cb 0.69 -0.59 0.06 0.00 1.84 0.00 0.00 41.12 43.12 2c3p n ASP 443 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2c3p n ASN 444 N -2.23 2.11 -3.42 -2.24 3.02 -0.96 -5.05 115.26 106.49 2c3p n ASN 444 Ca 0.05 -2.48 -0.14 0.00 -0.03 0.00 0.00 54.58 51.99 2c3p n ASN 444 Cb 0.43 -0.20 -0.05 0.00 -0.61 0.00 0.00 39.78 39.36 2c3p n ASN 444 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2c3p s THR 445 N -1.82 0.00 -2.63 3.41 -4.23 -1.00 -5.02 115.64 104.35 2c3p s THR 445 Ca 0.14 -1.59 0.23 0.00 -1.18 0.00 0.00 61.69 59.30 2c3p s THR 445 Cb 0.13 -2.56 0.34 0.00 1.34 0.00 0.00 72.50 71.75 2c3p s THR 445 CO 0.01 0.00 1.35 0.47 -0.54 0.00 0.00 174.62 175.91 2c3p n ASP 446 N -1.17 3.31 -4.77 3.99 10.43 -1.26 -4.83 116.55 122.25 2c3p n ASP 446 Ca 0.01 -1.99 -0.37 0.00 2.57 0.00 0.00 54.79 55.01 2c3p n ASP 446 Cb 0.62 -0.17 -0.00 0.00 1.84 0.00 0.00 41.12 43.41 2c3p n ASP 446 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2c3p s LEU 447 N -1.65 3.95 0.15 0.64 1.43 -1.26 -4.91 118.68 117.03 2c3p s LEU 447 Ca 0.35 2.30 -0.15 0.00 -1.03 0.00 0.00 54.13 55.61 2c3p s LEU 447 Cb 0.22 -4.31 -0.07 0.00 0.03 0.00 0.00 46.19 42.05 2c3p s LEU 447 CO 0.31 -1.02 0.56 -0.36 0.23 0.00 0.00 176.35 176.08 2c3p s PHE 448 N -1.58 3.61 0.04 0.29 0.40 0.14 -4.79 117.98 116.09 2c3p s PHE 448 Ca 0.66 1.09 0.05 0.00 -0.60 0.00 0.00 56.93 58.12 2c3p s PHE 448 Cb -0.28 -2.39 -0.02 0.00 0.51 0.00 0.00 43.02 40.84 2c3p s PHE 448 CO 0.34 0.42 -0.14 0.00 0.70 0.00 0.00 175.22 176.55 2c3p s ALA 449 N -1.46 1.12 -0.00 5.36 0.00 -1.26 -1.31 121.76 124.21 2c3p s ALA 449 Ca 0.38 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.55 2c3p s ALA 449 Cb -0.15 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.80 2c3p s ALA 449 CO 0.19 0.21 -0.00 -1.14 0.00 0.00 0.00 175.76 175.02 2c3p s GLN 450 N -1.09 0.04 0.00 0.00 0.74 0.21 -2.48 119.66 117.08 2c3p s GLN 450 Ca 0.01 0.01 0.01 0.00 0.05 0.00 0.00 55.36 55.44 2c3p s GLN 450 Cb -0.08 -0.08 -0.00 0.00 1.10 0.00 0.00 33.01 33.95 2c3p s GLN 450 CO 0.01 -0.02 -0.02 0.20 -0.55 0.00 0.00 175.29 174.91 2c3p s GLY 451 N 0.15 0.12 -0.08 2.59 0.00 0.04 -1.07 107.32 109.08 2c3p s GLY 451 Ca -0.01 -0.17 -0.11 0.00 0.00 0.00 0.00 44.72 44.42 2c3p s GLY 451 CO -0.00 -0.18 0.29 -0.47 0.00 0.00 0.00 173.10 172.74 2c3p s TYR 452 N -0.30 -0.26 -0.06 1.90 5.04 -0.34 0.16 117.35 123.49 2c3p s TYR 452 Ca -0.02 0.58 0.03 0.00 -2.44 0.00 0.00 57.07 55.22 2c3p s TYR 452 Cb -0.02 0.09 0.01 0.00 0.35 0.00 0.00 41.96 42.39 2c3p s TYR 452 CO -0.00 -0.23 -0.13 -0.06 -1.34 0.00 0.00 175.55 173.78 2c3p s PHE 453 N -0.38 1.48 -0.19 4.97 0.40 -1.26 -1.02 117.98 121.98 2c3p s PHE 453 Ca -0.05 -0.50 -0.09 0.00 -0.60 0.00 0.00 56.93 55.68 2c3p s PHE 453 Cb -0.03 -1.06 -0.05 0.00 0.51 0.00 0.00 43.02 42.39 2c3p s PHE 453 CO 0.02 -0.24 0.11 -1.12 0.70 0.00 0.00 175.22 174.69 2c3p s SER 454 N 0.46 6.08 0.33 1.36 0.01 -0.09 -4.97 113.70 116.88 2c3p s SER 454 Ca -0.11 0.20 0.02 0.00 1.31 0.00 0.00 55.95 57.37 2c3p s SER 454 Cb -0.14 -2.06 0.02 0.00 0.21 0.00 0.00 66.02 64.05 2c3p s SER 454 CO 0.03 0.19 0.19 -1.22 0.41 0.00 0.00 173.24 172.84 2c3p n TYR 455 N 3.47 -0.54 -4.10 2.43 4.02 -1.26 -1.31 117.16 119.87 2c3p n TYR 455 Ca -0.16 -1.46 -0.30 0.00 -0.01 0.00 0.00 57.90 55.97 2c3p n TYR 455 Cb 0.52 -0.26 -0.07 0.00 -0.02 0.00 0.00 39.34 39.51 2c3p n TYR 455 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2c3p s ASP 456 N -2.92 5.24 0.52 7.72 3.68 -1.17 -4.92 116.67 124.82 2c3p s ASP 456 Ca 0.14 -0.12 0.31 0.00 2.13 0.00 0.00 52.55 55.02 2c3p s ASP 456 Cb -0.01 -1.31 1.16 0.00 -1.45 0.00 0.00 42.92 41.31 2c3p s ASP 456 CO 0.09 0.16 1.91 0.28 0.13 0.00 0.00 175.17 177.74 2c3p h SER 457 N 3.30 0.00 -3.41 -0.34 0.02 -1.96 -3.42 113.55 107.74 2c3p h SER 457 Ca -0.47 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 59.95 2c3p h SER 457 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2c3p h SER 457 CO 0.62 0.00 0.51 -0.54 -1.14 0.00 0.00 176.83 176.29 2c3p s LYS 458 N -3.57 4.52 0.28 3.45 -0.14 -1.26 -4.94 119.74 118.08 2c3p s LYS 458 Ca 0.02 1.74 0.24 0.00 -1.36 0.00 0.00 55.97 56.61 2c3p s LYS 458 Cb 0.08 -3.31 0.36 0.00 -1.68 0.00 0.00 37.83 33.28 2c3p s LYS 458 CO 0.56 -0.08 1.46 0.87 -0.76 0.00 0.00 175.35 177.40 2c3p h LYS 459 N 5.85 0.00 -3.99 1.68 1.57 -1.81 -3.39 116.57 116.48 2c3p h LYS 459 Ca -0.43 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 57.96 2c3p h LYS 459 Cb 1.21 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 33.19 2c3p h LYS 459 CO 0.76 0.00 -0.77 0.45 -0.57 0.00 0.00 179.45 179.32 2c3p s SER 460 N -5.30 0.80 -1.17 0.86 0.15 -1.26 -4.74 113.70 103.04 2c3p s SER 460 Ca 0.06 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.60 2c3p s SER 460 Cb 0.09 -0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2c3p s SER 460 CO 0.69 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.69 2c3p n GLY 461 N 3.96 0.74 3.81 9.45 0.00 -1.26 -4.98 105.19 116.91 2c3p n GLY 461 Ca -0.25 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 2c3p n GLY 461 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c3p s GLY 462 N -2.71 1.65 -0.11 -0.02 0.00 -1.26 -4.56 107.32 100.31 2c3p s GLY 462 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 44.72 44.63 2c3p s GLY 462 CO 0.00 0.33 0.09 -0.26 0.00 0.00 0.00 173.10 173.26 2c3p s ILE 463 N -3.09 5.11 0.10 0.90 -4.36 -1.26 0.27 121.20 118.87 2c3p s ILE 463 Ca 0.59 0.06 0.10 0.00 -0.26 0.00 0.00 60.65 61.14 2c3p s ILE 463 Cb -0.14 -3.20 -0.04 0.00 1.25 0.00 0.00 42.46 40.33 2c3p s ILE 463 CO 0.55 0.61 -0.23 -0.89 0.24 0.00 0.00 174.94 175.22 2c3p s THR 464 N -0.95 2.49 -0.10 8.37 2.01 0.28 -3.03 115.64 124.71 2c3p s THR 464 Ca 0.14 -1.55 -0.01 0.00 0.31 0.00 0.00 61.69 60.58 2c3p s THR 464 Cb -0.12 -2.09 0.03 0.00 0.01 0.00 0.00 72.50 70.34 2c3p s THR 464 CO 0.03 0.17 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.49 2c3p s ILE 465 N -1.03 0.57 -0.11 1.82 1.01 -0.43 -0.02 121.20 123.01 2c3p s ILE 465 Ca 0.15 -0.11 -0.12 0.00 0.00 0.00 0.00 60.65 60.57 2c3p s ILE 465 Cb -0.10 -0.76 -0.05 0.00 0.01 0.00 0.00 42.46 41.56 2c3p s ILE 465 CO 0.07 0.20 0.26 -0.44 0.00 0.00 0.00 174.94 175.03 2c3p s SER 466 N 1.88 6.49 -0.23 3.58 0.01 0.10 -0.91 113.70 124.63 2c3p s SER 466 Ca 0.04 0.58 0.01 0.00 1.31 0.00 0.00 55.95 57.89 2c3p s SER 466 Cb -0.13 -2.16 0.04 0.00 0.21 0.00 0.00 66.02 63.98 2c3p s SER 466 CO -0.06 0.25 -0.13 -1.00 0.41 0.00 0.00 173.24 172.70 2c3p s HIS 467 N -0.33 3.06 0.06 2.43 3.76 -0.19 -1.08 115.29 123.01 2c3p s HIS 467 Ca 0.17 -1.94 0.08 0.00 -0.15 0.00 0.00 55.06 53.22 2c3p s HIS 467 Cb -0.13 -1.95 -0.03 0.00 1.11 0.00 0.00 32.58 31.57 2c3p s HIS 467 CO 0.06 -0.83 -0.23 -0.51 -0.85 0.00 0.00 174.74 172.38 2c3p s LEU 468 N 1.21 2.21 -0.00 0.89 1.43 -0.14 -1.20 118.68 123.07 2c3p s LEU 468 Ca -0.02 -0.60 0.01 0.00 -1.03 0.00 0.00 54.13 52.49 2c3p s LEU 468 Cb -0.17 -1.06 0.00 0.00 0.03 0.00 0.00 46.19 44.99 2c3p s LEU 468 CO -0.08 0.17 -0.02 -0.13 0.23 0.00 0.00 176.35 176.52 2c3p s ARG 469 N -1.43 0.20 -0.02 1.70 0.52 -0.23 0.42 118.95 120.11 2c3p s ARG 469 Ca 0.09 -0.07 0.02 0.00 -0.52 0.00 0.00 55.73 55.25 2c3p s ARG 469 Cb -0.09 -0.21 0.00 0.00 0.52 0.00 0.00 34.95 35.16 2c3p s ARG 469 CO 0.03 0.03 -0.07 -0.06 0.02 0.00 0.00 175.30 175.25 2c3p s PHE 470 N 0.05 0.75 0.12 -0.53 0.40 -0.52 -0.62 117.98 117.63 2c3p s PHE 470 Ca -0.00 -0.17 -0.25 0.00 -0.60 0.00 0.00 56.93 55.91 2c3p s PHE 470 Cb -0.02 -0.54 0.07 0.00 0.51 0.00 0.00 43.02 43.04 2c3p s PHE 470 CO -0.00 -0.07 0.80 0.20 0.70 0.00 0.00 175.22 176.85 2c3p s GLY 471 N 0.13 -0.40 0.23 4.36 0.00 -0.42 -0.31 107.32 110.91 2c3p s GLY 471 Ca -0.02 0.47 0.25 0.00 0.00 0.00 0.00 44.72 45.42 2c3p s GLY 471 CO 0.00 0.15 1.63 0.83 0.00 0.00 0.00 173.10 175.71 2c3p h GLU 472 N 2.00 0.00 -6.49 2.90 5.08 -1.87 0.39 114.58 116.60 2c3p h GLU 472 Ca -0.25 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.47 2c3p h GLU 472 Cb 1.26 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.36 2c3p h GLU 472 CO 0.30 0.00 -0.72 0.15 -1.00 0.00 0.00 179.01 177.74 2c3p s LYS 473 N -3.14 2.11 0.22 2.33 -0.14 -1.26 -4.81 119.74 115.05 2c3p s LYS 473 Ca 0.09 -1.16 -0.31 0.00 -1.36 0.00 0.00 55.97 53.23 2c3p s LYS 473 Cb 0.11 -2.23 -0.15 0.00 -1.68 0.00 0.00 37.83 33.88 2c3p s LYS 473 CO 0.64 0.47 1.15 -2.30 -0.76 0.00 0.00 175.35 174.55 2c3p n PRO 474 N 0.30 1.35 -3.24 -1.68 -0.02 -1.26 -4.73 135.00 125.72 2c3p n PRO 474 Ca -0.12 0.48 -0.44 0.00 -2.02 0.00 0.00 63.50 61.41 2c3p n PRO 474 Cb 0.54 -1.96 -0.07 0.00 -0.02 0.00 0.00 33.50 31.99 2c3p n PRO 474 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2c3p s ILE 475 N -0.43 4.99 -1.81 4.25 1.01 -1.26 -4.89 121.20 123.06 2c3p s ILE 475 Ca 0.68 -0.51 0.22 0.00 0.00 0.00 0.00 60.65 61.04 2c3p s ILE 475 Cb -0.77 -4.19 0.65 0.00 0.01 0.00 0.00 42.46 38.16 2c3p s ILE 475 CO 0.54 -0.65 1.55 0.00 0.00 0.00 0.00 174.94 176.38 2c3p n GLN 476 N 5.86 2.90 -2.35 2.79 6.02 -1.26 -4.89 117.38 126.46 2c3p n GLN 476 Ca -0.07 -2.70 -0.35 0.00 -0.01 0.00 0.00 57.00 53.87 2c3p n GLN 476 Cb 0.46 -1.62 -0.04 0.00 1.02 0.00 0.00 30.24 30.06 2c3p n GLN 476 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2c3p s SER 477 N -0.99 5.96 -1.20 1.08 0.01 -1.26 -2.98 113.70 114.33 2c3p s SER 477 Ca 0.49 -1.38 -0.04 0.00 1.31 0.00 0.00 55.95 56.33 2c3p s SER 477 Cb 0.27 -2.57 0.21 0.00 0.21 0.00 0.00 66.02 64.13 2c3p s SER 477 CO 0.32 -2.02 2.10 0.35 0.41 0.00 0.00 173.24 174.40 2c3p n THR 478 N 7.23 5.51 -3.56 1.44 -2.24 -1.26 -4.84 114.28 116.56 2c3p n THR 478 Ca 0.39 -5.02 -0.10 0.00 -2.27 0.00 0.00 64.05 57.05 2c3p n THR 478 Cb 0.48 -1.90 -0.02 0.00 -2.10 0.00 0.00 70.33 66.79 2c3p n THR 478 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2c3p s TYR 479 N -2.29 -0.43 0.90 4.78 -0.85 -1.26 -4.74 117.35 113.46 2c3p s TYR 479 Ca 0.46 0.14 -0.11 0.00 -0.52 0.00 0.00 57.07 57.04 2c3p s TYR 479 Cb 0.17 0.61 0.13 0.00 0.38 0.00 0.00 41.96 43.25 2c3p s TYR 479 CO -0.09 -0.97 1.09 -0.51 -1.52 0.00 0.00 175.55 173.55 2c3p s LEU 480 N -2.80 2.34 0.07 -3.49 1.43 -1.26 -4.98 118.68 109.99 2c3p s LEU 480 Ca 0.04 1.65 -0.30 0.00 -1.03 0.00 0.00 54.13 54.49 2c3p s LEU 480 Cb -0.03 -4.07 -0.05 0.00 0.03 0.00 0.00 46.19 42.08 2c3p s LEU 480 CO -0.07 -2.75 1.03 -0.69 0.23 0.00 0.00 176.35 174.11 2c3p s VAL 481 N -2.84 4.45 0.00 -1.59 1.01 -1.26 -4.91 120.40 115.26 2c3p s VAL 481 Ca 0.64 1.89 0.00 0.00 0.00 0.00 0.00 61.98 64.51 2c3p s VAL 481 Cb -0.19 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 31.98 2c3p s VAL 481 CO 0.58 0.22 0.04 -0.46 0.00 0.00 0.00 175.10 175.47 2c3p n ASN 482 N 3.32 0.07 -3.48 3.32 0.23 -1.26 -4.85 115.26 112.60 2c3p n ASN 482 Ca 0.05 -0.47 -0.27 0.00 -0.53 0.00 0.00 54.58 53.36 2c3p n ASN 482 Cb 0.49 0.76 -0.11 0.00 -2.08 0.00 0.00 39.78 38.84 2c3p n ASN 482 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2c3p s ARG 483 N -0.76 1.12 0.27 -3.83 0.52 -1.26 -4.23 118.95 110.79 2c3p s ARG 483 Ca 0.00 -2.23 -0.19 0.00 -0.52 0.00 0.00 55.73 52.79 2c3p s ARG 483 Cb 0.00 -1.74 -0.09 0.00 0.52 0.00 0.00 34.95 33.65 2c3p s ARG 483 CO 0.00 -1.35 0.77 0.00 0.02 0.00 0.00 175.30 174.74 2c3p s ALA 484 N -0.07 3.34 -0.01 2.13 0.00 -1.25 -4.69 121.76 121.21 2c3p s ALA 484 Ca 0.30 0.19 -0.02 0.00 0.00 0.00 0.00 51.96 52.43 2c3p s ALA 484 Cb -0.01 -2.87 -0.27 0.00 0.00 0.00 0.00 23.12 19.98 2c3p s ALA 484 CO -0.17 0.30 0.78 -0.44 0.00 0.00 0.00 175.76 176.23 2c3p h ASP 485 N 2.99 0.35 -3.40 0.00 5.19 -1.28 -1.45 116.42 118.82 2c3p h ASP 485 Ca -0.48 -0.53 -0.56 0.00 -0.62 0.00 0.00 57.03 54.85 2c3p h ASP 485 Cb 1.19 -0.11 -0.33 0.00 0.18 0.00 0.00 39.33 40.25 2c3p h ASP 485 CO 0.65 1.45 -0.83 -0.47 -3.12 0.00 0.00 179.24 176.91 2c3p s TYR 486 N -2.61 1.74 -0.06 4.55 5.04 -0.94 -0.75 117.35 124.33 2c3p s TYR 486 Ca -0.10 -0.67 0.01 0.00 -2.44 0.00 0.00 57.07 53.88 2c3p s TYR 486 Cb 0.07 -1.23 0.02 0.00 0.35 0.00 0.00 41.96 41.16 2c3p s TYR 486 CO 0.84 -0.31 -0.08 0.08 -1.34 0.00 0.00 175.55 174.74 2c3p s VAL 487 N 0.58 0.79 -0.06 3.14 1.01 -0.26 -1.77 120.40 123.83 2c3p s VAL 487 Ca -0.16 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 61.59 2c3p s VAL 487 Cb -0.16 -0.77 0.01 0.00 0.00 0.00 0.00 36.38 35.45 2c3p s VAL 487 CO 0.05 0.28 -0.16 0.00 0.00 0.00 0.00 175.10 175.28 2c3p s ALA 488 N 0.87 1.48 -0.31 5.51 0.00 -0.25 -1.04 121.76 128.02 2c3p s ALA 488 Ca -0.12 -0.58 -0.03 0.00 0.00 0.00 0.00 51.96 51.24 2c3p s ALA 488 Cb -0.15 -0.59 0.05 0.00 0.00 0.00 0.00 23.12 22.44 2c3p s ALA 488 CO 0.01 0.19 0.03 0.00 0.00 0.00 0.00 175.76 175.99 2c3p n HIS 490 N 4.65 0.00 -3.90 0.00 8.25 0.39 -1.60 115.22 123.00 2c3p n HIS 490 Ca -0.12 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.04 2c3p n HIS 490 Cb 0.43 -0.12 -0.16 0.00 1.12 0.00 0.00 29.99 31.27 2c3p n HIS 490 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2c3p s ASN 491 N -2.37 3.44 0.65 0.41 3.84 -1.25 -4.77 114.94 114.89 2c3p s ASN 491 Ca 0.30 -0.98 0.42 0.00 0.21 0.00 0.00 52.86 52.81 2c3p s ASN 491 Cb 0.20 -1.04 2.31 0.00 -0.55 0.00 0.00 41.25 42.18 2c3p s ASN 491 CO 0.46 -0.22 2.34 1.55 -2.79 0.00 0.00 177.10 178.44 2c3p h PRO 492 N 8.04 0.00 -0.11 0.43 0.13 -1.82 -1.85 132.00 136.82 2c3p h PRO 492 Ca -0.20 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.90 2c3p h PRO 492 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 2c3p h PRO 492 CO 0.41 0.00 -0.09 0.00 -0.23 0.00 0.00 178.00 178.09 2c3p h ALA 493 N 2.00 1.66 -0.66 -0.56 0.00 -1.94 -2.89 119.26 116.86 2c3p h ALA 493 Ca -0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2c3p h ALA 493 Cb 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2c3p h ALA 493 CO 0.00 0.25 0.26 1.88 0.00 0.00 0.00 179.25 181.64 2c3p h TYR 494 N 0.16 0.98 -0.62 0.00 0.99 -1.75 -3.31 116.97 113.41 2c3p h TYR 494 Ca 0.03 -0.06 0.10 0.00 2.00 0.00 0.00 58.73 60.80 2c3p h TYR 494 Cb 0.26 -0.30 -0.10 0.00 1.00 0.00 0.00 36.73 37.59 2c3p h TYR 494 CO 0.00 0.75 -0.25 0.28 -0.00 0.00 0.00 178.16 178.95 2c3p n VAL 495 N -4.30 -0.33 0.11 -2.88 0.31 -1.09 -1.08 118.33 109.07 2c3p n VAL 495 Ca 0.06 1.46 0.01 0.00 -0.01 0.00 0.00 64.34 65.86 2c3p n VAL 495 Cb 0.17 -1.93 -0.01 0.00 -0.91 0.00 0.00 33.84 31.17 2c3p n VAL 495 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2c3p h GLY 496 N 0.00 0.00 0.46 2.92 0.00 -1.79 -3.40 103.07 101.26 2c3p h GLY 496 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.18 2c3p h GLY 496 CO -0.62 0.00 -2.11 0.29 0.00 0.00 0.00 176.54 174.10 2c3p n ILE 497 N -3.18 1.64 -4.20 2.60 -5.35 -0.24 -4.99 119.36 105.65 2c3p n ILE 497 Ca -0.00 -0.68 -0.31 0.00 -0.27 0.00 0.00 62.75 61.49 2c3p n ILE 497 Cb 0.78 -1.41 -0.08 0.00 -1.74 0.00 0.00 39.64 37.19 2c3p n ILE 497 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2c3p s TYR 498 N -2.55 3.01 -1.08 4.28 1.51 -0.55 -5.01 117.35 116.96 2c3p s TYR 498 Ca -0.21 0.01 -0.20 0.00 -1.01 0.00 0.00 57.07 55.66 2c3p s TYR 498 Cb 0.07 -1.58 -0.07 0.00 -0.11 0.00 0.00 41.96 40.27 2c3p s TYR 498 CO 0.74 0.47 1.97 -3.47 -1.11 0.00 0.00 175.55 174.15 2c3p n ASP 499 N 0.88 3.25 0.18 2.29 2.03 -1.26 -4.74 116.55 119.17 2c3p n ASP 499 Ca -0.12 -2.75 0.02 0.00 0.52 0.00 0.00 54.79 52.46 2c3p n ASP 499 Cb 0.52 -1.45 0.34 0.00 -0.72 0.00 0.00 41.12 39.81 2c3p n ASP 499 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 2c3p h ILE 500 N 4.85 1.28 -0.43 5.18 3.07 -1.90 -3.14 117.51 126.43 2c3p h ILE 500 Ca 0.42 -1.35 0.00 0.00 1.55 0.00 0.00 64.86 65.48 2c3p h ILE 500 Cb 0.74 1.72 0.00 0.00 -0.27 0.00 0.00 36.82 39.01 2c3p h ILE 500 CO 1.73 0.39 0.00 0.18 -1.05 0.00 0.00 178.15 179.40 2c3p n LEU 501 N -4.07 2.80 -4.57 0.16 4.77 -1.26 -4.95 117.00 109.88 2c3p n LEU 501 Ca -0.02 -1.31 -0.52 0.00 -0.03 0.00 0.00 56.01 54.13 2c3p n LEU 501 Cb 0.42 -0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 41.18 2c3p n LEU 501 CO 0.39 0.66 0.80 1.21 -1.33 0.00 0.00 177.39 179.12 2c3p n GLU 502 N 1.04 0.98 -0.65 3.23 2.13 -1.19 -1.46 120.64 124.72 2c3p n GLU 502 Ca 0.18 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.35 2c3p n GLU 502 Cb 0.47 -1.93 0.00 0.00 0.27 0.00 0.00 31.44 30.25 2c3p n GLU 502 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2c3p n GLY 503 N 2.27 0.09 3.72 8.31 0.00 -1.26 -4.79 105.19 113.54 2c3p n GLY 503 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2c3p n GLY 503 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2c3p n ILE 504 N -2.02 1.53 -0.75 -0.61 3.06 -0.54 -3.76 119.36 116.27 2c3p n ILE 504 Ca 0.00 -0.38 -0.31 0.00 -2.50 0.00 0.00 62.75 59.56 2c3p n ILE 504 Cb 0.10 -1.76 0.17 0.00 0.54 0.00 0.00 39.64 38.69 2c3p n ILE 504 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 2c3p s LYS 505 N -1.27 0.90 0.27 9.51 1.02 -0.54 -4.87 119.74 124.75 2c3p s LYS 505 Ca 0.60 1.40 -0.29 0.00 0.02 0.00 0.00 55.97 57.69 2c3p s LYS 505 Cb -0.54 -1.72 -0.09 0.00 -0.52 0.00 0.00 37.83 34.95 2c3p s LYS 505 CO 0.56 -2.67 1.14 -0.51 -0.92 0.00 0.00 175.35 172.96 2c3p s ASP 506 N -2.75 7.18 0.00 2.83 -0.00 -1.26 -2.24 116.67 120.43 2c3p s ASP 506 Ca 0.66 2.32 0.00 0.00 -0.00 0.00 0.00 52.55 55.53 2c3p s ASP 506 Cb -0.22 -2.63 0.00 0.00 -0.00 0.00 0.00 42.92 40.07 2c3p s ASP 506 CO 0.59 -0.23 0.00 0.61 -0.00 0.00 0.00 175.17 176.14 2c3p n GLY 507 N 1.29 0.72 3.72 0.21 0.00 0.11 -4.99 105.19 106.24 2c3p n GLY 507 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2c3p n GLY 507 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c3p s GLY 508 N -2.00 1.64 -0.15 -0.02 0.00 -0.95 -4.37 107.32 101.47 2c3p s GLY 508 Ca 0.00 0.13 -0.15 0.00 0.00 0.00 0.00 44.72 44.70 2c3p s GLY 508 CO 0.00 0.57 0.34 -1.59 0.00 0.00 0.00 173.10 172.43 2c3p s THR 509 N -2.86 5.27 -0.27 0.90 2.01 0.07 -0.96 115.64 119.80 2c3p s THR 509 Ca 0.63 0.65 0.03 0.00 0.31 0.00 0.00 61.69 63.31 2c3p s THR 509 Cb -0.19 -3.68 0.06 0.00 0.01 0.00 0.00 72.50 68.71 2c3p s THR 509 CO 0.57 0.36 -0.09 0.12 -0.69 0.00 0.00 174.62 174.90 2c3p s PHE 510 N 0.58 3.21 -0.15 4.92 5.36 -0.76 -1.11 117.98 130.02 2c3p s PHE 510 Ca 0.19 -2.33 -0.08 0.00 -0.96 0.00 0.00 56.93 53.75 2c3p s PHE 510 Cb -0.14 -1.99 -0.04 0.00 -0.34 0.00 0.00 43.02 40.51 2c3p s PHE 510 CO 0.06 -0.87 0.12 0.08 -1.46 0.00 0.00 175.22 173.14 2c3p s VAL 511 N 1.12 5.32 -0.02 3.12 1.01 -0.20 -1.11 120.40 129.64 2c3p s VAL 511 Ca -0.06 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.09 2c3p s VAL 511 Cb -0.20 -3.36 -0.00 0.00 0.00 0.00 0.00 36.38 32.83 2c3p s VAL 511 CO -0.06 0.55 -0.11 -0.22 0.00 0.00 0.00 175.10 175.26 2c3p s LEU 512 N -0.44 1.86 -0.30 3.92 2.96 -0.48 -1.59 118.68 124.60 2c3p s LEU 512 Ca 0.11 -0.22 -0.16 0.00 -0.22 0.00 0.00 54.13 53.65 2c3p s LEU 512 Cb -0.12 -0.62 -0.02 0.00 0.50 0.00 0.00 46.19 45.93 2c3p s LEU 512 CO 0.02 0.10 0.41 0.21 -1.32 0.00 0.00 176.35 175.76 2c3p s ASN 513 N 0.06 6.26 -0.04 3.68 3.04 -0.63 -1.01 114.94 126.30 2c3p s ASN 513 Ca -0.01 0.10 -0.30 0.00 0.04 0.00 0.00 52.86 52.69 2c3p s ASN 513 Cb -0.08 -2.22 0.11 0.00 -1.54 0.00 0.00 41.25 37.52 2c3p s ASN 513 CO 0.00 -0.29 1.04 -0.94 -3.04 0.00 0.00 177.10 173.87 2c3p s SER 514 N 1.68 -0.24 -0.06 -4.21 1.04 -1.08 -3.23 113.70 107.61 2c3p s SER 514 Ca 0.15 -0.07 0.17 0.00 0.48 0.00 0.00 55.95 56.68 2c3p s SER 514 Cb -0.16 0.30 0.59 0.00 0.10 0.00 0.00 66.02 66.85 2c3p s SER 514 CO 0.11 -0.50 1.48 -0.81 0.98 0.00 0.00 173.24 174.50 2c3p n PRO 515 N -0.25 3.00 -1.85 4.02 -0.04 -1.26 -2.88 135.00 135.74 2c3p n PRO 515 Ca -0.05 -2.35 -0.40 0.00 -0.04 0.00 0.00 63.50 60.65 2c3p n PRO 515 Cb 0.61 -1.68 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 2c3p n PRO 515 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2c3p n TRP 516 N 1.07 2.57 -0.23 0.54 8.01 -1.26 -4.71 117.44 123.43 2c3p n TRP 516 Ca 0.21 -2.88 -0.07 0.00 -1.31 0.00 0.00 57.50 53.46 2c3p n TRP 516 Cb 0.68 -1.98 0.04 0.00 -2.01 0.00 0.00 31.31 28.04 2c3p n TRP 516 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.69 177.45 2c3p h SER 517 N 4.69 0.86 -3.80 -0.99 0.02 -1.96 -3.35 113.55 109.02 2c3p h SER 517 Ca 0.74 -0.15 -0.49 0.00 -0.84 0.00 0.00 61.79 61.05 2c3p h SER 517 Cb 0.30 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2c3p h SER 517 CO 1.55 0.77 0.39 -0.94 -1.14 0.00 0.00 176.83 177.46 2c3p s SER 518 N -6.09 7.42 0.41 3.07 1.04 -1.26 -4.91 113.70 113.38 2c3p s SER 518 Ca -0.13 2.05 0.15 0.00 0.48 0.00 0.00 55.95 58.50 2c3p s SER 518 Cb 0.13 -2.61 1.02 0.00 0.10 0.00 0.00 66.02 64.67 2c3p s SER 518 CO 0.80 -0.02 1.88 0.25 0.98 0.00 0.00 173.24 177.13 2c3p h LEU 519 N 3.79 0.45 -0.27 2.42 5.85 -1.96 0.12 115.31 125.71 2c3p h LEU 519 Ca -0.46 0.04 -0.18 0.00 0.84 0.00 0.00 57.88 58.11 2c3p h LEU 519 Cb 1.20 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.18 2c3p h LEU 519 CO 0.67 0.21 -0.55 1.05 -0.34 0.00 0.00 178.44 179.48 2c3p h GLU 520 N 0.46 0.85 -0.33 1.25 4.11 -1.95 -0.01 114.58 118.97 2c3p h GLU 520 Ca 0.43 -0.55 -0.02 0.00 0.07 0.00 0.00 59.36 59.29 2c3p h GLU 520 Cb 0.98 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 2c3p h GLU 520 CO -0.16 1.18 0.15 -0.44 0.07 0.00 0.00 179.01 179.81 2c3p h ASP 521 N 0.62 0.44 0.54 3.06 3.32 -1.29 -0.91 116.42 122.21 2c3p h ASP 521 Ca 0.01 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 2c3p h ASP 521 Cb 1.16 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2c3p h ASP 521 CO 0.12 0.46 -0.29 -0.03 -1.72 0.00 0.00 179.24 177.79 2c3p h MET 522 N 0.39 -0.74 -0.80 3.56 4.05 -0.80 -1.74 114.93 118.85 2c3p h MET 522 Ca 0.11 0.05 0.23 0.00 -0.28 0.00 0.00 59.70 59.81 2c3p h MET 522 Cb 0.15 0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 31.09 2c3p h MET 522 CO -0.01 -0.49 0.62 -0.44 0.23 0.00 0.00 176.91 176.81 2c3p h ASP 523 N -0.77 0.00 0.76 1.39 3.45 -0.88 0.27 116.42 120.64 2c3p h ASP 523 Ca -0.07 0.00 -0.19 0.00 0.43 0.00 0.00 57.03 57.20 2c3p h ASP 523 Cb 0.61 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.36 2c3p h ASP 523 CO 0.10 0.00 -0.89 0.50 -1.57 0.00 0.00 179.24 177.38 2c3p h LYS 524 N 0.00 0.08 0.00 3.56 3.64 -0.32 -3.39 116.57 120.14 2c3p h LYS 524 Ca 0.38 -0.09 -0.28 0.00 -1.27 0.00 0.00 60.65 59.39 2c3p h LYS 524 Cb 1.61 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 33.41 2c3p h LYS 524 CO -0.00 0.91 -2.03 0.72 -2.27 0.00 0.00 179.45 176.77 2c3p n HIS 525 N -3.56 0.00 -1.68 1.91 8.25 -0.08 -4.96 115.22 115.09 2c3p n HIS 525 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 2c3p n HIS 525 Cb 0.83 -0.69 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 2c3p n HIS 525 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2c3p s LEU 526 N -6.19 4.22 0.72 2.41 2.96 0.75 -4.85 118.68 118.70 2c3p s LEU 526 Ca -0.25 2.48 -0.16 0.00 -0.22 0.00 0.00 54.13 55.98 2c3p s LEU 526 Cb 0.07 -3.53 0.02 0.00 0.50 0.00 0.00 46.19 43.25 2c3p s LEU 526 CO 0.41 -1.23 1.10 -2.65 -1.32 0.00 0.00 176.35 172.65 2c3p n PRO 527 N 7.77 0.59 -0.12 0.98 -0.02 -1.26 -4.81 135.00 138.13 2c3p n PRO 527 Ca 0.22 0.26 -0.05 0.00 -2.02 0.00 0.00 63.50 61.91 2c3p n PRO 527 Cb 0.42 -2.34 0.03 0.00 -0.02 0.00 0.00 33.50 31.59 2c3p n PRO 527 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2c3p h SER 528 N -0.18 -0.04 -0.84 2.55 4.64 -1.92 -2.53 113.55 115.24 2c3p h SER 528 Ca -0.48 0.07 0.18 0.00 -0.47 0.00 0.00 61.79 61.09 2c3p h SER 528 Cb 1.33 0.11 -0.11 0.00 -0.31 0.00 0.00 62.40 63.42 2c3p h SER 528 CO 0.48 0.02 0.36 1.23 -0.87 0.00 0.00 176.83 178.05 2c3p h GLY 529 N 0.18 1.35 0.82 -0.77 0.00 -1.91 -0.23 103.07 102.52 2c3p h GLY 529 Ca 0.19 -0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 2c3p h GLY 529 CO -0.27 -0.17 -0.08 -2.22 0.00 0.00 0.00 176.54 173.79 2c3p h ILE 530 N 0.44 1.30 -0.36 2.60 1.08 -1.82 -1.58 117.51 119.16 2c3p h ILE 530 Ca 0.49 -1.12 0.05 0.00 -0.39 0.00 0.00 64.86 63.89 2c3p h ILE 530 Cb 0.84 1.59 -0.05 0.00 -3.07 0.00 0.00 36.82 36.13 2c3p h ILE 530 CO -0.47 0.34 0.07 0.11 -0.69 0.00 0.00 178.15 177.51 2c3p h LYS 531 N 0.14 0.18 -0.88 2.37 1.57 -0.99 0.27 116.57 119.23 2c3p h LYS 531 Ca 0.05 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2c3p h LYS 531 Cb 0.56 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.79 2c3p h LYS 531 CO 0.03 0.12 0.54 0.00 -0.57 0.00 0.00 179.45 179.57 2c3p h ARG 532 N 0.19 1.18 -0.04 3.15 3.08 -1.01 0.09 114.38 121.03 2c3p h ARG 532 Ca 0.17 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 2c3p h ARG 532 Cb 0.20 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 2c3p h ARG 532 CO -0.23 0.82 0.01 1.15 -1.07 0.00 0.00 179.97 180.65 2c3p h THR 533 N 1.20 1.21 -0.67 2.04 2.02 -0.34 0.15 112.91 118.52 2c3p h THR 533 Ca 0.32 -0.62 0.05 0.00 0.77 0.00 0.00 66.41 66.93 2c3p h THR 533 Cb -0.07 1.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 2c3p h THR 533 CO -0.06 0.17 0.39 0.40 0.37 0.00 0.00 175.52 176.79 2c3p h ILE 534 N -0.18 1.02 0.48 3.11 2.04 -0.29 -1.89 117.51 121.79 2c3p h ILE 534 Ca 0.01 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 2c3p h ILE 534 Cb 0.26 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2c3p h ILE 534 CO 0.00 0.14 -0.23 0.00 0.00 0.00 0.00 178.15 178.06 2c3p h ALA 535 N 1.32 -1.10 0.00 1.87 0.00 -0.76 -1.57 119.26 119.03 2c3p h ALA 535 Ca 0.29 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2c3p h ALA 535 Cb 0.12 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2c3p h ALA 535 CO -0.15 -1.05 0.00 0.09 0.00 0.00 0.00 179.25 178.14 2c3p n ASN 536 N -3.82 0.38 -0.54 0.00 4.13 0.51 -1.76 115.26 114.16 2c3p n ASN 536 Ca -0.08 0.67 0.06 0.00 1.68 0.00 0.00 54.58 56.91 2c3p n ASN 536 Cb 0.25 -0.72 0.08 0.00 -1.54 0.00 0.00 39.78 37.85 2c3p n ASN 536 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2c3p n LYS 537 N -2.00 1.27 -3.84 3.52 5.02 -0.72 -4.98 118.16 116.43 2c3p n LYS 537 Ca -0.01 -1.46 -0.24 0.00 -2.02 0.00 0.00 58.31 54.59 2c3p n LYS 537 Cb 0.04 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 2c3p n LYS 537 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2c3p n LYS 538 N 0.65 -4.10 -2.42 1.97 4.01 -0.72 0.07 118.16 117.62 2c3p n LYS 538 Ca 0.09 0.51 -0.35 0.00 -0.51 0.00 0.00 58.31 58.04 2c3p n LYS 538 Cb 0.34 -4.87 -0.02 0.00 -0.51 0.00 0.00 35.03 29.97 2c3p n LYS 538 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2c3p s LEU 539 N -6.85 3.90 -1.17 -0.35 1.43 -0.64 -3.58 118.68 111.42 2c3p s LEU 539 Ca 0.04 2.08 -0.16 0.00 -1.03 0.00 0.00 54.13 55.06 2c3p s LEU 539 Cb -0.02 -4.45 0.14 0.00 0.03 0.00 0.00 46.19 41.89 2c3p s LEU 539 CO 0.85 -0.87 1.43 -0.54 0.23 0.00 0.00 176.35 177.46 2c3p s LYS 540 N -3.03 3.97 -0.07 1.70 1.02 -0.13 -4.95 119.74 118.24 2c3p s LYS 540 Ca 0.66 -2.27 -0.29 0.00 0.02 0.00 0.00 55.97 54.09 2c3p s LYS 540 Cb -0.21 -5.13 -0.02 0.00 -0.52 0.00 0.00 37.83 31.95 2c3p s LYS 540 CO 0.25 -1.87 0.96 0.12 -0.92 0.00 0.00 175.35 173.89 2c3p s PHE 541 N 2.37 3.56 0.02 3.18 5.36 -1.26 -1.83 117.98 129.37 2c3p s PHE 541 Ca 0.43 1.57 0.06 0.00 -0.96 0.00 0.00 56.93 58.03 2c3p s PHE 541 Cb -0.02 -3.12 -0.02 0.00 -0.34 0.00 0.00 43.02 39.52 2c3p s PHE 541 CO -0.01 -0.13 -0.19 0.71 -1.46 0.00 0.00 175.22 174.14 2c3p s TYR 542 N 1.59 1.67 0.00 10.12 1.51 -0.26 -0.28 117.35 131.70 2c3p s TYR 542 Ca 0.48 -0.34 0.06 0.00 -1.01 0.00 0.00 57.07 56.25 2c3p s TYR 542 Cb -0.19 -1.03 -0.02 0.00 -0.11 0.00 0.00 41.96 40.61 2c3p s TYR 542 CO 0.21 0.03 -0.18 1.21 -1.11 0.00 0.00 175.55 175.71 2c3p s ASN 543 N -0.85 2.13 -0.15 2.29 2.47 -1.26 -1.38 114.94 118.19 2c3p s ASN 543 Ca 0.07 -0.37 -0.05 0.00 0.42 0.00 0.00 52.86 52.92 2c3p s ASN 543 Cb -0.08 -0.22 0.07 0.00 -1.45 0.00 0.00 41.25 39.58 2c3p s ASN 543 CO 0.01 0.19 0.31 -0.51 -3.72 0.00 0.00 177.10 173.38 2c3p s ILE 544 N -0.52 -0.49 -1.10 -5.21 2.07 -0.18 -4.78 121.20 110.99 2c3p s ILE 544 Ca 0.07 0.24 -0.20 0.00 -1.41 0.00 0.00 60.65 59.34 2c3p s ILE 544 Cb -0.07 -0.52 -0.07 0.00 0.13 0.00 0.00 42.46 41.93 2c3p s ILE 544 CO -0.00 0.10 1.94 -0.67 -1.91 0.00 0.00 174.94 174.40 2c3p n ASP 545 N 5.36 3.30 -0.32 4.50 -0.08 -1.14 -2.64 116.55 125.54 2c3p n ASP 545 Ca -0.07 -2.75 0.12 0.00 -1.51 0.00 0.00 54.79 50.58 2c3p n ASP 545 Cb 0.50 -1.50 0.34 0.00 2.34 0.00 0.00 41.12 42.79 2c3p n ASP 545 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2c3p h ALA 546 N 8.15 1.75 -0.12 -1.67 0.00 -1.91 -1.12 119.26 124.35 2c3p h ALA 546 Ca 0.38 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.25 2c3p h ALA 546 Cb 0.79 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2c3p h ALA 546 CO 1.63 -0.04 -0.27 0.28 0.00 0.00 0.00 179.25 180.84 2c3p h VAL 547 N 0.76 1.25 0.07 0.00 2.07 -1.83 -1.53 116.25 117.04 2c3p h VAL 547 Ca 0.50 -1.16 -0.28 0.00 0.82 0.00 0.00 66.70 66.59 2c3p h VAL 547 Cb 0.78 1.46 0.02 0.00 -1.52 0.00 0.00 31.29 32.03 2c3p h VAL 547 CO -0.27 0.35 -1.15 0.50 0.02 0.00 0.00 177.57 177.02 2c3p h LYS 548 N 0.20 0.57 -0.22 1.57 3.64 -1.60 -2.60 116.57 118.13 2c3p h LYS 548 Ca 0.03 -0.71 -0.04 0.00 -1.27 0.00 0.00 60.65 58.66 2c3p h LYS 548 Cb 0.60 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 2c3p h LYS 548 CO 0.04 1.30 -0.01 0.82 -2.27 0.00 0.00 179.45 179.34 2c3p h ILE 549 N 0.28 1.26 -0.88 2.00 2.04 -1.35 -1.28 117.51 119.58 2c3p h ILE 549 Ca -0.15 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 64.82 2c3p h ILE 549 Cb 1.81 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 39.27 2c3p h ILE 549 CO 0.21 0.28 0.57 0.00 0.00 0.00 0.00 178.15 179.22 2c3p h ALA 550 N 0.79 1.16 0.51 1.87 0.00 -1.35 -0.82 119.26 121.42 2c3p h ALA 550 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2c3p h ALA 550 Cb 0.42 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.90 2c3p h ALA 550 CO 0.01 0.44 -0.25 1.15 0.00 0.00 0.00 179.25 180.60 2c3p h THR 551 N 1.12 0.46 -0.27 0.00 2.02 -1.32 1.10 112.91 116.02 2c3p h THR 551 Ca 0.35 -0.22 0.06 0.00 0.77 0.00 0.00 66.41 67.36 2c3p h THR 551 Cb -0.02 0.55 -0.06 0.00 -1.74 0.00 0.00 68.15 66.89 2c3p h THR 551 CO -0.11 0.04 -0.09 0.44 0.37 0.00 0.00 175.52 176.17 2c3p h ASP 552 N -0.83 -0.31 0.29 4.18 3.32 -0.94 0.34 116.42 122.46 2c3p h ASP 552 Ca -0.07 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2c3p h ASP 552 Cb 0.59 0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2c3p h ASP 552 CO 0.12 -0.12 0.00 1.33 -1.72 0.00 0.00 179.24 178.85 2c3p n VAL 553 N -5.26 0.68 -0.01 -1.35 0.24 -0.34 -4.84 118.33 107.45 2c3p n VAL 553 Ca -0.01 0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.46 2c3p n VAL 553 Cb 0.18 -0.94 0.00 0.00 -1.47 0.00 0.00 33.84 31.61 2c3p n VAL 553 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2c3p n GLY 554 N -0.11 0.50 0.00 7.63 0.00 0.11 -4.67 105.19 108.65 2c3p n GLY 554 Ca 0.06 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.17 2c3p n GLY 554 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c3p n LEU 555 N 0.00 0.00 -3.39 0.99 4.77 0.38 -4.95 117.00 114.80 2c3p n LEU 555 Ca 0.00 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.81 2c3p n LEU 555 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 2c3p n LEU 555 CO 0.00 0.00 -0.03 0.61 -1.33 0.00 0.00 177.39 176.64 2c3p n GLY 556 N 0.68 -1.05 4.73 -0.72 0.00 -0.86 -2.54 105.19 105.43 2c3p n GLY 556 Ca 0.14 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.90 2c3p n GLY 556 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c3p n GLY 557 N -1.27 0.00 3.59 -0.02 0.00 -1.26 -4.84 105.19 101.39 2c3p n GLY 557 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2c3p n GLY 557 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2c3p s ARG 558 N -0.24 3.20 0.01 1.61 3.52 -1.05 -4.67 118.95 121.33 2c3p s ARG 558 Ca 0.00 1.09 0.26 0.00 -0.13 0.00 0.00 55.73 56.96 2c3p s ARG 558 Cb 0.00 -4.21 0.76 0.00 -1.56 0.00 0.00 34.95 29.94 2c3p s ARG 558 CO 0.00 -2.03 1.60 0.44 -0.81 0.00 0.00 175.30 174.50 2c3p n ILE 559 N 7.28 0.04 -0.24 4.11 -5.35 -1.26 -4.55 119.36 119.40 2c3p n ILE 559 Ca 0.21 -0.03 0.04 0.00 -0.27 0.00 0.00 62.75 62.70 2c3p n ILE 559 Cb 0.48 -0.06 0.15 0.00 -1.74 0.00 0.00 39.64 38.47 2c3p n ILE 559 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2c3p h ASN 560 N 0.00 -0.17 -0.71 7.28 7.08 -1.91 -1.74 115.58 125.41 2c3p h ASN 560 Ca 0.00 0.16 -0.06 0.00 -3.08 0.00 0.00 56.30 53.32 2c3p h ASN 560 Cb 0.52 0.26 -0.03 0.00 -2.08 0.00 0.00 38.32 36.99 2c3p h ASN 560 CO 0.00 -0.10 0.23 -0.03 -2.08 0.00 0.00 177.43 175.45 2c3p h MET 561 N 0.17 1.11 -0.26 4.14 4.05 -1.94 -0.06 114.93 122.14 2c3p h MET 561 Ca 0.38 -0.23 -0.03 0.00 -0.28 0.00 0.00 59.70 59.54 2c3p h MET 561 Cb 0.66 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 2c3p h MET 561 CO -0.55 0.94 0.03 0.82 0.23 0.00 0.00 176.91 178.38 2c3p h ILE 562 N 1.07 1.23 -0.11 1.77 5.03 -1.64 -0.90 117.51 123.96 2c3p h ILE 562 Ca 0.23 -0.80 -0.12 0.00 -0.12 0.00 0.00 64.86 64.05 2c3p h ILE 562 Cb 0.30 1.26 -0.01 0.00 -3.03 0.00 0.00 36.82 35.33 2c3p h ILE 562 CO -0.01 0.26 -0.45 0.24 -0.68 0.00 0.00 178.15 177.51 2c3p h MET 563 N 0.24 0.26 -0.24 2.37 2.86 -1.30 -1.52 114.93 117.60 2c3p h MET 563 Ca 0.08 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2c3p h MET 563 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 2c3p h MET 563 CO 0.01 0.66 0.15 0.37 1.06 0.00 0.00 176.91 179.16 2c3p h GLN 564 N 0.21 0.31 -0.61 1.72 5.75 -0.80 -1.71 115.11 119.99 2c3p h GLN 564 Ca 0.02 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.52 2c3p h GLN 564 Cb 0.88 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 29.32 2c3p h GLN 564 CO 0.07 0.23 0.37 1.15 -2.65 0.00 0.00 178.83 178.00 2c3p h THR 565 N 0.31 1.07 -0.76 2.39 2.02 -0.77 -1.90 112.91 115.27 2c3p h THR 565 Ca 0.09 -0.25 0.11 0.00 0.77 0.00 0.00 66.41 67.13 2c3p h THR 565 Cb -0.01 0.27 -0.08 0.00 -1.74 0.00 0.00 68.15 66.59 2c3p h THR 565 CO -0.02 0.13 0.38 0.00 0.37 0.00 0.00 175.52 176.38 2c3p h ALA 566 N 1.27 1.08 0.22 6.16 0.00 -0.78 -0.03 119.26 127.18 2c3p h ALA 566 Ca 0.25 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 2c3p h ALA 566 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2c3p h ALA 566 CO -0.10 -0.07 -0.10 0.35 0.00 0.00 0.00 179.25 179.33 2c3p h PHE 567 N 0.60 -0.27 0.00 0.00 3.57 -0.58 0.43 116.94 120.68 2c3p h PHE 567 Ca 0.39 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.88 2c3p h PHE 567 Cb 0.48 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 2c3p h PHE 567 CO -0.11 -0.00 -0.01 0.74 -2.23 0.00 0.00 178.31 176.70 2c3p h PHE 568 N -0.52 0.00 0.05 0.41 0.04 -0.88 -0.89 116.94 115.15 2c3p h PHE 568 Ca -0.03 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.39 2c3p h PHE 568 Cb 0.39 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.50 2c3p h PHE 568 CO 0.00 0.01 -1.97 1.17 -0.60 0.00 0.00 178.31 176.92 2c3p n LYS 569 N -3.49 0.66 -0.03 1.51 4.81 -0.07 -4.73 118.16 116.82 2c3p n LYS 569 Ca -0.03 0.33 0.04 0.00 -0.87 0.00 0.00 58.31 57.78 2c3p n LYS 569 Cb 0.09 -1.65 -0.15 0.00 0.02 0.00 0.00 35.03 33.33 2c3p n LYS 569 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2c3p n LEU 570 N -3.83 0.10 0.24 3.14 4.32 0.13 -4.44 117.00 116.65 2c3p n LEU 570 Ca -0.38 0.04 0.08 0.00 -0.02 0.00 0.00 56.01 55.73 2c3p n LEU 570 Cb 0.91 0.15 0.63 0.00 -1.62 0.00 0.00 43.42 43.49 2c3p n LEU 570 CO 0.27 0.15 1.08 0.00 -1.22 0.00 0.00 177.39 177.66 2c3p h ALA 571 N 1.66 1.99 -0.70 -1.18 0.00 -1.30 -3.47 119.26 116.26 2c3p h ALA 571 Ca -0.17 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 2c3p h ALA 571 Cb 1.41 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2c3p h ALA 571 CO 0.01 0.01 -0.13 0.41 0.00 0.00 0.00 179.25 179.55 2c3p n GLY 572 N -1.54 0.20 0.04 0.00 0.00 -1.26 -4.89 105.19 97.74 2c3p n GLY 572 Ca -0.02 -0.68 0.11 0.00 0.00 0.00 0.00 46.02 45.42 2c3p n GLY 572 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2c3p n VAL 573 N -3.92 0.20 -4.00 1.61 0.24 -1.26 -4.93 118.33 106.28 2c3p n VAL 573 Ca -0.06 -0.29 -0.09 0.00 -2.04 0.00 0.00 64.34 61.86 2c3p n VAL 573 Cb 0.52 0.14 -0.10 0.00 -1.47 0.00 0.00 33.84 32.92 2c3p n VAL 573 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2c3p s LEU 574 N -4.11 2.21 0.42 1.34 1.43 -1.26 -5.11 118.68 113.60 2c3p s LEU 574 Ca 0.03 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.25 2c3p s LEU 574 Cb 0.14 0.23 -0.08 0.00 0.03 0.00 0.00 46.19 46.51 2c3p s LEU 574 CO 0.81 -0.42 1.17 -2.16 0.23 0.00 0.00 176.35 175.98 2c3p s PRO 575 N -2.30 3.95 0.18 1.29 0.04 -1.26 -4.83 135.00 132.07 2c3p s PRO 575 Ca -0.08 1.83 -0.23 0.00 0.04 0.00 0.00 61.00 62.56 2c3p s PRO 575 Cb -0.04 -2.59 0.08 0.00 0.04 0.00 0.00 34.50 32.00 2c3p s PRO 575 CO -0.04 -0.41 1.57 0.35 0.04 0.00 0.00 177.00 178.52 2c3p h PHE 576 N 2.44 -1.14 -0.06 0.56 3.04 -1.90 -1.13 116.94 118.75 2c3p h PHE 576 Ca -0.49 0.08 0.04 0.00 3.98 0.00 0.00 57.97 61.58 2c3p h PHE 576 Cb 1.24 0.59 -0.06 0.00 2.56 0.00 0.00 35.95 40.28 2c3p h PHE 576 CO 0.54 -0.41 -0.39 0.93 -2.02 0.00 0.00 178.31 176.96 2c3p h GLU 577 N -0.19 -0.49 -0.88 1.11 4.39 -1.97 -1.57 114.58 114.97 2c3p h GLU 577 Ca 0.21 0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.95 2c3p h GLU 577 Cb 0.56 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.28 2c3p h GLU 577 CO -0.71 -0.33 0.57 -0.22 -1.16 0.00 0.00 179.01 177.16 2c3p h LYS 578 N -0.51 1.17 0.04 2.33 3.64 -1.89 -2.22 116.57 119.12 2c3p h LYS 578 Ca 0.06 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2c3p h LYS 578 Cb 0.62 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2c3p h LYS 578 CO -0.34 0.79 -0.03 0.00 -2.27 0.00 0.00 179.45 177.60 2c3p h ALA 579 N 1.31 -0.90 -0.81 5.00 0.00 -0.69 0.41 119.26 123.59 2c3p h ALA 579 Ca 0.32 -0.01 0.22 0.00 0.00 0.00 0.00 54.91 55.44 2c3p h ALA 579 Cb -0.12 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2c3p h ALA 579 CO -0.07 -0.89 0.57 0.28 0.00 0.00 0.00 179.25 179.14 2c3p h VAL 580 N -0.06 0.62 0.52 0.00 2.07 -1.37 0.35 116.25 118.38 2c3p h VAL 580 Ca -0.01 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 2c3p h VAL 580 Cb 0.05 0.54 0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2c3p h VAL 580 CO 0.00 0.01 -0.25 -0.78 0.02 0.00 0.00 177.57 176.58 2c3p h ASP 581 N 0.08 -0.59 -0.64 0.57 -0.00 -1.12 -1.82 116.42 112.89 2c3p h ASP 581 Ca 0.39 0.02 0.10 0.00 -0.00 0.00 0.00 57.03 57.54 2c3p h ASP 581 Cb 1.44 0.15 -0.08 0.00 -0.00 0.00 0.00 39.33 40.85 2c3p h ASP 581 CO -0.04 -0.30 0.25 -0.07 -0.00 0.00 0.00 179.24 179.08 2c3p h LEU 582 N -0.94 0.26 -0.46 2.28 4.07 0.10 0.94 115.31 121.56 2c3p h LEU 582 Ca -0.07 0.08 0.04 0.00 0.08 0.00 0.00 57.88 58.01 2c3p h LEU 582 Cb 0.54 0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.29 2c3p h LEU 582 CO 0.12 0.14 0.23 0.25 -1.08 0.00 0.00 178.44 178.10 2c3p h LEU 583 N 0.43 0.33 0.08 1.67 5.85 -0.41 -1.42 115.31 121.84 2c3p h LEU 583 Ca 0.33 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.07 2c3p h LEU 583 Cb 0.41 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2c3p h LEU 583 CO -0.32 0.24 -0.04 0.11 -0.34 0.00 0.00 178.44 178.09 2c3p h LYS 584 N 0.46 -0.10 -0.82 1.25 1.57 -0.35 -2.11 116.57 116.46 2c3p h LYS 584 Ca 0.20 0.01 0.20 0.00 -1.87 0.00 0.00 60.65 59.18 2c3p h LYS 584 Cb 0.10 0.02 -0.13 0.00 0.08 0.00 0.00 32.23 32.31 2c3p h LYS 584 CO -0.14 0.15 0.21 0.87 -0.57 0.00 0.00 179.45 179.97 2c3p h LYS 585 N -0.36 0.24 -0.32 3.15 1.57 -0.59 0.78 116.57 121.04 2c3p h LYS 585 Ca -0.01 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.68 2c3p h LYS 585 Cb 0.31 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 2c3p h LYS 585 CO 0.02 0.16 -0.10 0.66 -0.57 0.00 0.00 179.45 179.62 2c3p h SER 586 N 0.25 0.53 -0.32 0.86 4.64 -1.06 -1.39 113.55 117.05 2c3p h SER 586 Ca 0.49 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.66 2c3p h SER 586 Cb 0.91 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.84 2c3p h SER 586 CO -0.59 0.66 0.15 0.40 -0.87 0.00 0.00 176.83 176.59 2c3p h ILE 587 N 0.51 1.14 -0.15 0.95 2.04 -0.16 0.24 117.51 122.08 2c3p h ILE 587 Ca 0.10 -0.43 -0.22 0.00 1.00 0.00 0.00 64.86 65.31 2c3p h ILE 587 Cb 0.48 0.70 0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2c3p h ILE 587 CO 0.03 0.17 -0.76 0.45 0.00 0.00 0.00 178.15 178.04 2c3p h HIS 588 N 0.51 1.05 0.00 1.37 3.86 -1.05 -3.32 115.15 117.58 2c3p h HIS 588 Ca 0.13 -0.46 0.00 0.00 -1.16 0.00 0.00 60.37 58.87 2c3p h HIS 588 Cb 0.10 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.41 2c3p h HIS 588 CO 0.00 1.29 0.00 1.17 0.86 0.00 0.00 177.93 181.26 2c3p n LYS 589 N -3.97 0.00 -0.12 2.45 4.81 -0.32 -3.83 118.16 117.19 2c3p n LYS 589 Ca -0.08 0.49 -0.06 0.00 -0.87 0.00 0.00 58.31 57.80 2c3p n LYS 589 Cb 0.74 -1.31 0.06 0.00 0.02 0.00 0.00 35.03 34.53 2c3p n LYS 589 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2c3p n ALA 590 N -1.73 -0.92 -0.27 3.14 0.00 0.69 -4.52 120.51 116.90 2c3p n ALA 590 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2c3p n ALA 590 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.42 2c3p n ALA 590 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2c3p n TYR 591 N -3.32 0.00 -0.51 0.00 4.01 -1.26 -4.65 117.16 111.43 2c3p n TYR 591 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 2c3p n TYR 591 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 2c3p n TYR 591 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2c3p n GLY 592 N 0.00 0.00 0.00 2.72 0.00 -1.25 -4.85 105.19 101.81 2c3p n GLY 592 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2c3p n GLY 592 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2c3p n LYS 593 N -0.60 0.00 -1.36 1.61 2.85 -1.26 -4.70 118.16 114.70 2c3p n LYS 593 Ca 0.00 0.00 -0.30 0.00 -1.05 0.00 0.00 58.31 56.96 2c3p n LYS 593 Cb 0.13 0.00 -0.17 0.00 -0.65 0.00 0.00 35.03 34.34 2c3p n LYS 593 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2c3p n LYS 594 N 0.00 0.00 -0.87 -1.58 4.81 -1.26 -4.57 118.16 114.69 2c3p n LYS 594 Ca 0.00 0.00 0.10 0.00 -0.87 0.00 0.00 58.31 57.54 2c3p n LYS 594 Cb 0.00 -1.16 -0.03 0.00 0.02 0.00 0.00 35.03 33.85 2c3p n LYS 594 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2c3p n GLY 595 N 5.50 -1.16 0.02 3.14 0.00 -1.26 -3.90 105.19 107.53 2c3p n GLY 595 Ca 0.61 -0.57 0.15 0.00 0.00 0.00 0.00 46.02 46.20 2c3p n GLY 595 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3p n GLU 596 N -2.80 0.48 -0.12 1.61 -0.58 -1.26 -3.85 120.64 114.12 2c3p n GLU 596 Ca -0.01 -0.04 -0.11 0.00 -0.42 0.00 0.00 57.16 56.58 2c3p n GLU 596 Cb 0.59 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.94 2c3p n GLU 596 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2c3p h LYS 597 N 0.10 0.70 0.00 3.49 3.64 -1.94 0.35 116.57 122.91 2c3p h LYS 597 Ca 0.00 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.09 2c3p h LYS 597 Cb 0.29 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2c3p h LYS 597 CO 0.00 0.86 -0.11 0.82 -2.27 0.00 0.00 179.45 178.75 2c3p h ILE 598 N 0.49 0.28 0.12 2.00 2.04 -1.68 -2.45 117.51 118.32 2c3p h ILE 598 Ca 0.09 -0.81 -0.28 0.00 1.00 0.00 0.00 64.86 64.86 2c3p h ILE 598 Cb 0.60 1.63 0.02 0.00 -0.74 0.00 0.00 36.82 38.34 2c3p h ILE 598 CO 0.04 0.11 -1.22 0.58 0.00 0.00 0.00 178.15 177.65 2c3p h VAL 599 N 0.00 1.39 -0.12 1.67 2.07 -1.65 -3.20 116.25 116.40 2c3p h VAL 599 Ca -0.00 -2.72 -0.01 0.00 0.82 0.00 0.00 66.70 64.79 2c3p h VAL 599 Cb 0.63 2.79 -0.01 0.00 -1.52 0.00 0.00 31.29 33.18 2c3p h VAL 599 CO 0.01 0.81 0.04 0.50 0.02 0.00 0.00 177.57 178.95 2c3p h LYS 600 N 0.17 0.18 -0.69 1.57 1.63 -0.61 -0.38 116.57 118.45 2c3p h LYS 600 Ca -0.16 -0.04 0.07 0.00 -0.85 0.00 0.00 60.65 59.67 2c3p h LYS 600 Cb 1.91 -0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 33.46 2c3p h LYS 600 CO 0.22 0.32 0.37 0.52 -3.45 0.00 0.00 179.45 177.43 2c3p h MET 601 N 0.01 0.66 -0.24 1.90 2.86 -1.56 0.72 114.93 119.27 2c3p h MET 601 Ca 0.04 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 2c3p h MET 601 Cb 0.22 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2c3p h MET 601 CO -0.00 0.44 -0.08 -0.91 1.06 0.00 0.00 176.91 177.41 2c3p h ASN 602 N 0.68 0.49 -0.21 1.22 4.21 -1.51 0.28 115.58 120.74 2c3p h ASN 602 Ca 0.32 -0.38 -0.01 0.00 1.21 0.00 0.00 56.30 57.43 2c3p h ASN 602 Cb 0.23 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.29 2c3p h ASN 602 CO -0.20 0.76 0.09 0.74 -1.29 0.00 0.00 177.43 177.53 2c3p h THR 603 N 0.22 1.15 -0.37 2.81 2.02 -0.60 -1.68 112.91 116.46 2c3p h THR 603 Ca 0.06 -0.43 0.02 0.00 0.77 0.00 0.00 66.41 66.83 2c3p h THR 603 Cb 0.56 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 2c3p h THR 603 CO 0.03 0.14 0.20 0.44 0.37 0.00 0.00 175.52 176.70 2c3p h ASP 604 N 0.20 0.30 -0.80 4.18 3.45 0.52 -1.40 116.42 122.87 2c3p h ASP 604 Ca 0.07 0.01 0.12 0.00 0.43 0.00 0.00 57.03 57.67 2c3p h ASP 604 Cb 0.14 -0.05 -0.06 0.00 -0.56 0.00 0.00 39.33 38.81 2c3p h ASP 604 CO -0.01 0.22 0.52 0.00 -1.57 0.00 0.00 179.24 178.40 2c3p h ALA 605 N 1.18 1.89 -0.20 3.45 0.00 -0.15 0.10 119.26 125.53 2c3p h ALA 605 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2c3p h ALA 605 Cb 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2c3p h ALA 605 CO -0.09 -0.08 0.02 0.28 0.00 0.00 0.00 179.25 179.37 2c3p h VAL 606 N 0.62 1.23 -0.52 0.00 2.07 -0.32 0.10 116.25 119.43 2c3p h VAL 606 Ca 0.39 -0.77 -0.10 0.00 0.82 0.00 0.00 66.70 67.03 2c3p h VAL 606 Cb 0.64 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 2c3p h VAL 606 CO -0.15 0.24 -0.09 0.44 0.02 0.00 0.00 177.57 178.03 2c3p h ASP 607 N 0.12 0.97 -0.58 0.57 3.45 -0.79 0.18 116.42 120.34 2c3p h ASP 607 Ca 0.06 -0.35 -0.06 0.00 0.43 0.00 0.00 57.03 57.12 2c3p h ASP 607 Cb 0.34 -0.26 -0.03 0.00 -0.56 0.00 0.00 39.33 38.81 2c3p h ASP 607 CO 0.01 1.09 0.16 -0.61 -1.57 0.00 0.00 179.24 178.31 2c3p h GLN 608 N 0.84 0.97 -0.06 3.56 5.75 -0.77 -1.20 115.11 124.19 2c3p h GLN 608 Ca 0.14 -0.21 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 2c3p h GLN 608 Cb 0.64 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.05 2c3p h GLN 608 CO 0.04 0.86 -0.02 0.00 -2.65 0.00 0.00 178.83 177.06 2c3p h ALA 609 N 1.24 0.08 -0.91 3.38 0.00 -0.60 -0.31 119.26 122.14 2c3p h ALA 609 Ca 0.20 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.99 2c3p h ALA 609 Cb 0.32 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 2c3p h ALA 609 CO -0.00 -0.20 0.56 0.28 0.00 0.00 0.00 179.25 179.88 2c3p h VAL 610 N -0.24 0.96 0.55 0.00 2.07 -0.46 0.29 116.25 119.42 2c3p h VAL 610 Ca 0.01 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 2c3p h VAL 610 Cb 0.42 -0.06 0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2c3p h VAL 610 CO 0.01 0.17 -0.26 0.74 0.02 0.00 0.00 177.57 178.25 2c3p h THR 611 N 0.94 0.13 0.00 2.57 2.02 -1.10 -3.20 112.91 114.27 2c3p h THR 611 Ca 0.43 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2c3p h THR 611 Cb 0.33 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 2c3p h THR 611 CO -0.23 0.02 0.00 -1.20 0.37 0.00 0.00 175.52 174.49 2c3p n SER 612 N -5.28 0.00 -3.96 4.18 7.64 -0.14 -4.25 113.62 111.82 2c3p n SER 612 Ca -0.10 0.28 -0.42 0.00 1.01 0.00 0.00 58.87 59.64 2c3p n SER 612 Cb 0.31 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 2c3p n SER 612 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2c3p n LEU 613 N -1.36 6.38 -4.64 -3.43 7.94 0.08 -4.92 117.00 117.06 2c3p n LEU 613 Ca 0.03 -4.29 -0.30 0.00 -1.11 0.00 0.00 56.01 50.34 2c3p n LEU 613 Cb 0.07 -1.61 -0.09 0.00 0.53 0.00 0.00 43.42 42.32 2c3p n LEU 613 CO 0.06 1.02 -0.37 -1.10 -1.11 0.00 0.00 177.39 175.89 2c3p s GLN 614 N 2.35 2.36 -0.11 1.96 -1.52 -1.26 -5.00 119.66 118.44 2c3p s GLN 614 Ca 0.45 -0.92 -0.29 0.00 -1.95 0.00 0.00 55.36 52.66 2c3p s GLN 614 Cb 0.10 -2.43 -0.06 0.00 -0.22 0.00 0.00 33.01 30.39 2c3p s GLN 614 CO -0.03 0.53 2.00 -2.00 -0.25 0.00 0.00 175.29 175.54 2c3p s GLU 615 N -2.24 3.68 0.03 2.91 2.12 -1.26 -4.43 118.70 119.51 2c3p s GLU 615 Ca 0.24 2.20 -0.30 0.00 0.36 0.00 0.00 54.97 57.47 2c3p s GLU 615 Cb -0.11 -4.22 -0.07 0.00 0.26 0.00 0.00 34.13 29.98 2c3p s GLU 615 CO 0.16 -1.47 1.58 0.12 -0.54 0.00 0.00 175.26 175.11 2c3p s PHE 616 N 6.11 2.49 -0.01 5.30 5.36 0.61 -4.97 117.98 132.87 2c3p s PHE 616 Ca 0.90 0.45 -0.14 0.00 -0.96 0.00 0.00 56.93 57.18 2c3p s PHE 616 Cb -0.35 -3.87 -0.06 0.00 -0.34 0.00 0.00 43.02 38.40 2c3p s PHE 616 CO 0.37 -3.45 0.38 0.15 -1.46 0.00 0.00 175.22 171.20 2c3p s LYS 617 N 2.74 3.87 0.07 10.12 -0.14 -1.26 -4.60 119.74 130.53 2c3p s LYS 617 Ca 0.71 0.36 0.04 0.00 -1.36 0.00 0.00 55.97 55.72 2c3p s LYS 617 Cb -0.37 -3.22 -0.03 0.00 -1.68 0.00 0.00 37.83 32.54 2c3p s LYS 617 CO 0.30 0.70 -0.12 1.52 -0.76 0.00 0.00 175.35 176.99 2c3p s TYR 618 N -1.07 1.04 0.44 3.18 -0.85 -1.26 -5.03 117.35 113.81 2c3p s TYR 618 Ca 0.23 -0.49 -0.24 0.00 -0.52 0.00 0.00 57.07 56.04 2c3p s TYR 618 Cb -0.16 -0.59 -0.08 0.00 0.38 0.00 0.00 41.96 41.51 2c3p s TYR 618 CO 0.12 0.01 1.25 -1.25 -1.52 0.00 0.00 175.55 174.16 2c3p s PRO 619 N -1.81 3.79 0.12 -3.49 0.04 -1.26 -4.90 135.00 127.49 2c3p s PRO 619 Ca -0.03 2.00 0.13 0.00 0.04 0.00 0.00 61.00 63.14 2c3p s PRO 619 Cb -0.09 -2.56 0.62 0.00 0.04 0.00 0.00 34.50 32.51 2c3p s PRO 619 CO 0.02 -0.59 1.42 -3.47 0.04 0.00 0.00 177.00 174.41 2c3p n ASP 620 N -0.24 0.25 0.03 6.66 2.03 -1.26 -1.54 116.55 122.47 2c3p n ASP 620 Ca 0.06 0.59 0.08 0.00 0.52 0.00 0.00 54.79 56.04 2c3p n ASP 620 Cb 0.46 -0.63 0.36 0.00 -0.72 0.00 0.00 41.12 40.59 2c3p n ASP 620 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2c3p n SER 621 N -1.80 0.14 0.26 1.67 3.41 -1.26 -1.93 113.62 114.11 2c3p n SER 621 Ca 0.01 0.53 0.15 0.00 -0.26 0.00 0.00 58.87 59.30 2c3p n SER 621 Cb 0.11 -0.56 0.62 0.00 -0.26 0.00 0.00 64.21 64.11 2c3p n SER 621 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 2c3p h TRP 622 N 0.00 0.00 -1.06 7.33 4.06 -1.61 -2.96 115.95 121.71 2c3p h TRP 622 Ca 0.00 0.00 0.31 0.00 2.06 0.00 0.00 58.89 61.26 2c3p h TRP 622 Cb 0.29 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.41 2c3p h TRP 622 CO 0.00 0.08 0.89 0.87 -3.56 0.00 0.00 178.44 176.72 2c3p h LYS 623 N 0.00 0.00 -0.65 0.49 1.79 -1.61 -2.77 116.57 113.82 2c3p h LYS 623 Ca -0.00 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.16 2c3p h LYS 623 Cb 0.57 0.00 -0.32 0.00 -1.58 0.00 0.00 32.23 30.90 2c3p h LYS 623 CO 0.01 0.00 -0.92 -0.40 -1.08 0.00 0.00 179.45 177.06 2c3p n ASP 624 N -3.86 0.39 -4.65 0.86 5.68 -1.12 -4.81 116.55 109.04 2c3p n ASP 624 Ca 0.23 -2.59 -0.39 0.00 -0.50 0.00 0.00 54.79 51.54 2c3p n ASP 624 Cb 1.23 -0.04 0.03 0.00 -1.14 0.00 0.00 41.12 41.21 2c3p n ASP 624 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2c3p n ALA 625 N -0.29 0.57 -1.59 2.12 0.00 -1.05 -4.80 120.51 115.48 2c3p n ALA 625 Ca 0.05 0.13 -0.44 0.00 0.00 0.00 0.00 53.44 53.17 2c3p n ALA 625 Cb 0.83 -2.16 -0.04 0.00 0.00 0.00 0.00 19.45 18.08 2c3p n ALA 625 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2c3p n PRO 626 N -0.52 1.92 -1.55 0.00 -0.04 -1.26 -4.86 135.00 128.69 2c3p n PRO 626 Ca 0.11 0.56 -0.41 0.00 -0.04 0.00 0.00 63.50 63.72 2c3p n PRO 626 Cb 0.43 -3.07 -0.04 0.00 -0.04 0.00 0.00 33.50 30.78 2c3p n PRO 626 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c3p n ALA 627 N 10.78 1.18 -0.82 0.55 0.00 -1.26 -4.73 120.51 126.21 2c3p n ALA 627 Ca 0.30 -0.53 -0.34 0.00 0.00 0.00 0.00 53.44 52.87 2c3p n ALA 627 Cb 0.40 -2.97 0.11 0.00 0.00 0.00 0.00 19.45 17.00 2c3p n ALA 627 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2c3p n GLU 628 N 8.79 -0.64 0.00 0.00 0.28 -1.26 -5.02 120.64 122.78 2c3p n GLU 628 Ca 0.37 -0.17 0.00 0.00 -0.16 0.00 0.00 57.16 57.20 2c3p n GLU 628 Cb 0.44 -1.51 0.00 0.00 1.43 0.00 0.00 31.44 31.80 2c3p n GLU 628 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2c3p n THR 629 N -3.67 0.00 0.00 3.84 -2.24 -1.26 -5.08 114.28 105.87 2c3p n THR 629 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2c3p n THR 629 Cb 0.61 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2c3p n THR 629 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2c3p n LYS 630 N 0.00 0.00 -1.19 -0.78 2.85 -1.26 -5.05 118.16 112.73 2c3p n LYS 630 Ca 0.00 0.00 -0.23 0.00 -1.05 0.00 0.00 58.31 57.03 2c3p n LYS 630 Cb 0.00 0.00 -0.11 0.00 -0.65 0.00 0.00 35.03 34.27 2c3p n LYS 630 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2c3p n ALA 631 N 0.00 6.78 -2.61 0.58 0.00 -1.26 -4.92 120.51 119.08 2c3p n ALA 631 Ca 0.00 -2.57 -0.42 0.00 0.00 0.00 0.00 53.44 50.45 2c3p n ALA 631 Cb 0.00 -2.66 -0.04 0.00 0.00 0.00 0.00 19.45 16.76 2c3p n ALA 631 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2c3p s GLU 632 N 1.03 3.93 1.35 0.00 4.04 -1.26 -5.05 118.70 122.74 2c3p s GLU 632 Ca 0.67 0.68 -0.21 0.00 0.04 0.00 0.00 54.97 56.15 2c3p s GLU 632 Cb 0.28 -3.76 0.33 0.00 0.02 0.00 0.00 34.13 30.99 2c3p s GLU 632 CO -0.04 -0.84 0.78 -2.30 -1.84 0.00 0.00 175.26 171.02 2c3p n PRO 633 N 6.58 -4.04 -3.46 -4.83 -0.02 -1.26 -5.00 135.00 122.98 2c3p n PRO 633 Ca 0.07 -1.19 -0.37 0.00 -2.02 0.00 0.00 63.50 59.99 2c3p n PRO 633 Cb 0.48 -1.88 -0.06 0.00 -0.02 0.00 0.00 33.50 32.02 2c3p n PRO 633 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2c3p s MET 634 N -4.66 3.94 0.00 -0.52 -2.45 -1.26 -5.06 119.30 109.29 2c3p s MET 634 Ca 0.62 0.42 0.00 0.00 -1.25 0.00 0.00 55.69 55.49 2c3p s MET 634 Cb -0.13 -3.12 0.00 0.00 1.25 0.00 0.00 34.83 32.82 2c3p s MET 634 CO 0.55 0.62 0.00 2.41 1.05 0.00 0.00 175.02 179.64 2c3p n THR 635 N 1.42 0.00 -4.52 10.11 -1.04 -1.26 -5.11 114.28 113.88 2c3p n THR 635 Ca -0.11 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.64 2c3p n THR 635 Cb 0.52 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.93 2c3p n THR 635 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2c3p s ASN 636 N 1.35 3.87 0.25 8.00 4.22 -1.26 -5.01 114.94 126.36 2c3p s ASN 636 Ca 0.00 -1.22 -0.03 0.00 -2.14 0.00 0.00 52.86 49.48 2c3p s ASN 636 Cb 0.00 -0.39 0.48 0.00 1.28 0.00 0.00 41.25 42.62 2c3p s ASN 636 CO 0.00 -0.30 1.76 -0.08 -2.04 0.00 0.00 177.10 176.44 2c3p h GLU 637 N 1.89 0.58 -0.62 3.55 4.57 -2.03 -0.49 114.58 122.04 2c3p h GLU 637 Ca -0.43 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 57.64 2c3p h GLU 637 Cb 1.25 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.68 2c3p h GLU 637 CO 0.73 0.39 0.07 0.35 -1.18 0.00 0.00 179.01 179.36 2c3p h PHE 638 N 0.60 1.12 -0.12 0.92 3.57 -1.97 0.15 116.94 121.21 2c3p h PHE 638 Ca 0.43 -0.17 -0.13 0.00 3.53 0.00 0.00 57.97 61.63 2c3p h PHE 638 Cb 0.59 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2c3p h PHE 638 CO -0.10 0.97 -0.50 0.35 -2.23 0.00 0.00 178.31 176.79 2c3p h PHE 639 N 0.95 0.38 -0.10 0.41 3.57 -1.81 0.02 116.94 120.35 2c3p h PHE 639 Ca 0.18 -0.12 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 2c3p h PHE 639 Cb 0.48 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.14 2c3p h PHE 639 CO 0.04 0.75 -0.24 -0.22 -2.23 0.00 0.00 178.31 176.41 2c3p h LYS 640 N 0.25 0.34 0.00 1.11 3.64 -0.78 -0.22 116.57 120.90 2c3p h LYS 640 Ca 0.01 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2c3p h LYS 640 Cb 0.97 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2c3p h LYS 640 CO 0.08 0.84 -0.99 0.09 -2.27 0.00 0.00 179.45 177.20 2c3p n ASN 641 N -4.49 0.80 0.04 4.20 3.02 0.49 -4.47 115.26 114.85 2c3p n ASN 641 Ca -0.07 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.74 2c3p n ASN 641 Cb 0.44 0.48 0.00 0.00 -0.61 0.00 0.00 39.78 40.09 2c3p n ASN 641 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2c3p n VAL 642 N -2.56 0.82 -0.16 2.41 0.31 -0.03 -4.77 118.33 114.35 2c3p n VAL 642 Ca 0.00 0.27 -0.11 0.00 -0.01 0.00 0.00 64.34 64.50 2c3p n VAL 642 Cb 0.53 -1.33 -0.00 0.00 -0.91 0.00 0.00 33.84 32.13 2c3p n VAL 642 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 2c3p h VAL 643 N 0.00 1.27 0.04 2.52 3.04 -1.59 -2.52 116.25 119.01 2c3p h VAL 643 Ca 0.00 -1.23 0.00 0.00 -1.01 0.00 0.00 66.70 64.46 2c3p h VAL 643 Cb 0.00 1.07 -0.01 0.00 -2.01 0.00 0.00 31.29 30.35 2c3p h VAL 643 CO 0.00 0.43 -0.05 0.50 -1.01 0.00 0.00 177.57 177.44 2c3p h LYS 644 N 0.77 -0.10 -0.86 4.17 1.63 -1.28 0.16 116.57 121.06 2c3p h LYS 644 Ca 0.12 0.01 0.10 0.00 -0.85 0.00 0.00 60.65 60.03 2c3p h LYS 644 Cb 0.65 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.24 2c3p h LYS 644 CO 0.04 -0.07 0.56 -1.35 -3.45 0.00 0.00 179.45 175.18 2c3p h PRO 645 N -0.10 0.78 -0.22 1.90 0.11 -1.77 -1.00 132.00 131.71 2c3p h PRO 645 Ca 0.01 -0.05 -0.20 0.00 0.11 0.00 0.00 66.00 65.87 2c3p h PRO 645 Cb 0.10 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.04 2c3p h PRO 645 CO -0.02 0.52 -0.63 0.82 -0.21 0.00 0.00 178.00 178.48 2c3p h ILE 646 N 0.81 1.28 0.00 4.15 2.04 -0.96 0.53 117.51 125.36 2c3p h ILE 646 Ca 0.40 -1.83 -0.02 0.00 1.00 0.00 0.00 64.86 64.42 2c3p h ILE 646 Cb 0.46 1.82 -0.00 0.00 -0.74 0.00 0.00 36.82 38.36 2c3p h ILE 646 CO -0.17 0.59 -0.08 -0.07 0.00 0.00 0.00 178.15 178.42 2c3p h LEU 647 N 0.57 0.00 -3.16 1.44 3.38 0.13 -1.63 115.31 116.04 2c3p h LEU 647 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2c3p h LEU 647 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2c3p h LEU 647 CO 0.14 0.08 0.00 0.35 0.09 0.00 0.00 178.44 179.09 2c3p n THR 648 N -3.29 2.05 -2.09 0.22 -2.24 -0.46 -4.93 114.28 103.55 2c3p n THR 648 Ca -0.01 -1.20 -0.11 0.00 -2.27 0.00 0.00 64.05 60.46 2c3p n THR 648 Cb 0.28 -0.02 -0.01 0.00 -2.10 0.00 0.00 70.33 68.48 2c3p n THR 648 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c3p n GLN 649 N 0.94 -0.85 -0.10 -0.78 6.02 -0.61 -4.79 117.38 117.20 2c3p n GLN 649 Ca 0.26 0.57 0.06 0.00 -0.01 0.00 0.00 57.00 57.88 2c3p n GLN 649 Cb 0.96 -4.66 0.11 0.00 1.02 0.00 0.00 30.24 27.67 2c3p n GLN 649 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2c3p n GLN 650 N -2.13 1.85 -0.26 -1.09 1.13 0.18 -4.61 117.38 112.46 2c3p n GLN 650 Ca -0.13 -1.66 0.27 0.00 -1.94 0.00 0.00 57.00 53.54 2c3p n GLN 650 Cb 0.57 -1.24 0.64 0.00 0.11 0.00 0.00 30.24 30.31 2c3p n GLN 650 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2c3p h GLY 651 N 2.10 0.45 1.98 1.08 0.00 -1.73 0.36 103.07 107.30 2c3p h GLY 651 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2c3p h GLY 651 CO 0.00 -0.03 0.01 -0.55 0.00 0.00 0.00 176.54 175.97 2c3p h ASP 652 N 0.17 0.00 0.76 0.19 3.32 -1.91 -1.41 116.42 117.53 2c3p h ASP 652 Ca 0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.56 2c3p h ASP 652 Cb 1.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.24 2c3p h ASP 652 CO -0.11 0.00 -0.68 0.29 -1.72 0.00 0.00 179.24 177.02 2c3p n LYS 653 N -3.08 0.26 -2.07 3.56 5.02 0.13 -4.85 118.16 117.13 2c3p n LYS 653 Ca -0.03 0.06 -0.42 0.00 -2.02 0.00 0.00 58.31 55.90 2c3p n LYS 653 Cb 0.08 -1.65 -0.03 0.00 -0.02 0.00 0.00 35.03 33.41 2c3p n LYS 653 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2c3p s LEU 654 N -4.05 4.34 0.99 -0.35 1.43 -0.53 -4.95 118.68 115.55 2c3p s LEU 654 Ca 0.06 2.30 -0.15 0.00 -1.03 0.00 0.00 54.13 55.31 2c3p s LEU 654 Cb 0.14 -3.56 0.19 0.00 0.03 0.00 0.00 46.19 42.98 2c3p s LEU 654 CO 0.73 -0.81 1.18 -2.16 0.23 0.00 0.00 176.35 175.53 2c3p s PRO 655 N 2.57 0.50 0.49 1.29 0.04 -1.26 -4.73 135.00 133.89 2c3p s PRO 655 Ca 0.69 0.01 0.20 0.00 0.04 0.00 0.00 61.00 61.94 2c3p s PRO 655 Cb -0.35 -1.79 1.23 0.00 0.04 0.00 0.00 34.50 33.62 2c3p s PRO 655 CO 0.29 -2.58 2.05 0.28 0.04 0.00 0.00 177.00 177.08 2c3p h VAL 656 N -1.77 0.90 0.00 -0.36 2.07 -1.74 -2.39 116.25 112.96 2c3p h VAL 656 Ca -0.47 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 66.53 2c3p h VAL 656 Cb 1.30 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.36 2c3p h VAL 656 CO 0.49 0.14 0.00 0.77 0.02 0.00 0.00 177.57 178.99 2c3p h SER 657 N 0.00 0.00 1.18 0.57 4.64 -1.90 -2.62 113.55 115.42 2c3p h SER 657 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2c3p h SER 657 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2c3p h SER 657 CO 0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 176.83 175.96 2c3p n ALA 658 N -1.90 2.35 -2.58 5.18 0.00 -0.90 -4.89 120.51 117.77 2c3p n ALA 658 Ca -0.01 -0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.07 2c3p n ALA 658 Cb 0.11 -1.46 -0.09 0.00 0.00 0.00 0.00 19.45 18.01 2c3p n ALA 658 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2c3p s PHE 659 N -3.04 2.72 0.15 0.00 0.40 -0.99 -5.05 117.98 112.16 2c3p s PHE 659 Ca 0.12 -0.17 -0.30 0.00 -0.60 0.00 0.00 56.93 55.98 2c3p s PHE 659 Cb 0.16 -1.38 -0.07 0.00 0.51 0.00 0.00 43.02 42.23 2c3p s PHE 659 CO 0.56 0.46 1.20 -1.21 0.70 0.00 0.00 175.22 176.93 2c3p s GLU 660 N -2.47 4.48 0.39 0.44 0.41 -1.26 -4.92 118.70 115.78 2c3p s GLU 660 Ca 0.23 1.84 0.19 0.00 -0.41 0.00 0.00 54.97 56.82 2c3p s GLU 660 Cb -0.10 -3.27 1.12 0.00 -1.78 0.00 0.00 34.13 30.10 2c3p s GLU 660 CO 0.15 -0.14 1.75 0.00 -0.49 0.00 0.00 175.26 176.53 2c3p h ALA 661 N 5.74 2.25 -0.46 5.21 0.00 -1.95 0.61 119.26 130.65 2c3p h ALA 661 Ca -0.44 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2c3p h ALA 661 Cb 1.21 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2c3p h ALA 661 CO 0.77 -0.69 0.00 -0.40 0.00 0.00 0.00 179.25 178.93 2c3p n ASP 662 N -4.67 2.62 0.00 0.00 3.85 -1.26 -4.95 116.55 112.15 2c3p n ASP 662 Ca 0.27 -1.97 0.00 0.00 -0.71 0.00 0.00 54.79 52.38 2c3p n ASP 662 Cb 0.93 -0.31 0.00 0.00 -1.35 0.00 0.00 41.12 40.40 2c3p n ASP 662 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2c3p n GLY 663 N 1.29 0.68 3.78 6.12 0.00 0.21 -4.81 105.19 112.46 2c3p n GLY 663 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 2c3p n GLY 663 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2c3p s ARG 664 N -0.18 2.65 0.09 1.61 1.70 -1.26 -4.91 118.95 118.64 2c3p s ARG 664 Ca 0.00 1.23 0.05 0.00 -0.47 0.00 0.00 55.73 56.55 2c3p s ARG 664 Cb 0.00 -1.94 -0.03 0.00 -0.57 0.00 0.00 34.95 32.41 2c3p s ARG 664 CO 0.00 -1.34 -0.14 -0.06 -1.08 0.00 0.00 175.30 172.68 2c3p s PHE 665 N -2.65 1.25 0.53 5.89 0.40 -1.26 -4.60 117.98 117.54 2c3p s PHE 665 Ca 0.63 -0.50 -0.13 0.00 -0.60 0.00 0.00 56.93 56.33 2c3p s PHE 665 Cb -0.18 -0.69 -0.06 0.00 0.51 0.00 0.00 43.02 42.60 2c3p s PHE 665 CO 0.48 0.07 0.96 -1.25 0.70 0.00 0.00 175.22 176.19 2c3p s PRO 666 N -2.09 3.79 0.77 0.24 0.04 -1.26 -5.05 135.00 131.44 2c3p s PRO 666 Ca 0.02 0.78 -0.11 0.00 0.04 0.00 0.00 61.00 61.72 2c3p s PRO 666 Cb -0.08 -2.17 0.05 0.00 0.04 0.00 0.00 34.50 32.35 2c3p s PRO 666 CO 0.02 -0.33 1.08 -0.51 0.04 0.00 0.00 177.00 177.30 2c3p s LEU 667 N -4.44 2.87 -1.18 -3.56 1.02 -1.26 -4.40 118.68 107.73 2c3p s LEU 667 Ca 0.56 1.59 0.00 0.00 0.02 0.00 0.00 54.13 56.29 2c3p s LEU 667 Cb -0.10 -4.29 0.00 0.00 0.02 0.00 0.00 46.19 41.81 2c3p s LEU 667 CO 0.39 -1.88 0.00 0.61 0.02 0.00 0.00 176.35 175.49 2c3p n GLY 668 N -1.69 1.03 0.00 -3.19 0.00 0.95 -4.88 105.19 97.42 2c3p n GLY 668 Ca 0.08 -0.48 0.11 0.00 0.00 0.00 0.00 46.02 45.72 2c3p n GLY 668 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c3p n THR 669 N -2.90 0.49 0.68 2.61 -2.24 -1.03 -2.60 114.28 109.30 2c3p n THR 669 Ca -0.12 0.12 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 2c3p n THR 669 Cb 0.42 -0.75 0.36 0.00 -2.10 0.00 0.00 70.33 68.26 2c3p n THR 669 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2c3p n SER 670 N -1.48 0.67 0.10 3.42 3.41 -0.95 -3.59 113.62 115.20 2c3p n SER 670 Ca 0.06 0.41 0.18 0.00 -0.26 0.00 0.00 58.87 59.26 2c3p n SER 670 Cb 0.25 -0.47 0.74 0.00 -0.26 0.00 0.00 64.21 64.47 2c3p n SER 670 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2c3p h GLN 671 N 0.00 0.00 -0.10 4.33 1.08 -1.76 -2.67 115.11 115.99 2c3p h GLN 671 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2c3p h GLN 671 Cb 0.70 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.13 2c3p h GLN 671 CO 0.00 0.00 0.00 1.19 -0.95 0.00 0.00 178.83 179.07 2c3p n PHE 672 N -4.10 0.11 -0.09 2.96 3.01 -1.24 -4.59 117.46 113.52 2c3p n PHE 672 Ca 0.06 -0.07 -0.11 0.00 1.01 0.00 0.00 57.45 58.33 2c3p n PHE 672 Cb 0.48 -0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.91 2c3p n PHE 672 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2c3p h GLU 673 N 3.58 0.49 -6.93 -1.08 5.08 -1.66 -3.47 114.58 110.60 2c3p h GLU 673 Ca 0.00 -0.17 -0.50 0.00 -1.00 0.00 0.00 59.36 57.69 2c3p h GLU 673 Cb 0.79 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.92 2c3p h GLU 673 CO 0.00 0.67 -0.82 1.63 -1.00 0.00 0.00 179.01 179.49 2c3p n LYS 674 N -4.58 -0.57 -0.14 2.33 4.76 -1.26 -4.82 118.16 113.88 2c3p n LYS 674 Ca -0.03 -0.01 0.07 0.00 -2.87 0.00 0.00 58.31 55.47 2c3p n LYS 674 Cb 0.27 -2.24 0.39 0.00 -1.84 0.00 0.00 35.03 31.61 2c3p n LYS 674 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2c3p h ARG 675 N -1.51 0.65 -5.67 1.97 3.08 -1.91 -3.47 114.38 107.52 2c3p h ARG 675 Ca -0.57 -0.04 -0.34 0.00 0.07 0.00 0.00 59.98 59.10 2c3p h ARG 675 Cb 1.15 -0.15 0.17 0.00 0.08 0.00 0.00 29.97 31.22 2c3p h ARG 675 CO 0.48 0.43 -0.76 0.41 -1.07 0.00 0.00 179.97 179.46 2c3p n GLY 676 N -1.46 -0.38 0.90 0.04 0.00 0.64 -4.94 105.19 99.99 2c3p n GLY 676 Ca 0.09 0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.33 2c3p n GLY 676 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2c3p n VAL 677 N -4.22 0.46 -2.38 1.61 0.24 -1.26 -4.96 118.33 107.81 2c3p n VAL 677 Ca -0.26 -0.73 -0.39 0.00 -2.04 0.00 0.00 64.34 60.92 2c3p n VAL 677 Cb 0.66 0.98 -0.03 0.00 -1.47 0.00 0.00 33.84 33.98 2c3p n VAL 677 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c3p s ALA 678 N -1.31 3.30 -0.06 2.33 0.00 -1.25 -4.94 121.76 119.84 2c3p s ALA 678 Ca 0.30 0.94 -0.21 0.00 0.00 0.00 0.00 51.96 52.99 2c3p s ALA 678 Cb 0.18 -3.36 -0.30 0.00 0.00 0.00 0.00 23.12 19.64 2c3p s ALA 678 CO 0.25 -0.34 0.82 0.82 0.00 0.00 0.00 175.76 177.31 2c3p h ILE 679 N 2.74 1.42 -4.22 0.00 2.04 -1.89 -3.42 117.51 114.17 2c3p h ILE 679 Ca -0.48 -2.50 -0.54 0.00 1.00 0.00 0.00 64.86 62.34 2c3p h ILE 679 Cb 1.22 3.10 -0.27 0.00 -0.74 0.00 0.00 36.82 40.13 2c3p h ILE 679 CO 0.65 0.71 -0.83 0.20 0.00 0.00 0.00 178.15 178.87 2c3p s ASN 680 N -6.97 2.14 0.26 1.72 0.01 -1.26 -1.77 114.94 109.06 2c3p s ASN 680 Ca -0.15 -0.41 0.06 0.00 -0.71 0.00 0.00 52.86 51.65 2c3p s ASN 680 Cb 0.01 -0.20 -0.05 0.00 0.41 0.00 0.00 41.25 41.42 2c3p s ASN 680 CO 0.81 0.17 -0.06 0.68 -1.51 0.00 0.00 177.10 177.19 2c3p s VAL 681 N -0.62 1.49 0.58 1.60 -7.23 0.70 -3.97 120.40 112.95 2c3p s VAL 681 Ca 0.06 -2.11 -0.15 0.00 -1.81 0.00 0.00 61.98 57.97 2c3p s VAL 681 Cb -0.08 -2.36 -0.05 0.00 0.56 0.00 0.00 36.38 34.45 2c3p s VAL 681 CO 0.00 -0.35 1.03 -2.16 -0.31 0.00 0.00 175.10 173.31 2c3p s PRO 682 N -3.75 3.53 -0.11 4.82 0.04 -1.26 -0.25 135.00 138.01 2c3p s PRO 682 Ca 0.28 1.03 0.01 0.00 0.04 0.00 0.00 61.00 62.36 2c3p s PRO 682 Cb 0.04 -2.07 0.02 0.00 0.04 0.00 0.00 34.50 32.53 2c3p s PRO 682 CO 0.10 -0.63 -0.13 -1.14 0.04 0.00 0.00 177.00 175.25 2c3p s GLN 683 N -4.32 1.98 0.09 4.56 0.74 0.82 -4.83 119.66 118.70 2c3p s GLN 683 Ca 0.60 -0.46 -0.30 0.00 0.05 0.00 0.00 55.36 55.25 2c3p s GLN 683 Cb -0.13 -1.79 -0.06 0.00 1.10 0.00 0.00 33.01 32.13 2c3p s GLN 683 CO 0.39 -0.14 1.08 -0.46 -0.55 0.00 0.00 175.29 175.61 2c3p s TRP 684 N 1.24 3.60 -0.71 1.67 -0.00 -1.26 -1.72 118.94 121.77 2c3p s TRP 684 Ca -0.02 1.57 0.02 0.00 -0.00 0.00 0.00 56.10 57.68 2c3p s TRP 684 Cb -0.14 -3.24 0.17 0.00 -0.00 0.00 0.00 33.47 30.26 2c3p s TRP 684 CO -0.05 -0.52 0.52 0.08 -0.00 0.00 0.00 176.95 176.98 2c3p s VAL 685 N 0.44 3.28 0.66 5.86 1.01 0.29 -4.97 120.40 126.98 2c3p s VAL 685 Ca 0.52 -3.89 0.26 0.00 0.00 0.00 0.00 61.98 58.87 2c3p s VAL 685 Cb -0.27 -3.13 0.27 0.00 0.00 0.00 0.00 36.38 33.25 2c3p s VAL 685 CO 0.31 -0.98 1.79 1.55 0.00 0.00 0.00 175.10 177.78 2c3p h PRO 686 N 5.89 0.00 0.00 2.72 0.13 -1.94 -1.15 132.00 137.65 2c3p h PRO 686 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2c3p h PRO 686 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2c3p h PRO 686 CO 0.75 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.45 2c3p h GLU 687 N 0.00 0.00 -0.00 0.86 3.07 -1.95 -3.10 114.58 113.46 2c3p h GLU 687 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2c3p h GLU 687 Cb 0.88 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.79 2c3p h GLU 687 CO -0.00 0.00 -0.31 0.09 -1.40 0.00 0.00 179.01 177.39 2c3p n ASN 688 N -2.92 0.63 -4.69 1.42 5.03 -0.44 -5.02 115.26 109.28 2c3p n ASN 688 Ca 0.01 -0.82 -0.42 0.00 0.87 0.00 0.00 54.58 54.22 2c3p n ASN 688 Cb 0.31 0.81 -0.03 0.00 -1.02 0.00 0.00 39.78 39.86 2c3p n ASN 688 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2c3p n ILE 690 N 4.51 1.56 -3.72 0.00 -5.35 -1.26 -4.97 119.36 110.13 2c3p n ILE 690 Ca 0.13 -1.07 -0.22 0.00 -0.27 0.00 0.00 62.75 61.32 2c3p n ILE 690 Cb 0.43 0.17 0.03 0.00 -1.74 0.00 0.00 39.64 38.53 2c3p n ILE 690 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c3p n GLN 691 N 1.15 -5.10 0.04 6.28 6.02 -1.26 -4.95 117.38 119.56 2c3p n GLN 691 Ca 0.24 0.63 0.03 0.00 -0.01 0.00 0.00 57.00 57.89 2c3p n GLN 691 Cb 0.79 -5.25 -0.07 0.00 1.02 0.00 0.00 30.24 26.73 2c3p n GLN 691 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2c3p n ASN 693 N -2.77 -3.79 0.07 0.00 3.02 -1.26 -4.36 115.26 106.17 2c3p n ASN 693 Ca -0.08 0.08 -0.08 0.00 -0.03 0.00 0.00 54.58 54.48 2c3p n ASN 693 Cb 0.76 -1.59 0.05 0.00 -0.61 0.00 0.00 39.78 38.39 2c3p n ASN 693 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2c3p h GLN 694 N 0.31 0.32 -0.63 3.52 4.20 -1.94 -2.61 115.11 118.28 2c3p h GLN 694 Ca -0.07 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.38 2c3p h GLN 694 Cb 0.35 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 2c3p h GLN 694 CO 0.10 0.90 0.36 0.00 -0.67 0.00 0.00 178.83 179.52 2c3p h ALA 696 N 1.18 0.59 -0.88 0.00 0.00 -1.86 -2.70 119.26 115.60 2c3p h ALA 696 Ca 0.22 -0.48 0.06 0.00 0.00 0.00 0.00 54.91 54.72 2c3p h ALA 696 Cb 0.01 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 2c3p h ALA 696 CO -0.04 0.68 0.55 0.35 0.00 0.00 0.00 179.25 180.78 2c3p h PHE 697 N 0.67 1.01 0.00 0.00 3.57 -1.19 -3.11 116.94 117.89 2c3p h PHE 697 Ca 0.04 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 2c3p h PHE 697 Cb 1.04 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.45 2c3p h PHE 697 CO 0.06 0.51 -0.46 0.28 -2.23 0.00 0.00 178.31 176.47 2c3p h VAL 698 N 1.00 0.10 -2.33 1.41 2.07 -1.29 -3.46 116.25 113.73 2c3p h VAL 698 Ca 0.38 -1.15 -0.56 0.00 0.82 0.00 0.00 66.70 66.20 2c3p h VAL 698 Cb 0.17 1.86 0.03 0.00 -1.52 0.00 0.00 31.29 31.84 2c3p h VAL 698 CO -0.17 0.05 1.10 0.00 0.02 0.00 0.00 177.57 178.57 2c3p n PRO 700 N 6.03 0.26 0.00 0.00 -0.02 -1.26 -3.40 135.00 136.61 2c3p n PRO 700 Ca 0.19 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2c3p n PRO 700 Cb 0.35 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 2c3p n PRO 700 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2c3p n HIS 701 N -1.29 0.00 -2.54 6.00 8.25 -1.26 -4.60 115.22 119.78 2c3p n HIS 701 Ca 0.09 -0.16 -0.18 0.00 -0.26 0.00 0.00 57.72 57.21 2c3p n HIS 701 Cb 0.15 -0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.25 2c3p n HIS 701 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2c3p n SER 702 N -0.16 -5.29 -0.19 0.41 2.88 -1.22 -1.44 113.62 108.61 2c3p n SER 702 Ca 0.00 -0.10 0.15 0.00 -1.33 0.00 0.00 58.87 57.59 2c3p n SER 702 Cb 0.34 -4.28 0.75 0.00 -0.75 0.00 0.00 64.21 60.27 2c3p n SER 702 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2c3p n ALA 703 N -2.37 2.64 -3.49 -1.46 0.00 -1.26 -4.75 120.51 109.81 2c3p n ALA 703 Ca -0.17 -0.29 -0.33 0.00 0.00 0.00 0.00 53.44 52.65 2c3p n ALA 703 Cb 0.64 -1.36 -0.15 0.00 0.00 0.00 0.00 19.45 18.58 2c3p n ALA 703 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2c3p s ILE 704 N -1.99 2.59 -0.34 0.00 1.01 -1.26 -0.00 121.20 121.20 2c3p s ILE 704 Ca 0.42 -0.79 -0.02 0.00 0.00 0.00 0.00 60.65 60.26 2c3p s ILE 704 Cb 0.21 -2.09 0.08 0.00 0.01 0.00 0.00 42.46 40.66 2c3p s ILE 704 CO 0.34 0.52 0.08 -0.22 0.00 0.00 0.00 174.94 175.66 2c3p s LEU 705 N 0.83 4.47 0.41 2.97 2.96 0.49 -4.77 118.68 126.04 2c3p s LEU 705 Ca -0.05 -1.62 -0.25 0.00 -0.22 0.00 0.00 54.13 51.99 2c3p s LEU 705 Cb -0.15 -1.75 -0.08 0.00 0.50 0.00 0.00 46.19 44.70 2c3p s LEU 705 CO -0.01 -0.37 1.19 -2.84 -1.32 0.00 0.00 176.35 173.00 2c3p s PRO 706 N 1.18 3.98 -0.04 0.98 0.02 -1.26 -0.83 135.00 139.03 2c3p s PRO 706 Ca 0.01 1.87 0.04 0.00 0.02 0.00 0.00 61.00 62.94 2c3p s PRO 706 Cb -0.21 -2.64 -0.00 0.00 0.02 0.00 0.00 34.50 31.67 2c3p s PRO 706 CO -0.03 -0.39 -0.15 0.08 -0.33 0.00 0.00 177.00 176.18 2c3p s VAL 707 N -1.41 1.31 -0.28 3.83 1.01 0.32 -4.89 120.40 120.28 2c3p s VAL 707 Ca 0.58 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.89 2c3p s VAL 707 Cb -0.31 -1.13 0.09 0.00 0.00 0.00 0.00 36.38 35.03 2c3p s VAL 707 CO 0.39 0.38 0.10 -0.22 0.00 0.00 0.00 175.10 175.75 2c3p s LEU 708 N 0.10 1.36 0.30 3.92 2.96 -1.26 -0.91 118.68 125.15 2c3p s LEU 708 Ca -0.04 -1.32 0.11 0.00 -0.22 0.00 0.00 54.13 52.66 2c3p s LEU 708 Cb -0.11 -0.60 -0.05 0.00 0.50 0.00 0.00 46.19 45.92 2c3p s LEU 708 CO 0.02 -0.40 -0.15 0.00 -1.32 0.00 0.00 176.35 174.49 2c3p s ALA 709 N 1.86 2.84 0.37 5.97 0.00 -0.46 -4.64 121.76 127.69 2c3p s ALA 709 Ca 0.07 -1.92 0.03 0.00 0.00 0.00 0.00 51.96 50.14 2c3p s ALA 709 Cb -0.17 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 2c3p s ALA 709 CO -0.26 0.22 0.55 0.15 0.00 0.00 0.00 175.76 176.43 2c3p s LYS 710 N -3.55 3.21 0.18 0.00 1.02 -1.26 -0.66 119.74 118.68 2c3p s LYS 710 Ca 0.31 -0.65 -0.20 0.00 0.02 0.00 0.00 55.97 55.46 2c3p s LYS 710 Cb -0.03 -2.70 0.13 0.00 -0.52 0.00 0.00 37.83 34.71 2c3p s LYS 710 CO 0.16 -0.00 1.60 0.93 -0.92 0.00 0.00 175.35 177.12 2c3p h GLU 711 N 0.71 -0.15 -0.98 1.68 5.08 -1.98 -1.25 114.58 117.69 2c3p h GLU 711 Ca -0.47 0.01 0.21 0.00 -1.00 0.00 0.00 59.36 58.10 2c3p h GLU 711 Cb 1.24 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 30.44 2c3p h GLU 711 CO 0.57 -0.10 0.62 1.05 -1.00 0.00 0.00 179.01 180.15 2c3p h GLU 712 N -0.15 0.57 0.00 2.33 4.11 -1.99 -0.09 114.58 119.35 2c3p h GLU 712 Ca 0.23 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.62 2c3p h GLU 712 Cb 0.52 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2c3p h GLU 712 CO -0.61 0.37 0.00 0.39 0.07 0.00 0.00 179.01 179.24 2c3p n GLU 713 N -4.66 0.10 -0.26 1.06 1.02 -0.48 -3.16 120.64 114.27 2c3p n GLU 713 Ca 0.22 0.15 0.07 0.00 -0.02 0.00 0.00 57.16 57.58 2c3p n GLU 713 Cb 0.67 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.78 2c3p n GLU 713 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2c3p n LEU 714 N -1.42 3.25 0.45 -4.62 4.32 -0.05 -4.76 117.00 114.16 2c3p n LEU 714 Ca 0.06 -2.22 -0.17 0.00 -0.02 0.00 0.00 56.01 53.66 2c3p n LEU 714 Cb 0.20 -0.32 -0.08 0.00 -1.62 0.00 0.00 43.42 41.59 2c3p n LEU 714 CO 0.16 0.74 0.50 0.58 -1.22 0.00 0.00 177.39 178.15 2c3p h VAL 715 N 2.18 0.00 0.00 4.08 2.07 -1.59 -2.92 116.25 120.08 2c3p h VAL 715 Ca 0.00 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2c3p h VAL 715 Cb 0.92 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2c3p h VAL 715 CO 0.05 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.25 2c3p n GLY 716 N -1.36 0.53 3.75 2.17 0.00 -1.26 -4.89 105.19 104.13 2c3p n GLY 716 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2c3p n GLY 716 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p s ALA 717 N -1.37 3.50 0.70 4.61 0.00 -1.10 -4.98 121.76 123.11 2c3p s ALA 717 Ca 0.00 1.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.89 2c3p s ALA 717 Cb 0.00 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.61 2c3p s ALA 717 CO 0.00 -0.50 0.52 -2.30 0.00 0.00 0.00 175.76 173.48 2c3p n PRO 718 N 2.11 0.34 -0.28 0.00 -0.02 -1.26 -4.84 135.00 131.05 2c3p n PRO 718 Ca 0.04 0.15 0.04 0.00 -2.02 0.00 0.00 63.50 61.71 2c3p n PRO 718 Cb 0.43 -1.80 0.18 0.00 -0.02 0.00 0.00 33.50 32.28 2c3p n PRO 718 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c3p h ALA 719 N -0.26 1.15 0.00 3.55 0.00 -1.98 -1.47 119.26 120.25 2c3p h ALA 719 Ca -0.45 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2c3p h ALA 719 Cb 1.36 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2c3p h ALA 719 CO 0.43 -0.02 0.00 0.27 0.00 0.00 0.00 179.25 179.93 2c3p n ASN 720 N -4.83 0.00 -2.88 0.00 6.94 -1.26 -4.44 115.26 108.79 2c3p n ASN 720 Ca 0.14 -1.41 -0.24 0.00 -0.02 0.00 0.00 54.58 53.05 2c3p n ASN 720 Cb 0.33 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.69 2c3p n ASN 720 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 2c3p n PHE 721 N -0.75 1.33 -1.67 -2.53 7.35 -0.56 -4.92 117.46 115.71 2c3p n PHE 721 Ca 0.11 -2.15 -0.47 0.00 -0.76 0.00 0.00 57.45 54.18 2c3p n PHE 721 Cb 0.05 -1.89 -0.04 0.00 0.35 0.00 0.00 39.48 37.95 2c3p n PHE 721 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 2c3p n THR 722 N 3.45 0.29 -4.29 -2.13 -1.04 -1.26 -4.98 114.28 104.32 2c3p n THR 722 Ca 0.54 -0.05 -0.18 0.00 -2.04 0.00 0.00 64.05 62.32 2c3p n THR 722 Cb 0.36 -1.71 -0.15 0.00 -1.82 0.00 0.00 70.33 67.02 2c3p n THR 722 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2c3p s ALA 723 N 2.47 0.64 0.42 2.41 0.00 -1.26 -4.81 121.76 121.63 2c3p s ALA 723 Ca 0.86 -0.32 -0.05 0.00 0.00 0.00 0.00 51.96 52.45 2c3p s ALA 723 Cb -0.68 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.22 2c3p s ALA 723 CO 0.44 0.15 0.71 -0.51 0.00 0.00 0.00 175.76 176.55 2c3p s LEU 724 N -0.13 3.79 0.06 0.00 1.43 0.22 -4.82 118.68 119.23 2c3p s LEU 724 Ca 0.02 0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 53.67 2c3p s LEU 724 Cb -0.04 -3.76 -0.05 0.00 0.03 0.00 0.00 46.19 42.38 2c3p s LEU 724 CO -0.00 -0.44 1.04 -1.83 0.23 0.00 0.00 176.35 175.34 2c3p s GLU 725 N -4.34 4.57 0.15 1.70 -1.05 -1.26 0.10 118.70 118.58 2c3p s GLU 725 Ca 0.46 1.54 -0.34 0.00 -0.15 0.00 0.00 54.97 56.48 2c3p s GLU 725 Cb -0.10 -3.39 -0.14 0.00 -0.44 0.00 0.00 34.13 30.05 2c3p s GLU 725 CO 0.39 -0.02 1.56 0.00 0.95 0.00 0.00 175.26 178.14 2c3p n ALA 726 N 3.46 1.16 -2.15 -0.84 0.00 0.39 -4.74 120.51 117.79 2c3p n ALA 726 Ca 0.05 0.45 -0.33 0.00 0.00 0.00 0.00 53.44 53.62 2c3p n ALA 726 Cb 0.49 -2.33 -0.06 0.00 0.00 0.00 0.00 19.45 17.55 2c3p n ALA 726 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2c3p s LYS 727 N 0.89 4.02 0.00 0.00 1.02 -1.26 -4.59 119.74 119.82 2c3p s LYS 727 Ca 0.79 0.68 0.00 0.00 0.02 0.00 0.00 55.97 57.46 2c3p s LYS 727 Cb -0.70 -2.50 0.00 0.00 -0.52 0.00 0.00 37.83 34.11 2c3p s LYS 727 CO 0.39 0.19 0.00 0.41 -0.92 0.00 0.00 175.35 175.42 2c3p n GLY 728 N -0.22 2.63 0.15 -3.33 0.00 -1.26 -4.60 105.19 98.55 2c3p n GLY 728 Ca 0.03 -1.67 -0.10 0.00 0.00 0.00 0.00 46.02 44.28 2c3p n GLY 728 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2c3p h LYS 729 N 0.00 0.43 0.00 1.61 3.64 -2.00 -2.77 116.57 117.47 2c3p h LYS 729 Ca 0.00 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2c3p h LYS 729 Cb 0.00 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2c3p h LYS 729 CO 0.00 0.51 0.00 0.39 -2.27 0.00 0.00 179.45 178.08 2c3p n GLU 730 N -4.71 0.01 -0.32 1.90 4.71 -1.26 -2.59 120.64 118.39 2c3p n GLU 730 Ca -0.03 0.22 0.08 0.00 -0.01 0.00 0.00 57.16 57.42 2c3p n GLU 730 Cb 0.17 -1.50 0.21 0.00 -1.01 0.00 0.00 31.44 29.31 2c3p n GLU 730 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2c3p n LEU 731 N -1.49 3.39 -4.69 -4.62 4.77 -1.06 -5.00 117.00 108.30 2c3p n LEU 731 Ca 0.04 -2.73 -0.44 0.00 -0.03 0.00 0.00 56.01 52.85 2c3p n LEU 731 Cb 0.18 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 40.81 2c3p n LEU 731 CO 0.15 0.68 1.40 1.17 -1.33 0.00 0.00 177.39 179.46 2c3p n LYS 732 N -0.37 2.60 0.00 3.23 4.81 -1.07 -1.95 118.16 125.41 2c3p n LYS 732 Ca 0.17 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.56 2c3p n LYS 732 Cb 0.72 -2.80 0.00 0.00 0.02 0.00 0.00 35.03 32.97 2c3p n LYS 732 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2c3p n GLY 733 N 4.03 2.08 3.89 3.14 0.00 -1.26 -5.06 105.19 112.00 2c3p n GLY 733 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2c3p n GLY 733 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c3p s TYR 734 N -2.42 3.46 -0.21 1.61 1.51 -0.82 -4.61 117.35 115.87 2c3p s TYR 734 Ca 0.00 0.85 -0.07 0.00 -1.01 0.00 0.00 57.07 56.85 2c3p s TYR 734 Cb 0.00 -2.27 -0.03 0.00 -0.11 0.00 0.00 41.96 39.54 2c3p s TYR 734 CO 0.00 0.10 0.05 0.15 -1.11 0.00 0.00 175.55 174.74 2c3p s LYS 735 N -3.45 3.81 -0.08 -0.62 -0.14 0.16 0.15 119.74 119.57 2c3p s LYS 735 Ca 0.48 -0.42 -0.03 0.00 -1.36 0.00 0.00 55.97 54.64 2c3p s LYS 735 Cb -0.11 -3.22 -0.04 0.00 -1.68 0.00 0.00 37.83 32.78 2c3p s LYS 735 CO 0.28 0.08 0.06 0.12 -0.76 0.00 0.00 175.35 175.13 2c3p s PHE 736 N 0.87 3.31 -0.10 3.18 5.36 0.12 -1.36 117.98 129.36 2c3p s PHE 736 Ca 0.03 0.29 -0.14 0.00 -0.96 0.00 0.00 56.93 56.15 2c3p s PHE 736 Cb -0.14 -1.82 0.03 0.00 -0.34 0.00 0.00 43.02 40.76 2c3p s PHE 736 CO 0.02 0.56 0.37 0.50 -1.46 0.00 0.00 175.22 175.21 2c3p s ARG 737 N -1.13 0.53 -0.41 10.12 3.52 -0.09 -0.61 118.95 130.88 2c3p s ARG 737 Ca 0.16 0.30 -0.09 0.00 -0.13 0.00 0.00 55.73 55.97 2c3p s ARG 737 Cb -0.12 0.25 0.07 0.00 -1.56 0.00 0.00 34.95 33.59 2c3p s ARG 737 CO 0.05 -0.10 0.24 0.42 -0.81 0.00 0.00 175.30 175.11 2c3p s ILE 738 N -0.31 4.19 -0.31 4.11 -1.09 -1.26 0.12 121.20 126.64 2c3p s ILE 738 Ca -0.05 -1.36 -0.17 0.00 -2.23 0.00 0.00 60.65 56.84 2c3p s ILE 738 Cb -0.03 -3.54 -0.02 0.00 -1.58 0.00 0.00 42.46 37.29 2c3p s ILE 738 CO 0.02 -0.47 0.48 -1.58 -1.23 0.00 0.00 174.94 172.16 2c3p s GLN 739 N 1.42 3.81 -0.13 2.79 2.00 -0.01 -4.84 119.66 124.70 2c3p s GLN 739 Ca 0.03 -0.01 -0.25 0.00 -2.00 0.00 0.00 55.36 53.12 2c3p s GLN 739 Cb -0.22 -3.74 -0.02 0.00 0.80 0.00 0.00 33.01 29.83 2c3p s GLN 739 CO 0.02 -0.49 0.83 0.42 -0.50 0.00 0.00 175.29 175.57 2c3p s ILE 740 N 2.28 4.91 -1.11 -2.34 -1.09 -1.26 -0.38 121.20 122.21 2c3p s ILE 740 Ca 0.18 1.65 -0.16 0.00 -2.23 0.00 0.00 60.65 60.09 2c3p s ILE 740 Cb -0.16 -4.14 0.15 0.00 -1.58 0.00 0.00 42.46 36.74 2c3p s ILE 740 CO 0.11 0.08 1.33 0.21 -1.23 0.00 0.00 174.94 175.45 2c3p s ASN 741 N 1.08 6.91 0.52 3.58 3.84 1.00 -4.74 114.94 127.12 2c3p s ASN 741 Ca 0.40 -2.64 0.20 0.00 0.21 0.00 0.00 52.86 51.03 2c3p s ASN 741 Cb -0.17 -2.41 1.33 0.00 -0.55 0.00 0.00 41.25 39.45 2c3p s ASN 741 CO 0.15 -0.87 2.08 0.71 -2.79 0.00 0.00 177.10 176.38 2c3p h THR 742 N 5.11 0.88 0.00 -5.21 1.35 -1.88 -2.13 112.91 111.03 2c3p h THR 742 Ca 0.26 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 66.07 2c3p h THR 742 Cb 0.93 0.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 2c3p h THR 742 CO 1.20 0.00 -0.42 -0.07 -0.25 0.00 0.00 175.52 175.98 2c3p h LEU 743 N 0.00 0.00 -0.34 3.87 3.38 -1.93 -3.26 115.31 117.03 2c3p h LEU 743 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2c3p h LEU 743 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2c3p h LEU 743 CO -0.00 0.23 -0.67 0.47 0.09 0.00 0.00 178.44 178.56 2c3p n ASP 744 N -3.07 1.20 -4.77 -0.43 8.00 -1.02 -0.26 116.55 116.19 2c3p n ASP 744 Ca 0.02 -1.00 -0.37 0.00 0.71 0.00 0.00 54.79 54.15 2c3p n ASP 744 Cb 0.63 0.61 -0.01 0.00 -0.02 0.00 0.00 41.12 42.32 2c3p n ASP 744 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c3p n MET 746 N -0.45 1.24 -3.34 0.00 2.81 -1.26 -3.77 117.12 112.36 2c3p n MET 746 Ca 0.07 -1.47 -0.20 0.00 -1.81 0.00 0.00 57.70 54.29 2c3p n MET 746 Cb 0.48 -1.30 0.06 0.00 -0.71 0.00 0.00 33.22 31.75 2c3p n MET 746 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c3p n GLY 747 N 0.89 -0.31 0.11 3.03 0.00 -1.25 -4.59 105.19 103.07 2c3p n GLY 747 Ca 0.09 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 2c3p n GLY 747 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p n GLY 749 N 1.27 0.70 0.24 0.00 0.00 -1.26 -3.14 105.19 102.99 2c3p n GLY 749 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.92 2c3p n GLY 749 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2c3p h ASN 750 N 0.00 0.53 0.56 1.61 2.35 -1.86 0.45 115.58 119.22 2c3p h ASN 750 Ca 0.00 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 2c3p h ASN 750 Cb 0.00 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 2c3p h ASN 750 CO 0.00 0.36 -0.40 0.00 -1.65 0.00 0.00 177.43 175.74 2c3p h ALA 752 N -0.64 1.69 -0.07 0.00 0.00 -1.82 -0.80 119.26 117.62 2c3p h ALA 752 Ca -0.06 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2c3p h ALA 752 Cb 0.78 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2c3p h ALA 752 CO 0.03 0.17 -0.25 0.22 0.00 0.00 0.00 179.25 179.42 2c3p h ASP 753 N 0.79 0.12 -0.01 0.00 3.58 -0.21 -3.19 116.42 117.49 2c3p h ASP 753 Ca 0.34 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.76 2c3p h ASP 753 Cb 0.32 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.34 2c3p h ASP 753 CO -0.12 0.37 -0.35 2.30 -2.88 0.00 0.00 179.24 178.56 2c3p n ILE 754 N -4.20 0.00 -1.52 2.25 -6.64 -0.61 -4.96 119.36 103.68 2c3p n ILE 754 Ca -0.01 -0.32 -0.54 0.00 -1.77 0.00 0.00 62.75 60.10 2c3p n ILE 754 Cb 0.33 1.17 -0.07 0.00 -1.44 0.00 0.00 39.64 39.62 2c3p n ILE 754 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2c3p h PRO 756 N 10.21 -0.04 -6.48 0.00 0.11 -1.92 -3.45 132.00 130.43 2c3p h PRO 756 Ca -0.33 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.18 2c3p h PRO 756 Cb 1.33 0.01 0.08 0.00 0.11 0.00 0.00 31.00 32.53 2c3p h PRO 756 CO 1.00 -0.03 0.49 -0.35 -0.21 0.00 0.00 178.00 178.91 2c3p n PRO 757 N -5.11 1.69 -0.31 1.05 -0.04 -1.26 -4.87 135.00 126.15 2c3p n PRO 757 Ca 0.01 0.60 0.06 0.00 -0.04 0.00 0.00 63.50 64.13 2c3p n PRO 757 Cb 0.25 -2.21 0.21 0.00 -0.04 0.00 0.00 33.50 31.71 2c3p n PRO 757 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2c3p h LYS 758 N 4.04 0.73 -4.77 0.54 1.57 -1.96 -2.82 116.57 113.90 2c3p h LYS 758 Ca -0.44 -0.04 -0.71 0.00 -1.87 0.00 0.00 60.65 57.58 2c3p h LYS 758 Cb 1.30 -0.17 -0.19 0.00 0.08 0.00 0.00 32.23 33.25 2c3p h LYS 758 CO 0.75 0.49 0.81 -2.00 -0.57 0.00 0.00 179.45 178.92 2c3p s GLU 759 N -5.99 3.70 0.20 3.15 2.56 -1.26 -5.00 118.70 116.06 2c3p s GLU 759 Ca -0.12 -2.04 -0.30 0.00 0.00 0.00 0.00 54.97 52.51 2c3p s GLU 759 Cb 0.21 -4.87 -0.16 0.00 2.00 0.00 0.00 34.13 31.31 2c3p s GLU 759 CO 0.79 -1.69 0.87 1.63 -0.56 0.00 0.00 175.26 176.29 2c3p n LYS 760 N 5.93 0.65 0.00 4.30 4.76 -1.07 -4.75 118.16 127.98 2c3p n LYS 760 Ca 0.25 0.23 0.12 0.00 -2.87 0.00 0.00 58.31 56.04 2c3p n LYS 760 Cb 0.47 -1.50 0.27 0.00 -1.84 0.00 0.00 35.03 32.44 2c3p n LYS 760 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2c3p n ALA 761 N 0.58 3.30 -3.71 7.82 0.00 -1.26 -4.78 120.51 122.46 2c3p n ALA 761 Ca 0.15 -0.45 -0.24 0.00 0.00 0.00 0.00 53.44 52.91 2c3p n ALA 761 Cb 0.25 -1.06 -0.17 0.00 0.00 0.00 0.00 19.45 18.47 2c3p n ALA 761 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2c3p s LEU 762 N -2.59 1.20 -0.03 0.00 1.43 -1.26 0.11 118.68 117.54 2c3p s LEU 762 Ca 0.21 -0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 2c3p s LEU 762 Cb 0.19 -0.65 0.01 0.00 0.03 0.00 0.00 46.19 45.77 2c3p s LEU 762 CO 0.57 -0.08 -0.09 -0.69 0.23 0.00 0.00 176.35 176.28 2c3p s VAL 763 N 1.33 0.83 0.23 -1.59 1.01 -0.70 -4.72 120.40 116.78 2c3p s VAL 763 Ca -0.04 -0.36 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 2c3p s VAL 763 Cb -0.14 -0.75 -0.09 0.00 0.00 0.00 0.00 36.38 35.41 2c3p s VAL 763 CO -0.03 0.26 1.18 -0.04 0.00 0.00 0.00 175.10 176.48 2c3p s MET 764 N 0.33 4.52 0.05 2.72 1.00 -1.26 -0.13 119.30 126.53 2c3p s MET 764 Ca -0.06 1.89 -0.08 0.00 0.00 0.00 0.00 55.69 57.45 2c3p s MET 764 Cb -0.10 -3.21 -0.00 0.00 0.00 0.00 0.00 34.83 31.51 2c3p s MET 764 CO 0.01 -0.02 0.15 -0.65 0.00 0.00 0.00 175.02 174.51 2c3p s GLN 765 N -0.72 0.68 0.28 2.03 -1.52 0.65 -4.92 119.66 116.15 2c3p s GLN 765 Ca 0.50 -0.76 -0.30 0.00 -1.95 0.00 0.00 55.36 52.85 2c3p s GLN 765 Cb -0.33 0.27 -0.13 0.00 -0.22 0.00 0.00 33.01 32.61 2c3p s GLN 765 CO 0.39 -0.19 1.42 -2.30 -0.25 0.00 0.00 175.29 174.36 2c3p n PRO 766 N 0.54 2.21 -0.27 2.91 -0.02 -1.26 -0.22 135.00 138.90 2c3p n PRO 766 Ca -0.18 0.78 0.08 0.00 -2.02 0.00 0.00 63.50 62.17 2c3p n PRO 766 Cb 0.59 -2.45 0.22 0.00 -0.02 0.00 0.00 33.50 31.84 2c3p n PRO 766 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2c3p h LEU 767 N 3.87 -0.02 -1.71 2.45 5.85 -1.61 -0.39 115.31 123.76 2c3p h LEU 767 Ca -0.46 0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.45 2c3p h LEU 767 Cb 1.27 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.51 2c3p h LEU 767 CO 0.73 -0.09 0.22 -2.24 -0.34 0.00 0.00 178.44 176.72 2c3p h ASP 768 N 0.24 0.34 0.60 1.25 3.04 -1.90 0.42 116.42 120.42 2c3p h ASP 768 Ca 0.47 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 54.25 2c3p h ASP 768 Cb 0.86 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 39.07 2c3p h ASP 768 CO -0.58 0.24 0.00 0.35 -2.04 0.00 0.00 179.24 177.21 2c3p n THR 769 N -4.49 0.59 -0.01 1.15 -2.24 -0.16 -3.93 114.28 105.20 2c3p n THR 769 Ca 0.02 0.15 -0.01 0.00 -2.27 0.00 0.00 64.05 61.95 2c3p n THR 769 Cb 0.10 -0.81 -0.01 0.00 -2.10 0.00 0.00 70.33 67.51 2c3p n THR 769 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c3p n GLN 770 N -1.45 3.37 -0.08 -0.78 1.13 -0.06 -4.85 117.38 114.66 2c3p n GLN 770 Ca 0.06 -0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 55.02 2c3p n GLN 770 Cb 0.21 -1.04 -0.02 0.00 0.11 0.00 0.00 30.24 29.50 2c3p n GLN 770 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 2c3p h ARG 771 N 0.00 0.37 -0.93 -1.09 0.11 -1.13 -1.56 114.38 110.15 2c3p h ARG 771 Ca -0.03 -0.03 0.13 0.00 0.10 0.00 0.00 59.98 60.15 2c3p h ARG 771 Cb 0.98 -0.08 -0.09 0.00 1.11 0.00 0.00 29.97 31.89 2c3p h ARG 771 CO 0.00 0.27 0.55 -0.44 0.10 0.00 0.00 179.97 180.45 2c3p h ASP 772 N 0.36 0.76 0.01 0.08 3.32 -1.86 0.91 116.42 120.00 2c3p h ASP 772 Ca 0.10 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2c3p h ASP 772 Cb -0.01 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.47 2c3p h ASP 772 CO -0.02 0.37 -0.14 0.00 -1.72 0.00 0.00 179.24 177.73 2c3p h ALA 773 N 1.54 -0.00 0.00 3.45 0.00 -1.88 -3.39 119.26 118.98 2c3p h ALA 773 Ca 0.48 -0.48 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2c3p h ALA 773 Cb 0.57 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2c3p h ALA 773 CO -0.30 0.03 -0.61 1.96 0.00 0.00 0.00 179.25 180.33 2c3p h GLN 774 N -0.76 0.00 0.45 0.00 1.08 -1.03 -3.18 115.11 111.67 2c3p h GLN 774 Ca -0.02 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 2c3p h GLN 774 Cb 1.01 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.43 2c3p h GLN 774 CO 0.03 0.61 -0.27 0.28 -0.95 0.00 0.00 178.83 178.53 2c3p h VAL 775 N 0.00 0.45 0.00 -0.54 2.07 -1.02 0.26 116.25 117.47 2c3p h VAL 775 Ca -0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 2c3p h VAL 775 Cb 1.24 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2c3p h VAL 775 CO 0.08 0.00 -0.10 1.55 0.02 0.00 0.00 177.57 179.12 2c3p h PRO 776 N -0.68 0.00 -0.13 1.57 0.13 -1.77 -2.02 132.00 129.10 2c3p h PRO 776 Ca -0.05 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.97 2c3p h PRO 776 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 2c3p h PRO 776 CO 0.06 0.10 -0.34 -0.91 -0.23 0.00 0.00 178.00 176.67 2c3p h ASN 777 N 0.00 0.52 -0.38 1.44 -0.26 -1.34 -1.54 115.58 114.03 2c3p h ASN 777 Ca -0.00 -0.59 -0.08 0.00 -0.56 0.00 0.00 56.30 55.08 2c3p h ASN 777 Cb 0.37 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.46 2c3p h ASN 777 CO 0.01 1.02 -0.06 0.25 -1.06 0.00 0.00 177.43 177.59 2c3p h LEU 778 N 0.05 0.70 -0.46 1.61 7.12 -0.33 -0.23 115.31 123.78 2c3p h LEU 778 Ca -0.01 -0.34 0.09 0.00 0.13 0.00 0.00 57.88 57.75 2c3p h LEU 778 Cb 0.96 -0.19 -0.08 0.00 -0.53 0.00 0.00 40.66 40.82 2c3p h LEU 778 CO 0.07 0.88 0.00 -0.08 -0.13 0.00 0.00 178.44 179.19 2c3p h GLU 779 N 0.51 0.11 -0.16 1.25 4.22 -1.37 0.34 114.58 119.48 2c3p h GLU 779 Ca 0.10 -0.01 -0.04 0.00 0.08 0.00 0.00 59.36 59.50 2c3p h GLU 779 Cb 0.56 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2c3p h GLU 779 CO 0.03 0.08 -0.05 -0.92 -2.18 0.00 0.00 179.01 175.97 2c3p h TYR 780 N 0.12 0.35 -0.84 0.92 3.20 -1.06 -3.11 116.97 116.54 2c3p h TYR 780 Ca 0.23 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 62.04 2c3p h TYR 780 Cb 0.34 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.48 2c3p h TYR 780 CO -0.29 0.59 0.55 0.00 -1.64 0.00 0.00 178.16 177.38 2c3p h ALA 781 N 0.70 1.42 -0.44 1.82 0.00 -0.48 -2.27 119.26 120.01 2c3p h ALA 781 Ca 0.04 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.02 2c3p h ALA 781 Cb 0.49 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2c3p h ALA 781 CO 0.02 0.53 0.33 0.00 0.00 0.00 0.00 179.25 180.13 2c3p h ALA 782 N 1.49 2.36 -0.09 0.00 0.00 -0.28 0.14 119.26 122.88 2c3p h ALA 782 Ca 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2c3p h ALA 782 Cb -0.09 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2c3p h ALA 782 CO -0.07 -0.56 0.00 0.54 0.00 0.00 0.00 179.25 179.16 2c3p n ARG 783 N -4.28 1.53 -3.21 0.00 1.74 -0.85 -4.81 116.66 106.77 2c3p n ARG 783 Ca 0.08 -0.79 -0.39 0.00 -0.77 0.00 0.00 57.85 55.98 2c3p n ARG 783 Cb 0.53 -1.41 -0.06 0.00 -1.02 0.00 0.00 32.46 30.50 2c3p n ARG 783 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2c3p s ILE 784 N -1.90 5.10 0.17 0.55 1.01 0.49 -5.01 121.20 121.62 2c3p s ILE 784 Ca 0.34 1.05 -0.33 0.00 0.00 0.00 0.00 60.65 61.72 2c3p s ILE 784 Cb 0.18 -3.88 -0.16 0.00 0.01 0.00 0.00 42.46 38.61 2c3p s ILE 784 CO 0.28 0.20 1.12 -2.65 0.00 0.00 0.00 174.94 173.89 2c3p n PRO 785 N 4.55 1.08 -2.59 2.79 -0.02 -1.26 -4.89 135.00 134.65 2c3p n PRO 785 Ca -0.04 0.38 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 2c3p n PRO 785 Cb 0.51 -1.85 -0.03 0.00 -0.02 0.00 0.00 33.50 32.10 2c3p n PRO 785 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c3p s VAL 786 N -0.27 4.55 -1.34 -1.45 1.01 -1.26 -4.82 120.40 116.82 2c3p s VAL 786 Ca 0.73 1.84 -0.12 0.00 0.00 0.00 0.00 61.98 64.43 2c3p s VAL 786 Cb -0.86 -4.18 0.12 0.00 0.00 0.00 0.00 36.38 31.45 2c3p s VAL 786 CO 0.53 0.04 1.95 0.29 0.00 0.00 0.00 175.10 177.91 2c3p n LYS 787 N 4.79 3.30 0.19 2.72 4.76 -1.26 -4.73 118.16 127.93 2c3p n LYS 787 Ca 0.09 -3.21 0.14 0.00 -2.87 0.00 0.00 58.31 52.46 2c3p n LYS 787 Cb 0.48 -3.11 0.47 0.00 -1.84 0.00 0.00 35.03 31.03 2c3p n LYS 787 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2c3p h SER 788 N 6.10 0.00 0.00 4.39 4.64 -1.81 -3.26 113.55 123.61 2c3p h SER 788 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 2c3p h SER 788 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 2c3p h SER 788 CO 1.67 0.00 -0.04 1.21 -0.87 0.00 0.00 176.83 178.80 2c3p n GLU 789 N -2.69 1.75 -0.05 4.77 4.07 -1.26 -4.46 120.64 122.76 2c3p n GLU 789 Ca 0.03 -1.17 -0.15 0.00 -0.06 0.00 0.00 57.16 55.81 2c3p n GLU 789 Cb 0.36 -1.48 -0.13 0.00 -0.06 0.00 0.00 31.44 30.14 2c3p n GLU 789 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2c3p h VAL 790 N 2.87 1.72 -2.07 6.31 2.07 -1.95 -3.47 116.25 121.73 2c3p h VAL 790 Ca 0.00 -2.25 -0.60 0.00 0.82 0.00 0.00 66.70 64.67 2c3p h VAL 790 Cb 0.64 3.24 -0.12 0.00 -1.52 0.00 0.00 31.29 33.52 2c3p h VAL 790 CO 0.00 0.59 -0.69 -0.76 0.02 0.00 0.00 177.57 176.74 2c3p s LEU 791 N -8.28 2.82 0.20 2.57 1.43 -1.26 -5.02 118.68 111.14 2c3p s LEU 791 Ca -0.18 -1.00 -0.32 0.00 -1.03 0.00 0.00 54.13 51.59 2c3p s LEU 791 Cb -0.02 -1.23 -0.14 0.00 0.03 0.00 0.00 46.19 44.83 2c3p s LEU 791 CO 0.71 -0.10 1.48 -2.65 0.23 0.00 0.00 176.35 176.02 2c3p n PRO 792 N -0.79 2.05 -0.25 1.29 -0.02 -1.26 -4.84 135.00 131.18 2c3p n PRO 792 Ca -0.05 0.74 0.06 0.00 -2.02 0.00 0.00 63.50 62.22 2c3p n PRO 792 Cb 0.61 -2.44 0.30 0.00 -0.02 0.00 0.00 33.50 31.95 2c3p n PRO 792 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2c3p h ARG 793 N 4.92 0.86 -0.64 -0.52 2.43 -1.86 -2.37 114.38 117.21 2c3p h ARG 793 Ca -0.45 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2c3p h ARG 793 Cb 1.27 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2c3p h ARG 793 CO 0.81 0.57 0.00 -0.40 -1.51 0.00 0.00 179.97 179.44 2c3p n ASP 794 N -4.49 5.01 -4.90 -3.80 3.85 -1.26 -3.16 116.55 107.80 2c3p n ASP 794 Ca 0.13 -2.73 -0.30 0.00 -0.71 0.00 0.00 54.79 51.18 2c3p n ASP 794 Cb 0.24 -0.64 -0.04 0.00 -1.35 0.00 0.00 41.12 39.33 2c3p n ASP 794 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 2c3p s SER 795 N -0.72 6.48 0.05 -1.12 1.04 -0.89 -4.82 113.70 113.72 2c3p s SER 795 Ca 0.48 0.66 -0.13 0.00 0.48 0.00 0.00 55.95 57.44 2c3p s SER 795 Cb 0.35 -2.12 -0.04 0.00 0.10 0.00 0.00 66.02 64.31 2c3p s SER 795 CO 0.16 -0.07 1.21 0.25 0.98 0.00 0.00 173.24 175.77 2c3p h LEU 796 N 2.26 -0.69 -0.28 2.42 6.46 -1.91 0.20 115.31 123.76 2c3p h LEU 796 Ca -0.47 0.09 0.01 0.00 -0.12 0.00 0.00 57.88 57.39 2c3p h LEU 796 Cb 1.18 0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 41.37 2c3p h LEU 796 CO 0.69 -0.16 0.16 0.50 -0.62 0.00 0.00 178.44 179.01 2c3p h LYS 797 N -0.17 0.32 0.00 1.25 3.64 -1.92 -2.94 116.57 116.75 2c3p h LYS 797 Ca 0.02 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2c3p h LYS 797 Cb 0.24 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2c3p h LYS 797 CO -0.21 0.21 -0.02 0.78 -2.27 0.00 0.00 179.45 177.95 2c3p h GLY 798 N 0.33 0.00 1.73 5.01 0.00 -1.63 -2.50 103.07 106.01 2c3p h GLY 798 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.36 2c3p h GLY 798 CO -0.05 0.00 -0.23 1.48 0.00 0.00 0.00 176.54 177.74 2c3p h SER 799 N 0.00 0.32 0.00 0.19 4.64 -0.77 -1.77 113.55 116.16 2c3p h SER 799 Ca -0.00 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 2c3p h SER 799 Cb 0.04 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2c3p h SER 799 CO 0.00 0.56 0.00 0.00 -0.87 0.00 0.00 176.83 176.52 2c3p n GLN 800 N -4.16 0.97 -0.27 4.77 1.13 -0.94 -1.86 117.38 117.02 2c3p n GLN 800 Ca -0.01 0.00 0.08 0.00 -1.94 0.00 0.00 57.00 55.13 2c3p n GLN 800 Cb 0.36 -1.35 0.23 0.00 0.11 0.00 0.00 30.24 29.58 2c3p n GLN 800 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 2c3p n PHE 801 N -0.85 0.70 -4.02 1.08 0.99 -0.67 -4.61 117.46 110.09 2c3p n PHE 801 Ca 0.16 -0.51 -0.22 0.00 -0.00 0.00 0.00 57.45 56.89 2c3p n PHE 801 Cb 0.08 -0.03 -0.04 0.00 -1.00 0.00 0.00 39.48 38.49 2c3p n PHE 801 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 2c3p s GLN 802 N -1.06 2.98 -0.10 -1.08 -1.52 -0.78 -2.20 119.66 115.90 2c3p s GLN 802 Ca 0.34 -1.05 -0.30 0.00 -1.95 0.00 0.00 55.36 52.41 2c3p s GLN 802 Cb 0.18 -2.61 -0.02 0.00 -0.22 0.00 0.00 33.01 30.35 2c3p s GLN 802 CO 0.23 0.34 1.10 -1.21 -0.25 0.00 0.00 175.29 175.50 2c3p s GLU 803 N -3.90 4.37 0.06 2.91 2.02 -1.26 -5.00 118.70 117.90 2c3p s GLU 803 Ca 0.35 1.52 -0.30 0.00 0.02 0.00 0.00 54.97 56.55 2c3p s GLU 803 Cb -0.08 -3.57 -0.05 0.00 0.10 0.00 0.00 34.13 30.53 2c3p s GLU 803 CO 0.26 -0.42 1.07 -1.25 0.02 0.00 0.00 175.26 174.94 2c3p s PRO 804 N 2.29 4.54 -0.29 0.39 0.04 -1.26 -4.40 135.00 136.31 2c3p s PRO 804 Ca 0.51 1.59 0.11 0.00 0.04 0.00 0.00 61.00 63.25 2c3p s PRO 804 Cb -0.21 -3.38 0.66 0.00 0.04 0.00 0.00 34.50 31.61 2c3p s PRO 804 CO 0.18 -0.07 1.67 1.28 0.04 0.00 0.00 177.00 180.10 2c3p n LEU 805 N 3.53 5.30 -3.29 -3.56 4.77 -1.26 -4.75 117.00 117.73 2c3p n LEU 805 Ca 0.06 -3.30 -0.07 0.00 -0.03 0.00 0.00 56.01 52.68 2c3p n LEU 805 Cb 0.48 -0.69 -0.06 0.00 -2.33 0.00 0.00 43.42 40.83 2c3p n LEU 805 CO 0.53 0.87 -0.03 -0.32 -1.33 0.00 0.00 177.39 177.11 2c3p s MET 806 N -3.02 0.42 0.09 3.23 1.75 -1.26 -1.42 119.30 119.09 2c3p s MET 806 Ca 0.51 0.35 0.03 0.00 -1.25 0.00 0.00 55.69 55.33 2c3p s MET 806 Cb 0.42 -0.23 -0.04 0.00 2.84 0.00 0.00 34.83 37.82 2c3p s MET 806 CO 0.10 -0.89 -0.08 -1.21 -0.65 0.00 0.00 175.02 172.28 2c3p s GLU 807 N 2.60 0.79 -1.44 4.11 2.02 -0.17 -4.74 118.70 121.87 2c3p s GLU 807 Ca 0.11 -1.16 -0.02 0.00 0.02 0.00 0.00 54.97 53.93 2c3p s GLU 807 Cb -0.13 -0.38 0.01 0.00 0.10 0.00 0.00 34.13 33.73 2c3p s GLU 807 CO -0.25 0.04 0.43 1.19 0.02 0.00 0.00 175.26 176.69 2c3p n PHE 808 N 0.49 -1.64 -1.63 1.61 0.99 -0.52 -4.37 117.46 112.39 2c3p n PHE 808 Ca -0.16 0.74 -0.29 0.00 -0.00 0.00 0.00 57.45 57.75 2c3p n PHE 808 Cb 0.58 -3.63 0.14 0.00 -1.00 0.00 0.00 39.48 35.58 2c3p n PHE 808 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2c3p s SER 809 N -4.28 3.40 -0.06 4.37 1.04 -1.26 -4.77 113.70 112.15 2c3p s SER 809 Ca 0.07 0.78 0.07 0.00 0.48 0.00 0.00 55.95 57.35 2c3p s SER 809 Cb -0.04 -1.22 0.32 0.00 0.10 0.00 0.00 66.02 65.19 2c3p s SER 809 CO 0.90 -2.60 1.11 0.61 0.98 0.00 0.00 173.24 174.24 2c3p n GLY 810 N -2.58 1.48 3.72 7.32 0.00 -1.25 -4.93 105.19 108.96 2c3p n GLY 810 Ca 0.09 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 2c3p n GLY 810 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p s ALA 811 N -1.68 1.87 0.85 4.61 0.00 -1.26 -3.08 121.76 123.06 2c3p s ALA 811 Ca 0.23 0.49 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 2c3p s ALA 811 Cb 0.15 -3.38 0.11 0.00 0.00 0.00 0.00 23.12 20.00 2c3p s ALA 811 CO 0.10 -2.25 1.16 0.00 0.00 0.00 0.00 175.76 174.77 2c3p s SER 813 N -2.57 6.45 -0.18 0.00 0.15 -1.26 -1.67 113.70 114.62 2c3p s SER 813 Ca 0.68 2.80 0.00 0.00 0.70 0.00 0.00 55.95 60.13 2c3p s SER 813 Cb -0.24 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.46 2c3p s SER 813 CO 0.54 -0.90 0.00 0.61 1.20 0.00 0.00 173.24 174.69 2c3p n GLY 814 N 3.46 0.51 3.59 9.45 0.00 -1.26 -4.88 105.19 116.05 2c3p n GLY 814 Ca 0.13 -0.26 -0.48 0.00 0.00 0.00 0.00 46.02 45.41 2c3p n GLY 814 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p n GLY 816 N 2.09 -1.11 0.13 0.00 0.00 -0.90 -4.15 105.19 101.25 2c3p n GLY 816 Ca 0.15 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 2c3p n GLY 816 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3p n GLU 817 N -1.12 0.66 0.23 1.61 1.02 -1.26 -4.27 120.64 117.51 2c3p n GLU 817 Ca 0.15 0.34 0.07 0.00 -0.02 0.00 0.00 57.16 57.70 2c3p n GLU 817 Cb 0.25 -1.66 0.61 0.00 -0.02 0.00 0.00 31.44 30.62 2c3p n GLU 817 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2c3p h THR 818 N -0.42 1.02 -0.77 2.62 1.35 -1.86 -2.64 112.91 112.22 2c3p h THR 818 Ca -0.47 -0.05 -0.01 0.00 -0.55 0.00 0.00 66.41 65.33 2c3p h THR 818 Cb 1.73 0.97 -0.04 0.00 -1.73 0.00 0.00 68.15 69.09 2c3p h THR 818 CO -0.10 0.02 0.45 -0.65 -0.25 0.00 0.00 175.52 174.98 2c3p h PRO 819 N 0.05 1.06 -0.29 4.72 0.11 -1.79 -0.46 132.00 135.40 2c3p h PRO 819 Ca 0.01 -0.11 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 2c3p h PRO 819 Cb 0.01 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 30.89 2c3p h PRO 819 CO -0.00 0.77 0.14 1.88 -0.21 0.00 0.00 178.00 180.58 2c3p h TYR 820 N 1.06 0.42 -0.45 0.65 -1.99 -1.73 -2.30 116.97 112.63 2c3p h TYR 820 Ca 0.28 -0.02 -0.05 0.00 2.00 0.00 0.00 58.73 60.94 2c3p h TYR 820 Cb -0.01 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 38.57 2c3p h TYR 820 CO -0.00 0.39 0.11 0.28 -0.00 0.00 0.00 178.16 178.93 2c3p h VAL 821 N 0.34 1.24 -0.45 -2.88 2.07 -1.36 -1.05 116.25 114.15 2c3p h VAL 821 Ca 0.10 -0.83 0.05 0.00 0.82 0.00 0.00 66.70 66.85 2c3p h VAL 821 Cb 0.12 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 30.75 2c3p h VAL 821 CO -0.01 0.29 0.18 -0.09 0.02 0.00 0.00 177.57 177.96 2c3p h ARG 822 N 0.60 0.35 -0.52 1.57 2.43 -0.98 -1.08 114.38 116.75 2c3p h ARG 822 Ca 0.14 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 2c3p h ARG 822 Cb 0.33 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2c3p h ARG 822 CO 0.00 0.23 0.13 0.28 -1.51 0.00 0.00 179.97 179.10 2c3p h VAL 823 N 0.36 1.24 -0.84 0.20 2.07 -1.20 -2.26 116.25 115.81 2c3p h VAL 823 Ca 0.21 -0.84 0.12 0.00 0.82 0.00 0.00 66.70 67.01 2c3p h VAL 823 Cb 0.19 0.80 -0.08 0.00 -1.52 0.00 0.00 31.29 30.68 2c3p h VAL 823 CO -0.20 0.31 0.46 0.40 0.02 0.00 0.00 177.57 178.55 2c3p h ILE 824 N 0.72 0.81 -0.29 4.57 2.04 -0.16 -0.03 117.51 125.18 2c3p h ILE 824 Ca 0.16 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.71 2c3p h ILE 824 Cb 0.32 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 2c3p h ILE 824 CO 0.00 0.13 -0.13 0.71 0.00 0.00 0.00 178.15 178.86 2c3p h THR 825 N 0.71 1.23 0.00 -0.27 1.35 -0.81 -1.07 112.91 114.04 2c3p h THR 825 Ca 0.43 -1.01 -0.01 0.00 -0.55 0.00 0.00 66.41 65.28 2c3p h THR 825 Cb 0.52 1.15 -0.00 0.00 -1.73 0.00 0.00 68.15 68.09 2c3p h THR 825 CO -0.31 0.33 -0.03 1.56 -0.25 0.00 0.00 175.52 176.83 2c3p h GLN 826 N 0.45 0.00 0.03 4.72 4.20 -0.45 0.51 115.11 124.57 2c3p h GLN 826 Ca 0.08 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.43 2c3p h GLN 826 Cb 0.49 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.22 2c3p h GLN 826 CO 0.03 0.03 -2.21 1.28 -0.67 0.00 0.00 178.83 177.29 2c3p n LEU 827 N -3.24 1.71 0.00 1.46 4.32 -0.66 -4.78 117.00 115.80 2c3p n LEU 827 Ca -0.02 0.08 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 2c3p n LEU 827 Cb 0.18 -0.37 0.00 0.00 -1.62 0.00 0.00 43.42 41.60 2c3p n LEU 827 CO 0.25 0.70 0.02 0.49 -1.22 0.00 0.00 177.39 177.63 2c3p n PHE 828 N -3.13 0.00 -0.21 -1.77 3.01 -0.50 -4.93 117.46 109.93 2c3p n PHE 828 Ca -0.34 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.17 2c3p n PHE 828 Cb 1.06 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 40.63 2c3p n PHE 828 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2c3p n GLY 829 N 0.22 -0.95 0.12 1.37 0.00 0.18 -0.02 105.19 106.10 2c3p n GLY 829 Ca 0.00 0.62 0.10 0.00 0.00 0.00 0.00 46.02 46.74 2c3p n GLY 829 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2c3p n GLU 830 N -4.92 0.13 -1.19 1.61 0.00 -1.26 -2.62 120.64 112.39 2c3p n GLU 830 Ca 0.10 0.53 0.04 0.00 0.00 0.00 0.00 57.16 57.84 2c3p n GLU 830 Cb 0.33 -1.85 0.05 0.00 0.00 0.00 0.00 31.44 29.97 2c3p n GLU 830 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 2c3p n ARG 831 N -2.12 0.32 -4.14 3.44 1.85 0.97 -4.36 116.66 112.62 2c3p n ARG 831 Ca 0.00 -2.14 -0.27 0.00 -1.00 0.00 0.00 57.85 54.44 2c3p n ARG 831 Cb 0.10 -0.39 -0.07 0.00 -1.05 0.00 0.00 32.46 31.05 2c3p n ARG 831 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2c3p s MET 832 N -0.66 2.66 -0.08 2.89 0.23 -1.15 0.32 119.30 123.51 2c3p s MET 832 Ca 0.31 -0.95 0.02 0.00 -1.03 0.00 0.00 55.69 54.04 2c3p s MET 832 Cb 0.34 -2.52 -0.02 0.00 -1.53 0.00 0.00 34.83 31.09 2c3p s MET 832 CO -0.13 0.48 -0.12 -0.06 -2.03 0.00 0.00 175.02 173.17 2c3p s PHE 833 N -1.67 2.79 -0.17 3.16 0.40 0.10 -1.42 117.98 121.17 2c3p s PHE 833 Ca 0.29 -0.24 0.01 0.00 -0.60 0.00 0.00 56.93 56.39 2c3p s PHE 833 Cb -0.10 -1.71 0.03 0.00 0.51 0.00 0.00 43.02 41.75 2c3p s PHE 833 CO 0.21 0.12 -0.13 0.42 0.70 0.00 0.00 175.22 176.53 2c3p s ILE 834 N -0.45 1.64 -0.49 0.64 1.01 0.68 -0.39 121.20 123.84 2c3p s ILE 834 Ca 0.06 -0.82 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 2c3p s ILE 834 Cb -0.12 -1.61 0.11 0.00 0.01 0.00 0.00 42.46 40.85 2c3p s ILE 834 CO 0.02 0.35 0.40 0.00 0.00 0.00 0.00 174.94 175.70 2c3p s ALA 835 N 1.43 3.50 -0.21 9.38 0.00 -0.37 -0.68 121.76 134.81 2c3p s ALA 835 Ca 0.02 -2.44 -0.13 0.00 0.00 0.00 0.00 51.96 49.41 2c3p s ALA 835 Cb -0.14 -3.00 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 2c3p s ALA 835 CO -0.10 -1.90 0.28 1.21 0.00 0.00 0.00 175.76 175.26 2c3p s ASN 836 N 2.94 6.31 0.46 0.00 3.84 0.78 -1.64 114.94 127.63 2c3p s ASN 836 Ca 0.04 0.35 -0.22 0.00 0.21 0.00 0.00 52.86 53.24 2c3p s ASN 836 Cb -0.27 -2.17 -0.08 0.00 -0.55 0.00 0.00 41.25 38.18 2c3p s ASN 836 CO 0.02 0.01 1.10 0.00 -2.79 0.00 0.00 177.10 175.44 2c3p s ALA 837 N 1.05 2.94 0.30 1.71 0.00 0.10 -4.08 121.76 123.78 2c3p s ALA 837 Ca 0.14 0.78 -0.30 0.00 0.00 0.00 0.00 51.96 52.58 2c3p s ALA 837 Cb -0.14 -3.32 -0.11 0.00 0.00 0.00 0.00 23.12 19.55 2c3p s ALA 837 CO 0.06 -0.47 1.58 0.99 0.00 0.00 0.00 175.76 177.91 2c3p s THR 838 N -1.71 2.08 -4.93 0.00 2.01 -1.16 -4.00 115.64 107.92 2c3p s THR 838 Ca 0.64 0.07 0.00 0.00 0.31 0.00 0.00 61.69 62.71 2c3p s THR 838 Cb -0.23 -3.04 0.00 0.00 0.01 0.00 0.00 72.50 69.23 2c3p s THR 838 CO 0.28 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.83 2c3p n GLY 839 N 1.98 -0.95 0.35 4.40 0.00 -1.26 -4.82 105.19 104.88 2c3p n GLY 839 Ca 0.07 -1.17 0.06 0.00 0.00 0.00 0.00 46.02 44.98 2c3p n GLY 839 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p h SER 841 N 0.97 0.00 0.54 0.00 4.64 -1.92 0.59 113.55 118.37 2c3p h SER 841 Ca 0.47 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.50 2c3p h SER 841 Cb 0.43 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.47 2c3p h SER 841 CO -0.25 0.11 -1.62 0.77 -0.87 0.00 0.00 176.83 174.96 2c3p h SER 842 N 0.00 0.02 -0.03 4.97 4.64 -1.38 -2.23 113.55 119.54 2c3p h SER 842 Ca -0.00 -0.05 -0.08 0.00 -0.47 0.00 0.00 61.79 61.19 2c3p h SER 842 Cb 0.42 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2c3p h SER 842 CO 0.01 1.04 -0.30 0.40 -0.87 0.00 0.00 176.83 177.11 2c3p h ILE 843 N 0.00 1.48 0.00 0.95 1.08 -0.05 0.20 117.51 121.17 2c3p h ILE 843 Ca -0.25 -1.85 -0.07 0.00 -0.39 0.00 0.00 64.86 62.30 2c3p h ILE 843 Cb 1.98 2.56 -0.01 0.00 -3.07 0.00 0.00 36.82 38.28 2c3p h ILE 843 CO 0.09 0.52 -0.33 4.11 -0.69 0.00 0.00 178.15 181.85 2c3p h TRP 844 N -0.33 0.00 -0.07 1.37 5.08 -0.02 -2.98 115.95 119.00 2c3p h TRP 844 Ca -0.03 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 59.81 2c3p h TRP 844 Cb 1.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.15 2c3p h TRP 844 CO 0.15 0.33 -0.55 0.78 -1.28 0.00 0.00 178.44 177.87 2c3p h GLY 845 N 3.49 0.22 -5.00 11.11 0.00 -1.34 -3.31 103.07 108.23 2c3p h GLY 845 Ca -0.00 -0.25 -0.22 0.00 0.00 0.00 0.00 47.33 46.85 2c3p h GLY 845 CO 0.04 0.23 -0.38 0.00 0.00 0.00 0.00 176.54 176.43 2c3p n ALA 846 N -2.46 1.36 -2.59 3.60 0.00 0.68 -4.31 120.51 116.79 2c3p n ALA 846 Ca -0.02 -1.36 -0.43 0.00 0.00 0.00 0.00 53.44 51.64 2c3p n ALA 846 Cb 0.58 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 19.00 2c3p n ALA 846 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2c3p s SER 847 N -1.27 6.47 0.44 0.00 0.01 -1.13 -4.92 113.70 113.29 2c3p s SER 847 Ca 0.22 0.04 -0.24 0.00 1.31 0.00 0.00 55.95 57.28 2c3p s SER 847 Cb 0.40 -2.47 -0.10 0.00 0.21 0.00 0.00 66.02 64.07 2c3p s SER 847 CO -0.09 -1.15 1.04 0.00 0.41 0.00 0.00 173.24 173.45 2c3p n ALA 848 N 7.42 0.34 -0.27 1.44 0.00 -1.26 -0.90 120.51 127.28 2c3p n ALA 848 Ca 0.06 0.21 0.09 0.00 0.00 0.00 0.00 53.44 53.80 2c3p n ALA 848 Cb 0.48 -2.11 0.31 0.00 0.00 0.00 0.00 19.45 18.13 2c3p n ALA 848 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2c3p n PRO 849 N 0.01 3.19 -3.00 0.00 -0.04 -1.26 -5.03 135.00 128.87 2c3p n PRO 849 Ca 0.09 -2.47 -0.41 0.00 -0.04 0.00 0.00 63.50 60.67 2c3p n PRO 849 Cb 0.40 -1.75 -0.05 0.00 -0.04 0.00 0.00 33.50 32.06 2c3p n PRO 849 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2c3p s SER 850 N -0.88 6.68 -0.30 3.54 0.15 -0.08 -4.81 113.70 118.00 2c3p s SER 850 Ca 0.45 0.82 0.03 0.00 0.70 0.00 0.00 55.95 57.95 2c3p s SER 850 Cb 0.27 -2.38 0.08 0.00 -1.71 0.00 0.00 66.02 62.28 2c3p s SER 850 CO 0.24 -0.46 -0.02 -0.04 1.20 0.00 0.00 173.24 174.16 2c3p s MET 851 N 2.69 1.87 0.18 5.44 -1.94 -1.26 -3.75 119.30 122.54 2c3p s MET 851 Ca 0.30 -1.62 -0.01 0.00 -1.71 0.00 0.00 55.69 52.65 2c3p s MET 851 Cb -0.15 -3.08 0.08 0.00 2.01 0.00 0.00 34.83 33.69 2c3p s MET 851 CO 0.09 -0.77 1.45 -1.00 -0.01 0.00 0.00 175.02 174.78 2c3p h PRO 852 N 7.71 0.40 -6.89 2.03 0.13 -1.76 -2.43 132.00 131.18 2c3p h PRO 852 Ca -0.12 -0.31 -0.52 0.00 -0.87 0.00 0.00 66.00 64.18 2c3p h PRO 852 Cb 1.03 0.06 0.06 0.00 0.13 0.00 0.00 31.00 32.29 2c3p h PRO 852 CO 0.50 0.95 0.61 0.71 -0.23 0.00 0.00 178.00 180.54 2c3p s TYR 853 N -3.66 3.05 0.29 1.56 1.51 -1.26 -1.00 117.35 117.84 2c3p s TYR 853 Ca -0.06 1.45 -0.00 0.00 -1.01 0.00 0.00 57.07 57.45 2c3p s TYR 853 Cb 0.11 -3.62 -0.02 0.00 -0.11 0.00 0.00 41.96 38.31 2c3p s TYR 853 CO 0.84 -1.75 0.32 -1.59 -1.11 0.00 0.00 175.55 172.26 2c3p s LYS 854 N -1.88 1.64 0.26 -0.62 -2.85 -0.51 -0.03 119.74 115.74 2c3p s LYS 854 Ca 0.51 -1.76 0.03 0.00 -1.00 0.00 0.00 55.97 53.75 2c3p s LYS 854 Cb -0.38 0.36 -0.03 0.00 -2.06 0.00 0.00 37.83 35.72 2c3p s LYS 854 CO 0.50 -0.62 0.41 0.95 0.10 0.00 0.00 175.35 176.69 2c3p s THR 855 N -3.57 5.22 0.29 3.79 -4.23 -1.26 -4.35 115.64 111.52 2c3p s THR 855 Ca 0.35 -0.77 -0.03 0.00 -1.18 0.00 0.00 61.69 60.06 2c3p s THR 855 Cb 0.02 -3.84 0.06 0.00 1.34 0.00 0.00 72.50 70.08 2c3p s THR 855 CO 0.19 -0.37 0.40 -0.46 -0.54 0.00 0.00 174.62 173.85 2c3p n ASN 856 N -1.40 0.27 0.31 3.99 0.23 0.13 -4.87 115.26 113.93 2c3p n ASN 856 Ca -0.07 -1.29 0.18 0.00 -0.53 0.00 0.00 54.58 52.87 2c3p n ASN 856 Cb 0.56 -0.28 1.01 0.00 -2.08 0.00 0.00 39.78 38.99 2c3p n ASN 856 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2c3p h ARG 857 N 0.00 0.00 -0.24 -3.83 0.11 -2.00 -1.28 114.38 107.14 2c3p h ARG 857 Ca -0.13 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.95 2c3p h ARG 857 Cb 0.42 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.50 2c3p h ARG 857 CO 0.11 0.01 0.00 1.28 0.10 0.00 0.00 179.97 181.47 2c3p n LEU 858 N -3.53 2.23 0.00 0.08 7.99 -1.26 -4.92 117.00 117.59 2c3p n LEU 858 Ca -0.03 -0.95 0.00 0.00 -0.01 0.00 0.00 56.01 55.02 2c3p n LEU 858 Cb 0.09 -0.16 0.00 0.00 -0.11 0.00 0.00 43.42 43.25 2c3p n LEU 858 CO 0.25 0.48 0.00 0.61 -1.51 0.00 0.00 177.39 177.21 2c3p n GLY 859 N 1.24 0.68 3.87 -0.72 0.00 -0.48 -5.05 105.19 104.73 2c3p n GLY 859 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2c3p n GLY 859 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c3p s GLN 860 N -0.26 3.75 0.10 1.61 -0.21 -1.26 -4.75 119.66 118.64 2c3p s GLN 860 Ca 0.00 0.16 -0.27 0.00 0.02 0.00 0.00 55.36 55.27 2c3p s GLN 860 Cb 0.00 -3.01 0.08 0.00 1.00 0.00 0.00 33.01 31.08 2c3p s GLN 860 CO 0.00 0.57 1.08 0.20 -2.12 0.00 0.00 175.29 175.03 2c3p s GLY 861 N -1.73 -0.26 0.20 3.09 0.00 -1.26 0.22 107.32 107.58 2c3p s GLY 861 Ca 0.32 0.26 -0.32 0.00 0.00 0.00 0.00 44.72 44.99 2c3p s GLY 861 CO 0.18 0.40 1.74 -1.05 0.00 0.00 0.00 173.10 174.36 2c3p n PRO 862 N -0.51 2.79 -2.95 2.90 -0.02 -1.08 -4.67 135.00 131.46 2c3p n PRO 862 Ca -0.06 1.01 -0.43 0.00 -2.02 0.00 0.00 63.50 61.99 2c3p n PRO 862 Cb 0.61 -2.86 -0.05 0.00 -0.02 0.00 0.00 33.50 31.18 2c3p n PRO 862 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c3p s ALA 863 N 1.29 3.29 -0.11 3.55 0.00 -0.50 -4.95 121.76 124.32 2c3p s ALA 863 Ca 0.76 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2c3p s ALA 863 Cb -0.50 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.10 2c3p s ALA 863 CO 0.32 -1.94 -0.05 -0.46 0.00 0.00 0.00 175.76 173.63 2c3p s TRP 864 N 3.34 2.98 -0.13 0.00 -0.00 -1.26 -0.23 118.94 123.64 2c3p s TRP 864 Ca 0.31 -0.16 -0.12 0.00 -0.00 0.00 0.00 56.10 56.12 2c3p s TRP 864 Cb -0.12 -1.84 0.03 0.00 -0.00 0.00 0.00 33.47 31.55 2c3p s TRP 864 CO 0.23 0.13 0.34 0.20 -0.00 0.00 0.00 176.95 177.86 2c3p s GLY 865 N -0.20 -0.26 -0.23 5.86 0.00 0.14 -4.98 107.32 107.66 2c3p s GLY 865 Ca 0.03 0.97 -0.02 0.00 0.00 0.00 0.00 44.72 45.70 2c3p s GLY 865 CO 0.03 0.85 -0.06 0.21 0.00 0.00 0.00 173.10 174.12 2c3p s ASN 866 N 0.20 4.23 0.00 1.64 2.47 -1.26 -0.16 114.94 122.07 2c3p s ASN 866 Ca -0.00 -0.68 0.00 0.00 0.42 0.00 0.00 52.86 52.60 2c3p s ASN 866 Cb -0.03 -1.68 0.00 0.00 -1.45 0.00 0.00 41.25 38.09 2c3p s ASN 866 CO 0.00 -0.08 0.00 -0.24 -3.72 0.00 0.00 177.10 173.06 2c3p n SER 867 N 4.72 0.00 -2.43 -4.21 2.88 -1.26 -5.02 113.62 108.31 2c3p n SER 867 Ca -0.17 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.28 2c3p n SER 867 Cb 0.49 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.92 2c3p n SER 867 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2c3p n LEU 868 N 0.00 0.00 0.07 2.46 4.77 -1.26 -4.97 117.00 118.07 2c3p n LEU 868 Ca 0.00 -1.00 -0.20 0.00 -0.03 0.00 0.00 56.01 54.78 2c3p n LEU 868 Cb 0.00 0.26 -0.15 0.00 -2.33 0.00 0.00 43.42 41.21 2c3p n LEU 868 CO 0.00 -0.15 -0.44 0.15 -1.33 0.00 0.00 177.39 175.62 2c3p h PHE 869 N 1.18 0.59 0.00 -1.77 3.57 -1.93 -3.08 116.94 115.50 2c3p h PHE 869 Ca -0.11 -0.43 0.00 0.00 3.53 0.00 0.00 57.97 60.96 2c3p h PHE 869 Cb 0.39 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.11 2c3p h PHE 869 CO 0.00 1.53 -0.34 -0.85 -2.23 0.00 0.00 178.31 176.42 2c3p n GLU 870 N -3.52 0.06 -0.06 1.11 0.00 -1.26 -4.36 120.64 112.61 2c3p n GLU 870 Ca -0.21 0.03 0.05 0.00 0.00 0.00 0.00 57.16 57.03 2c3p n GLU 870 Cb 1.06 -1.55 0.08 0.00 0.00 0.00 0.00 31.44 31.04 2c3p n GLU 870 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2c3p n ASP 871 N -1.64 2.29 -0.24 -1.84 3.85 -1.26 -4.37 116.55 113.34 2c3p n ASP 871 Ca 0.06 -2.52 0.04 0.00 -0.71 0.00 0.00 54.79 51.66 2c3p n ASP 871 Cb 0.36 -0.22 0.15 0.00 -1.35 0.00 0.00 41.12 40.05 2c3p n ASP 871 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2c3p h ALA 872 N 0.20 0.78 0.19 2.12 0.00 -1.76 0.11 119.26 120.90 2c3p h ALA 872 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2c3p h ALA 872 Cb 0.77 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2c3p h ALA 872 CO 0.01 -0.40 -0.09 0.00 0.00 0.00 0.00 179.25 178.77 2c3p h ALA 873 N 1.65 -0.25 -0.20 0.00 0.00 -1.89 -0.90 119.26 117.67 2c3p h ALA 873 Ca 0.39 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 2c3p h ALA 873 Cb 0.68 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2c3p h ALA 873 CO -0.60 -0.61 0.02 0.93 0.00 0.00 0.00 179.25 178.99 2c3p h GLU 874 N -0.31 0.29 -0.15 0.00 3.07 -1.66 0.15 114.58 115.97 2c3p h GLU 874 Ca -0.03 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 2c3p h GLU 874 Cb 0.24 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 2c3p h GLU 874 CO 0.04 0.29 0.04 -0.92 -1.40 0.00 0.00 179.01 177.06 2c3p h TYR 875 N 0.29 0.26 -0.19 4.33 3.20 -0.45 -0.65 116.97 123.75 2c3p h TYR 875 Ca 0.07 -0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.81 2c3p h TYR 875 Cb 0.16 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 2c3p h TYR 875 CO 0.00 0.39 -0.31 0.78 -1.64 0.00 0.00 178.16 177.38 2c3p h GLY 876 N 0.05 0.41 1.72 1.82 0.00 -0.43 -1.89 103.07 104.75 2c3p h GLY 876 Ca 0.05 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 46.97 2c3p h GLY 876 CO 0.00 0.32 -0.15 -2.75 0.00 0.00 0.00 176.54 173.96 2c3p h PHE 877 N 0.33 0.36 -0.30 5.60 3.57 -0.47 -1.24 116.94 124.79 2c3p h PHE 877 Ca 0.04 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 2c3p h PHE 877 Cb 0.72 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2c3p h PHE 877 CO 0.02 0.48 -0.15 0.78 -2.23 0.00 0.00 178.31 177.21 2c3p h GLY 878 N 0.86 0.68 0.91 2.40 0.00 -0.34 0.49 103.07 108.06 2c3p h GLY 878 Ca 0.06 -0.61 0.03 0.00 0.00 0.00 0.00 47.33 46.81 2c3p h GLY 878 CO 0.03 0.56 0.66 -0.33 0.00 0.00 0.00 176.54 177.45 2c3p h MET 879 N 0.38 1.24 -0.28 4.80 2.86 -1.08 0.27 114.93 123.11 2c3p h MET 879 Ca 0.07 -0.07 -0.08 0.00 -2.06 0.00 0.00 59.70 57.55 2c3p h MET 879 Cb 0.67 -0.28 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 2c3p h MET 879 CO 0.04 0.82 -0.18 -0.97 1.06 0.00 0.00 176.91 177.69 2c3p h ASN 880 N 1.28 0.50 -0.48 1.22 -0.73 -0.87 -1.38 115.58 115.13 2c3p h ASN 880 Ca 0.39 -0.15 -0.10 0.00 1.87 0.00 0.00 56.30 58.31 2c3p h ASN 880 Cb -0.02 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 38.42 2c3p h ASN 880 CO -0.12 0.70 -0.10 0.24 -0.37 0.00 0.00 177.43 177.78 2c3p h MET 881 N 0.46 0.91 -0.21 6.67 2.86 0.62 -0.68 114.93 125.57 2c3p h MET 881 Ca 0.08 -0.34 0.02 0.00 -2.06 0.00 0.00 59.70 57.40 2c3p h MET 881 Cb 0.58 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 2c3p h MET 881 CO 0.04 0.99 0.08 1.03 1.06 0.00 0.00 176.91 180.11 2c3p h SER 882 N 0.76 0.10 -0.80 1.22 0.87 -0.61 0.48 113.55 115.56 2c3p h SER 882 Ca 0.12 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 2c3p h SER 882 Cb 0.64 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.57 2c3p h SER 882 CO 0.04 0.09 0.43 0.24 -0.53 0.00 0.00 176.83 177.10 2c3p h MET 883 N 0.18 1.13 0.03 2.24 2.86 -1.10 0.14 114.93 120.41 2c3p h MET 883 Ca 0.09 -0.14 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2c3p h MET 883 Cb 0.05 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.49 2c3p h MET 883 CO -0.08 0.84 -0.01 0.35 1.06 0.00 0.00 176.91 179.06 2c3p h PHE 884 N 1.12 -0.03 -0.11 -0.22 3.57 -0.47 0.82 116.94 121.62 2c3p h PHE 884 Ca 0.28 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 2c3p h PHE 884 Cb 0.05 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.79 2c3p h PHE 884 CO 0.00 -0.00 0.03 0.00 -2.23 0.00 0.00 178.31 176.12 2c3p h ALA 885 N 0.92 0.14 -0.26 2.41 0.00 -0.52 -0.46 119.26 121.48 2c3p h ALA 885 Ca -0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 2c3p h ALA 885 Cb 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2c3p h ALA 885 CO 0.01 -0.25 -0.36 0.00 0.00 0.00 0.00 179.25 178.64 2c3p h ARG 886 N -0.01 0.58 0.00 0.00 3.08 -0.70 -1.38 114.38 115.95 2c3p h ARG 886 Ca 0.03 -0.28 -0.07 0.00 0.07 0.00 0.00 59.98 59.74 2c3p h ARG 886 Cb 0.21 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 2c3p h ARG 886 CO -0.00 0.86 -0.33 0.00 -1.07 0.00 0.00 179.97 179.43 2c3p h ARG 887 N 0.49 0.00 -0.04 0.04 3.08 -0.82 -1.64 114.38 115.49 2c3p h ARG 887 Ca 0.05 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.93 2c3p h ARG 887 Cb 0.85 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2c3p h ARG 887 CO 0.07 0.33 -0.74 1.15 -1.07 0.00 0.00 179.97 179.71 2c3p h THR 888 N 0.00 1.43 -0.38 2.04 2.02 -0.88 -0.44 112.91 116.69 2c3p h THR 888 Ca -0.00 -2.28 -0.08 0.00 0.77 0.00 0.00 66.41 64.81 2c3p h THR 888 Cb 1.17 2.22 -0.01 0.00 -1.74 0.00 0.00 68.15 69.79 2c3p h THR 888 CO 0.04 0.67 -0.09 -0.74 0.37 0.00 0.00 175.52 175.77 2c3p h HIS 889 N 0.16 0.83 -0.16 3.16 -0.00 -0.90 -1.43 115.15 116.81 2c3p h HIS 889 Ca -0.03 -0.18 -0.00 0.00 -0.00 0.00 0.00 60.37 60.16 2c3p h HIS 889 Cb 1.31 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 28.51 2c3p h HIS 889 CO 0.03 0.87 0.09 1.25 -0.00 0.00 0.00 177.93 180.17 2c3p h LEU 890 N 0.54 0.19 -0.66 0.26 5.85 -1.17 -0.97 115.31 119.35 2c3p h LEU 890 Ca 0.10 -0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.84 2c3p h LEU 890 Cb 0.61 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.52 2c3p h LEU 890 CO 0.04 0.21 0.29 0.00 -0.34 0.00 0.00 178.44 178.64 2c3p h ALA 891 N 0.99 0.89 -0.47 1.25 0.00 -0.90 0.15 119.26 121.16 2c3p h ALA 891 Ca 0.06 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2c3p h ALA 891 Cb 0.06 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2c3p h ALA 891 CO -0.01 -0.12 0.27 0.22 0.00 0.00 0.00 179.25 179.61 2c3p h ASP 892 N 0.50 0.57 -0.69 0.00 1.82 -0.87 -0.47 116.42 117.29 2c3p h ASP 892 Ca 0.33 -0.07 -0.01 0.00 -0.39 0.00 0.00 57.03 56.89 2c3p h ASP 892 Cb 0.38 -0.14 -0.03 0.00 0.68 0.00 0.00 39.33 40.21 2c3p h ASP 892 CO -0.29 0.47 0.38 -0.07 -1.61 0.00 0.00 179.24 178.12 2c3p h LEU 893 N 0.62 0.85 0.37 2.28 -0.00 -0.02 -1.09 115.31 118.32 2c3p h LEU 893 Ca 0.17 -0.09 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 2c3p h LEU 893 Cb 0.01 -0.22 -0.00 0.00 -0.00 0.00 0.00 40.66 40.45 2c3p h LEU 893 CO -0.03 0.70 -0.22 0.00 -0.00 0.00 0.00 178.44 178.89 2c3p h ALA 894 N 1.19 -0.55 -1.00 1.53 0.00 -0.21 0.17 119.26 120.38 2c3p h ALA 894 Ca 0.24 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.11 2c3p h ALA 894 Cb 0.03 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 2c3p h ALA 894 CO -0.04 -0.82 0.65 0.00 0.00 0.00 0.00 179.25 179.04 2c3p h ALA 895 N 0.05 1.42 -0.33 0.00 0.00 -1.02 -0.59 119.26 118.78 2c3p h ALA 895 Ca -0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2c3p h ALA 895 Cb 0.46 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2c3p h ALA 895 CO 0.05 0.42 0.21 -0.22 0.00 0.00 0.00 179.25 179.71 2c3p h LYS 896 N 1.16 0.45 0.00 0.00 3.64 -0.70 -1.78 116.57 119.34 2c3p h LYS 896 Ca 0.44 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2c3p h LYS 896 Cb 0.20 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 2c3p h LYS 896 CO -0.18 0.33 0.00 0.00 -2.27 0.00 0.00 179.45 177.32 2c3p h ALA 897 N 1.09 1.00 0.00 5.00 0.00 0.43 -1.58 119.26 125.20 2c3p h ALA 897 Ca 0.12 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2c3p h ALA 897 Cb -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2c3p h ALA 897 CO -0.02 0.00 -0.36 -0.07 0.00 0.00 0.00 179.25 178.80 2c3p h LEU 898 N 0.00 0.00 -4.78 0.00 3.38 -0.24 -3.08 115.31 110.59 2c3p h LEU 898 Ca 0.00 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.24 2c3p h LEU 898 Cb 0.40 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.88 2c3p h LEU 898 CO 0.00 0.36 0.99 -0.62 0.09 0.00 0.00 178.44 179.26 2c3p n GLU 899 N -3.58 2.71 -3.76 1.13 -0.58 -0.60 -4.93 120.64 111.04 2c3p n GLU 899 Ca -0.00 -3.39 -0.13 0.00 -0.42 0.00 0.00 57.16 53.21 2c3p n GLU 899 Cb 0.48 -2.26 -0.03 0.00 -0.57 0.00 0.00 31.44 29.06 2c3p n GLU 899 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2c3p n SER 900 N -0.52 -1.22 -1.00 1.62 3.41 -1.17 -5.03 113.62 109.73 2c3p n SER 900 Ca 0.55 -2.72 -0.02 0.00 -0.26 0.00 0.00 58.87 56.42 2c3p n SER 900 Cb 0.33 2.28 0.05 0.00 -0.26 0.00 0.00 64.21 66.61 2c3p n SER 900 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2c3p n ASP 901 N -1.68 2.53 -4.74 4.04 3.85 -1.26 -4.91 116.55 114.37 2c3p n ASP 901 Ca 0.01 -2.23 -0.37 0.00 -0.71 0.00 0.00 54.79 51.49 2c3p n ASP 901 Cb 0.53 -0.55 0.05 0.00 -1.35 0.00 0.00 41.12 39.80 2c3p n ASP 901 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2c3p s ALA 902 N -0.91 2.55 0.81 2.12 0.00 -1.26 -4.94 121.76 120.13 2c3p s ALA 902 Ca 0.10 1.16 -0.13 0.00 0.00 0.00 0.00 51.96 53.08 2c3p s ALA 902 Cb 0.08 -3.51 0.08 0.00 0.00 0.00 0.00 23.12 19.76 2c3p s ALA 902 CO 0.02 -1.36 1.14 -1.13 0.00 0.00 0.00 175.76 174.43 2c3p n SER 903 N -1.55 0.78 -0.36 0.00 3.41 -1.26 -4.70 113.62 109.94 2c3p n SER 903 Ca 0.14 0.57 0.06 0.00 -0.26 0.00 0.00 58.87 59.38 2c3p n SER 903 Cb 0.48 -1.48 0.23 0.00 -0.26 0.00 0.00 64.21 63.18 2c3p n SER 903 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2c3p h GLY 904 N -0.94 1.58 0.74 5.00 0.00 -1.98 0.10 103.07 107.57 2c3p h GLY 904 Ca -0.46 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.43 2c3p h GLY 904 CO 0.45 0.21 -0.12 -0.55 0.00 0.00 0.00 176.54 176.53 2c3p h ASP 905 N 1.03 -0.28 -0.52 0.19 3.45 -1.99 0.60 116.42 118.91 2c3p h ASP 905 Ca 0.47 -0.17 0.09 0.00 0.43 0.00 0.00 57.03 57.85 2c3p h ASP 905 Cb 0.41 0.07 -0.07 0.00 -0.56 0.00 0.00 39.33 39.18 2c3p h ASP 905 CO -0.23 0.02 0.11 0.58 -1.57 0.00 0.00 179.24 178.15 2c3p h VAL 906 N -0.59 0.72 -0.55 -1.35 2.07 -1.78 -0.43 116.25 114.33 2c3p h VAL 906 Ca -0.03 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 2c3p h VAL 906 Cb 0.43 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 2c3p h VAL 906 CO 0.05 0.05 0.19 0.11 0.02 0.00 0.00 177.57 177.99 2c3p h LYS 907 N 0.25 0.81 -0.28 1.57 1.57 -0.67 0.27 116.57 120.09 2c3p h LYS 907 Ca 0.26 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 2c3p h LYS 907 Cb 0.35 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2c3p h LYS 907 CO -0.33 0.69 0.11 0.93 -0.57 0.00 0.00 179.45 180.28 2c3p h GLU 908 N 0.80 0.41 -0.21 3.15 5.08 0.14 0.07 114.58 124.01 2c3p h GLU 908 Ca 0.19 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2c3p h GLU 908 Cb 0.20 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2c3p h GLU 908 CO -0.01 0.44 0.12 0.00 -1.00 0.00 0.00 179.01 178.56 2c3p h ALA 909 N 0.95 0.27 -0.31 3.43 0.00 -0.61 0.59 119.26 123.58 2c3p h ALA 909 Ca 0.09 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2c3p h ALA 909 Cb 0.18 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2c3p h ALA 909 CO -0.01 -0.22 0.20 -0.07 0.00 0.00 0.00 179.25 179.16 2c3p h LEU 910 N 0.25 0.35 -1.39 0.00 3.38 -0.83 0.29 115.31 117.36 2c3p h LEU 910 Ca 0.08 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2c3p h LEU 910 Cb 0.04 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2c3p h LEU 910 CO -0.01 0.25 0.25 -0.61 0.09 0.00 0.00 178.44 178.40 2c3p h GLN 911 N 0.41 0.66 -0.21 1.13 5.75 -0.74 0.93 115.11 123.04 2c3p h GLN 911 Ca 0.12 -0.07 -0.10 0.00 -0.15 0.00 0.00 58.65 58.45 2c3p h GLN 911 Cb -0.04 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.37 2c3p h GLN 911 CO -0.03 0.50 -0.26 0.78 -2.65 0.00 0.00 178.83 177.17 2c3p h GLY 912 N 0.76 0.59 0.89 2.39 0.00 0.08 -2.33 103.07 105.45 2c3p h GLY 912 Ca 0.17 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 2c3p h GLY 912 CO -0.03 0.57 0.09 -0.25 0.00 0.00 0.00 176.54 176.92 2c3p h TRP 913 N 0.22 0.38 -0.83 5.60 7.01 0.07 -1.55 115.95 126.85 2c3p h TRP 913 Ca 0.03 -0.03 0.08 0.00 2.11 0.00 0.00 58.89 61.08 2c3p h TRP 913 Cb 0.82 -0.11 -0.07 0.00 -2.10 0.00 0.00 29.16 27.70 2c3p h TRP 913 CO 0.08 0.42 0.48 -0.07 -2.79 0.00 0.00 178.44 176.57 2c3p h LEU 914 N 0.23 0.71 -0.79 0.65 3.38 -0.83 0.68 115.31 119.35 2c3p h LEU 914 Ca 0.08 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 2c3p h LEU 914 Cb 0.21 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2c3p h LEU 914 CO -0.00 0.42 -0.50 0.00 0.09 0.00 0.00 178.44 178.45 2c3p h ALA 915 N 1.44 0.97 -0.36 1.53 0.00 -1.21 -3.15 119.26 118.47 2c3p h ALA 915 Ca 0.39 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2c3p h ALA 915 Cb 0.30 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2c3p h ALA 915 CO -0.22 0.66 0.03 0.41 0.00 0.00 0.00 179.25 180.12 2c3p n GLY 916 N 0.04 4.10 0.32 0.00 0.00 -0.60 -4.77 105.19 104.28 2c3p n GLY 916 Ca -0.02 -1.07 0.18 0.00 0.00 0.00 0.00 46.02 45.12 2c3p n GLY 916 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2c3p h LYS 917 N 1.87 0.16 -0.55 1.61 3.64 0.38 0.09 116.57 123.77 2c3p h LYS 917 Ca 0.08 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2c3p h LYS 917 Cb 1.64 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.42 2c3p h LYS 917 CO 0.34 0.11 0.00 0.09 -2.27 0.00 0.00 179.45 177.72 2c3p n ASN 918 N -5.24 4.46 -4.45 4.20 3.02 -1.26 -4.34 115.26 111.64 2c3p n ASN 918 Ca 0.26 -2.49 -0.36 0.00 -0.03 0.00 0.00 54.58 51.97 2c3p n ASN 918 Cb 0.85 -0.53 -0.12 0.00 -0.61 0.00 0.00 39.78 39.36 2c3p n ASN 918 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2c3p s ASP 919 N -1.06 5.01 0.23 6.41 3.68 -0.01 -4.96 116.67 125.98 2c3p s ASP 919 Ca 0.47 -0.19 -0.06 0.00 2.13 0.00 0.00 52.55 54.89 2c3p s ASP 919 Cb 0.31 -1.88 0.35 0.00 -1.45 0.00 0.00 42.92 40.25 2c3p s ASP 919 CO 0.21 0.02 1.79 -0.65 0.13 0.00 0.00 175.17 176.67 2c3p h PRO 920 N 7.84 0.64 0.28 4.34 0.11 -1.87 0.22 132.00 143.56 2c3p h PRO 920 Ca -0.37 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 2c3p h PRO 920 Cb 1.17 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2c3p h PRO 920 CO 0.60 0.42 -0.13 0.82 -0.21 0.00 0.00 178.00 179.50 2c3p h ILE 921 N 0.66 0.68 -0.33 4.15 1.08 -1.94 -3.09 117.51 118.71 2c3p h ILE 921 Ca 0.36 -0.77 -0.17 0.00 -0.39 0.00 0.00 64.86 63.90 2c3p h ILE 921 Cb 0.37 1.04 -0.00 0.00 -3.07 0.00 0.00 36.82 35.15 2c3p h ILE 921 CO -0.26 0.14 -0.45 0.11 -0.69 0.00 0.00 178.15 177.00 2c3p h LYS 922 N -0.83 0.89 -0.41 2.37 1.79 -1.80 -1.00 116.57 117.57 2c3p h LYS 922 Ca -0.04 -0.52 -0.02 0.00 -2.18 0.00 0.00 60.65 57.90 2c3p h LYS 922 Cb 0.51 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.18 2c3p h LYS 922 CO 0.06 1.16 0.18 0.66 -1.08 0.00 0.00 179.45 180.43 2c3p h SER 923 N 0.69 0.52 0.01 0.86 4.64 -0.26 -0.45 113.55 119.55 2c3p h SER 923 Ca 0.04 -0.05 -0.24 0.00 -0.47 0.00 0.00 61.79 61.07 2c3p h SER 923 Cb 1.05 -0.13 0.02 0.00 -0.31 0.00 0.00 62.40 63.03 2c3p h SER 923 CO 0.11 0.46 -0.94 0.50 -0.87 0.00 0.00 176.83 176.09 2c3p h LYS 924 N 0.58 0.61 0.11 4.77 3.64 -1.45 -0.17 116.57 124.67 2c3p h LYS 924 Ca 0.14 -0.68 0.02 0.00 -1.27 0.00 0.00 60.65 58.87 2c3p h LYS 924 Cb 0.10 0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 2c3p h LYS 924 CO -0.02 1.27 -0.23 1.49 -2.27 0.00 0.00 179.45 179.70 2c3p h GLU 925 N 0.24 -0.40 0.00 1.90 4.81 -0.54 0.11 114.58 120.69 2c3p h GLU 925 Ca -0.12 0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 58.99 2c3p h GLU 925 Cb 1.61 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 31.06 2c3p h GLU 925 CO 0.18 -0.27 -0.71 1.88 -0.73 0.00 0.00 179.01 179.36 2c3p h TYR 926 N -0.42 0.00 -0.47 0.92 -1.99 -1.18 -3.06 116.97 110.77 2c3p h TYR 926 Ca 0.03 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.66 2c3p h TYR 926 Cb 0.45 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.16 2c3p h TYR 926 CO -0.22 0.71 -0.08 0.78 -0.00 0.00 0.00 178.16 179.36 2c3p h GLY 927 N 2.76 0.95 2.00 3.88 0.00 -0.83 -1.58 103.07 110.25 2c3p h GLY 927 Ca -0.01 -0.76 -0.02 0.00 0.00 0.00 0.00 47.33 46.54 2c3p h GLY 927 CO 0.09 0.70 -0.10 -0.55 0.00 0.00 0.00 176.54 176.69 2c3p h ASP 928 N 0.73 0.00 -0.01 0.19 3.32 -0.76 0.50 116.42 120.38 2c3p h ASP 928 Ca 0.12 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.93 2c3p h ASP 928 Cb 0.62 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.18 2c3p h ASP 928 CO 0.04 0.10 -0.92 0.11 -1.72 0.00 0.00 179.24 176.84 2c3p h LYS 929 N 0.00 0.70 -0.59 3.56 1.57 -1.32 -2.86 116.57 117.64 2c3p h LYS 929 Ca -0.00 -0.67 -0.10 0.00 -1.87 0.00 0.00 60.65 58.00 2c3p h LYS 929 Cb 0.22 0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 2c3p h LYS 929 CO 0.01 1.27 -0.04 -0.07 -0.57 0.00 0.00 179.45 180.05 2c3p h LEU 930 N 0.43 1.05 -0.57 2.94 3.38 -0.43 0.45 115.31 122.56 2c3p h LEU 930 Ca -0.09 -0.32 0.06 0.00 0.09 0.00 0.00 57.88 57.61 2c3p h LEU 930 Cb 1.56 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.98 2c3p h LEU 930 CO 0.18 1.12 0.28 0.11 0.09 0.00 0.00 178.44 180.23 2c3p h LYS 931 N 0.96 0.52 0.31 1.13 1.57 -0.92 0.17 116.57 120.32 2c3p h LYS 931 Ca 0.16 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2c3p h LYS 931 Cb 0.61 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2c3p h LYS 931 CO 0.04 0.35 -0.15 0.87 -0.57 0.00 0.00 179.45 179.99 2c3p h LYS 932 N 0.54 -0.40 -0.47 3.15 1.57 -1.20 -2.75 116.57 117.02 2c3p h LYS 932 Ca 0.26 0.03 0.06 0.00 -1.87 0.00 0.00 60.65 59.12 2c3p h LYS 932 Cb 0.18 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 2c3p h LYS 932 CO -0.18 -0.08 0.32 -0.07 -0.57 0.00 0.00 179.45 178.86 2c3p h LEU 933 N -0.75 0.36 -2.62 2.94 3.38 0.16 -2.77 115.31 116.00 2c3p h LEU 933 Ca -0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2c3p h LEU 933 Cb 0.50 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2c3p h LEU 933 CO 0.07 0.24 0.00 0.18 0.09 0.00 0.00 178.44 179.02 2c3p n LEU 934 N -4.48 3.46 -4.62 1.67 4.77 0.58 -4.97 117.00 113.43 2c3p n LEU 934 Ca 0.06 -1.83 -0.50 0.00 -0.03 0.00 0.00 56.01 53.71 2c3p n LEU 934 Cb 0.24 -0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 40.94 2c3p n LEU 934 CO 0.35 0.83 0.99 0.00 -1.33 0.00 0.00 177.39 178.22 2c3p n ALA 935 N 1.25 -0.16 0.00 -1.18 0.00 -1.04 -1.23 120.51 118.15 2c3p n ALA 935 Ca 0.19 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.12 2c3p n ALA 935 Cb 0.55 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.83 2c3p n ALA 935 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3p n GLY 936 N 2.76 2.41 3.66 0.00 0.00 -1.26 -4.99 105.19 107.77 2c3p n GLY 936 Ca 0.18 -0.05 -0.55 0.00 0.00 0.00 0.00 46.02 45.59 2c3p n GLY 936 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2c3p n GLN 937 N 0.00 1.27 -0.00 1.61 -0.06 -0.37 -4.84 117.38 114.99 2c3p n GLN 937 Ca 0.00 0.45 0.00 0.00 -2.00 0.00 0.00 57.00 55.45 2c3p n GLN 937 Cb 0.00 -2.22 -0.00 0.00 -4.06 0.00 0.00 30.24 23.96 2c3p n GLN 937 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 2c3p n LYS 938 N 6.03 5.95 -4.24 3.69 4.01 -1.26 -4.58 118.16 127.76 2c3p n LYS 938 Ca 0.29 -0.00 -0.25 0.00 -0.51 0.00 0.00 58.31 57.83 2c3p n LYS 938 Cb 0.16 -0.59 -0.08 0.00 -0.51 0.00 0.00 35.03 34.02 2c3p n LYS 938 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2c3p s ASP 939 N -1.18 4.66 0.68 4.39 1.11 -1.26 -4.73 116.67 120.33 2c3p s ASP 939 Ca 0.00 -0.49 0.00 0.00 0.18 0.00 0.00 52.55 52.24 2c3p s ASP 939 Cb 0.00 -0.94 0.00 0.00 1.07 0.00 0.00 42.92 43.06 2c3p s ASP 939 CO 0.03 0.06 0.00 0.61 1.18 0.00 0.00 175.17 177.04 2c3p n GLY 940 N -0.38 0.58 0.26 0.21 0.00 -1.26 -1.72 105.19 102.88 2c3p n GLY 940 Ca -0.09 -0.82 -0.03 0.00 0.00 0.00 0.00 46.02 45.08 2c3p n GLY 940 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2c3p h LEU 941 N 0.00 -0.72 -1.98 0.99 5.85 -1.99 0.13 115.31 117.59 2c3p h LEU 941 Ca 0.00 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2c3p h LEU 941 Cb 0.00 0.41 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 2c3p h LEU 941 CO 0.00 -0.24 -0.10 -0.07 -0.34 0.00 0.00 178.44 177.70 2c3p h LEU 942 N -0.08 0.00 -0.12 2.25 4.07 -1.96 -1.63 115.31 117.84 2c3p h LEU 942 Ca 0.25 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.97 2c3p h LEU 942 Cb 0.47 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.22 2c3p h LEU 942 CO -0.59 0.10 -0.91 1.23 -1.08 0.00 0.00 178.44 177.19 2c3p h GLY 943 N 0.82 0.74 1.33 0.83 0.00 0.11 -1.58 103.07 105.32 2c3p h GLY 943 Ca -0.00 -1.18 -0.15 0.00 0.00 0.00 0.00 47.33 46.00 2c3p h GLY 943 CO 0.01 1.05 -0.42 1.46 0.00 0.00 0.00 176.54 178.64 2c3p h GLN 944 N 0.42 0.73 -0.56 4.80 4.20 -0.68 -2.54 115.11 121.46 2c3p h GLN 944 Ca -0.09 -0.39 -0.10 0.00 0.06 0.00 0.00 58.65 58.14 2c3p h GLN 944 Cb 1.54 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.32 2c3p h GLN 944 CO 0.18 1.01 -0.02 0.82 -0.67 0.00 0.00 178.83 180.14 2c3p h ILE 945 N 0.59 1.27 0.00 2.54 2.04 -1.33 -2.60 117.51 120.02 2c3p h ILE 945 Ca 0.04 -1.16 -0.03 0.00 1.00 0.00 0.00 64.86 64.71 2c3p h ILE 945 Cb 0.97 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.93 2c3p h ILE 945 CO 0.09 0.42 -0.16 0.00 0.00 0.00 0.00 178.15 178.50 2c3p h ALA 946 N 0.96 1.41 -0.02 1.87 0.00 -1.14 -1.87 119.26 120.47 2c3p h ALA 946 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2c3p h ALA 946 Cb 0.58 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2c3p h ALA 946 CO 0.03 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.48 2c3p n ALA 947 N -2.36 2.60 -1.06 0.00 0.00 -0.97 -3.80 120.51 114.91 2c3p n ALA 947 Ca -0.02 -0.39 0.07 0.00 0.00 0.00 0.00 53.44 53.10 2c3p n ALA 947 Cb 0.25 -1.24 0.24 0.00 0.00 0.00 0.00 19.45 18.70 2c3p n ALA 947 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2c3p n MET 948 N -0.10 2.59 -0.07 0.00 2.00 -0.70 -4.75 117.12 116.09 2c3p n MET 948 Ca 0.20 -2.86 0.18 0.00 0.00 0.00 0.00 57.70 55.22 2c3p n MET 948 Cb 0.29 -1.80 0.61 0.00 0.00 0.00 0.00 33.22 32.32 2c3p n MET 948 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2c3p h SER 949 N 1.49 0.17 0.00 7.83 4.64 -1.67 0.87 113.55 126.87 2c3p h SER 949 Ca 0.03 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2c3p h SER 949 Cb 1.43 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 2c3p h SER 949 CO 0.22 0.09 0.00 -0.90 -0.87 0.00 0.00 176.83 175.37 2c3p n ASP 950 N -4.42 0.00 -0.05 4.97 5.68 -1.26 -1.40 116.55 120.07 2c3p n ASP 950 Ca 0.12 -1.01 0.01 0.00 -0.50 0.00 0.00 54.79 53.40 2c3p n ASP 950 Cb 0.57 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 2c3p n ASP 950 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2c3p n LEU 951 N -0.61 0.76 0.47 -2.12 4.77 0.30 -4.82 117.00 115.75 2c3p n LEU 951 Ca 0.03 -0.82 -0.19 0.00 -0.03 0.00 0.00 56.01 55.00 2c3p n LEU 951 Cb 0.01 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.01 2c3p n LEU 951 CO 0.02 0.18 0.54 1.88 -1.33 0.00 0.00 177.39 178.68 2c3p h TYR 952 N 0.23 -1.19 -3.63 -1.77 0.99 -1.28 -3.43 116.97 106.89 2c3p h TYR 952 Ca 0.00 -0.02 -0.51 0.00 2.00 0.00 0.00 58.73 60.20 2c3p h TYR 952 Cb 0.06 0.40 -0.01 0.00 1.00 0.00 0.00 36.73 38.18 2c3p h TYR 952 CO 0.00 -0.72 0.38 -0.08 -0.00 0.00 0.00 178.16 177.75 2c3p s THR 953 N -5.75 4.21 -0.06 -2.88 -1.32 -1.26 -4.68 115.64 103.91 2c3p s THR 953 Ca -0.18 1.97 -0.36 0.00 -1.21 0.00 0.00 61.69 61.91 2c3p s THR 953 Cb 0.02 -4.26 -0.14 0.00 -1.51 0.00 0.00 72.50 66.62 2c3p s THR 953 CO 0.55 0.37 1.73 1.17 -2.21 0.00 0.00 174.62 176.23 2c3p n LYS 954 N 2.26 1.84 -2.77 7.08 3.00 -1.26 -4.97 118.16 123.34 2c3p n LYS 954 Ca 0.01 0.67 -0.27 0.00 -0.00 0.00 0.00 58.31 58.72 2c3p n LYS 954 Cb 0.48 -2.45 -0.00 0.00 0.00 0.00 0.00 35.03 33.06 2c3p n LYS 954 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2c3p s LYS 955 N 2.94 3.54 -0.26 1.64 -0.14 -1.26 -4.79 119.74 121.40 2c3p s LYS 955 Ca 0.90 0.11 0.02 0.00 -1.36 0.00 0.00 55.97 55.64 2c3p s LYS 955 Cb -0.80 -2.43 0.05 0.00 -1.68 0.00 0.00 37.83 32.98 2c3p s LYS 955 CO 0.51 -0.14 -0.09 0.45 -0.76 0.00 0.00 175.35 175.32 2c3p s SER 956 N -4.07 4.43 -0.29 2.83 0.15 0.15 -5.01 113.70 111.88 2c3p s SER 956 Ca 0.46 -1.28 -0.18 0.00 0.70 0.00 0.00 55.95 55.65 2c3p s SER 956 Cb -0.10 -1.58 -0.02 0.00 -1.71 0.00 0.00 66.02 62.60 2c3p s SER 956 CO 0.43 -0.18 0.54 -0.69 1.20 0.00 0.00 173.24 174.53 2c3p s VAL 957 N 1.16 5.03 0.09 4.45 1.01 -1.26 -0.72 120.40 130.16 2c3p s VAL 957 Ca -0.07 0.77 0.09 0.00 0.00 0.00 0.00 61.98 62.78 2c3p s VAL 957 Cb -0.19 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2c3p s VAL 957 CO -0.05 -0.02 -0.22 0.26 0.00 0.00 0.00 175.10 175.08 2c3p s TRP 958 N 2.39 2.45 -0.21 5.22 0.52 0.48 -0.99 118.94 128.79 2c3p s TRP 958 Ca 0.22 -0.31 0.02 0.00 0.02 0.00 0.00 56.10 56.04 2c3p s TRP 958 Cb -0.15 -1.35 0.04 0.00 -1.15 0.00 0.00 33.47 30.86 2c3p s TRP 958 CO 0.10 0.31 -0.13 0.42 0.02 0.00 0.00 176.95 177.67 2c3p s ILE 959 N -1.03 1.93 -0.13 2.03 1.01 0.93 -1.23 121.20 124.71 2c3p s ILE 959 Ca 0.15 -1.21 -0.06 0.00 0.00 0.00 0.00 60.65 59.54 2c3p s ILE 959 Cb -0.10 -1.95 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 2c3p s ILE 959 CO 0.07 0.20 0.08 -0.36 0.00 0.00 0.00 174.94 174.93 2c3p s PHE 960 N 1.27 3.39 0.01 3.97 2.99 -0.65 -0.53 117.98 128.41 2c3p s PHE 960 Ca -0.02 0.32 -0.28 0.00 0.00 0.00 0.00 56.93 56.94 2c3p s PHE 960 Cb -0.17 -1.95 0.10 0.00 0.00 0.00 0.00 43.02 41.00 2c3p s PHE 960 CO -0.08 0.49 0.86 0.20 -0.00 0.00 0.00 175.22 176.69 2c3p s GLY 961 N -0.53 -0.48 0.80 4.36 0.00 -0.96 0.02 107.32 110.52 2c3p s GLY 961 Ca 0.11 0.99 -0.06 0.00 0.00 0.00 0.00 44.72 45.76 2c3p s GLY 961 CO 0.02 0.34 1.09 0.61 0.00 0.00 0.00 173.10 175.16 2c3p n GLY 962 N -0.22 -0.17 0.27 0.20 0.00 -1.26 -0.97 105.19 103.03 2c3p n GLY 962 Ca -0.10 -1.91 -0.08 0.00 0.00 0.00 0.00 46.02 43.94 2c3p n GLY 962 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2c3p h ASP 963 N -1.00 0.80 -0.93 1.61 2.03 -1.84 -1.88 116.42 115.22 2c3p h ASP 963 Ca -0.36 -0.29 0.08 0.00 -0.73 0.00 0.00 57.03 55.73 2c3p h ASP 963 Cb 1.17 -0.22 -0.07 0.00 -0.83 0.00 0.00 39.33 39.38 2c3p h ASP 963 CO 0.32 1.00 0.58 1.23 -1.03 0.00 0.00 179.24 181.34 2c3p h GLY 964 N 0.96 1.43 0.68 7.15 0.00 -1.92 0.35 103.07 111.72 2c3p h GLY 964 Ca 0.09 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2c3p h GLY 964 CO 0.06 0.25 -0.16 -0.25 0.00 0.00 0.00 176.54 176.44 2c3p h TRP 965 N 1.01 -0.40 -0.14 5.60 7.01 -1.84 -2.03 115.95 125.15 2c3p h TRP 965 Ca 0.42 -0.01 -0.15 0.00 2.11 0.00 0.00 58.89 61.26 2c3p h TRP 965 Cb 0.26 0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.44 2c3p h TRP 965 CO -0.02 -0.08 -0.56 0.00 -2.79 0.00 0.00 178.44 174.99 2c3p h ALA 966 N -0.23 0.77 0.00 2.65 0.00 -1.04 0.32 119.26 121.74 2c3p h ALA 966 Ca -0.04 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 2c3p h ALA 966 Cb 0.51 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2c3p h ALA 966 CO 0.07 0.69 -1.46 0.66 0.00 0.00 0.00 179.25 179.22 2c3p n TYR 967 N -3.94 0.58 0.00 0.00 4.02 0.12 -3.81 117.16 114.13 2c3p n TYR 967 Ca -0.03 0.17 0.00 0.00 -0.01 0.00 0.00 57.90 58.03 2c3p n TYR 967 Cb 0.60 -0.80 0.00 0.00 -0.02 0.00 0.00 39.34 39.12 2c3p n TYR 967 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2c3p n ASP 968 N -2.54 0.00 0.06 7.72 10.43 -0.78 -4.71 116.55 126.72 2c3p n ASP 968 Ca -0.03 0.00 0.04 0.00 2.57 0.00 0.00 54.79 57.37 2c3p n ASP 968 Cb 0.60 0.00 0.45 0.00 1.84 0.00 0.00 41.12 44.01 2c3p n ASP 968 CO 0.00 0.00 0.00 -0.29 -1.07 0.00 0.00 177.20 175.84 2c3p h ILE 969 N 0.00 1.10 -0.32 0.53 2.10 -1.22 -2.87 117.51 116.83 2c3p h ILE 969 Ca 0.00 -0.27 0.00 0.00 1.08 0.00 0.00 64.86 65.67 2c3p h ILE 969 Cb 0.00 0.71 0.00 0.00 -1.09 0.00 0.00 36.82 36.44 2c3p h ILE 969 CO 0.00 0.11 0.00 0.61 -1.08 0.00 0.00 178.15 177.79 2c3p n GLY 970 N -1.37 1.61 0.25 8.18 0.00 0.11 -4.58 105.19 109.40 2c3p n GLY 970 Ca 0.01 -0.55 -0.00 0.00 0.00 0.00 0.00 46.02 45.48 2c3p n GLY 970 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2c3p h TYR 971 N 3.31 0.53 -0.93 1.61 3.20 -1.33 0.32 116.97 123.68 2c3p h TYR 971 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2c3p h TYR 971 Cb 0.81 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.89 2c3p h TYR 971 CO 0.20 0.19 0.59 0.78 -1.64 0.00 0.00 178.16 178.28 2c3p h GLY 972 N 0.52 1.33 0.73 1.82 0.00 -1.81 0.16 103.07 105.83 2c3p h GLY 972 Ca 0.31 -0.53 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2c3p h GLY 972 CO -0.26 0.52 -0.10 -1.33 0.00 0.00 0.00 176.54 175.37 2c3p h GLY 973 N 1.27 0.34 0.63 4.60 0.00 -1.61 -2.06 103.07 106.25 2c3p h GLY 973 Ca 0.34 -0.32 0.04 0.00 0.00 0.00 0.00 47.33 47.38 2c3p h GLY 973 CO -0.07 0.29 -0.04 -2.00 0.00 0.00 0.00 176.54 174.72 2c3p h LEU 974 N -0.05 -0.16 -0.27 3.11 5.85 -0.07 -1.15 115.31 122.58 2c3p h LEU 974 Ca 0.03 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.85 2c3p h LEU 974 Cb 0.59 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 2c3p h LEU 974 CO 0.03 -0.06 -0.03 -0.78 -0.34 0.00 0.00 178.44 177.26 2c3p h ASP 975 N 0.01 -0.17 -0.49 1.25 1.82 -0.68 -1.12 116.42 117.04 2c3p h ASP 975 Ca 0.09 0.07 -0.03 0.00 -0.39 0.00 0.00 57.03 56.77 2c3p h ASP 975 Cb 0.14 0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 2c3p h ASP 975 CO -0.19 -0.05 0.20 -0.74 -1.61 0.00 0.00 179.24 176.84 2c3p h HIS 976 N 0.04 0.75 -0.46 0.28 2.76 -0.95 -1.28 115.15 116.29 2c3p h HIS 976 Ca 0.13 -0.06 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 2c3p h HIS 976 Cb 0.18 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 28.90 2c3p h HIS 976 CO -0.23 0.62 0.23 0.28 -1.30 0.00 0.00 177.93 177.53 2c3p h VAL 977 N 0.65 1.18 -0.23 5.26 2.07 -0.94 -1.78 116.25 122.46 2c3p h VAL 977 Ca 0.16 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 67.11 2c3p h VAL 977 Cb 0.20 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2c3p h VAL 977 CO -0.01 0.20 -0.13 -0.07 0.02 0.00 0.00 177.57 177.58 2c3p h LEU 978 N 0.61 0.36 -0.22 2.57 3.38 -1.10 -2.04 115.31 118.86 2c3p h LEU 978 Ca 0.16 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2c3p h LEU 978 Cb 0.11 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2c3p h LEU 978 CO -0.02 0.52 0.00 0.00 0.09 0.00 0.00 178.44 179.02 2c3p n ALA 979 N -2.48 1.92 0.22 1.53 0.00 -0.49 -2.92 120.51 118.29 2c3p n ALA 979 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 53.44 53.53 2c3p n ALA 979 Cb 0.30 -1.38 0.45 0.00 0.00 0.00 0.00 19.45 18.82 2c3p n ALA 979 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2c3p h SER 980 N 0.00 0.00 0.00 0.00 4.64 -0.58 -3.46 113.55 114.15 2c3p h SER 980 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2c3p h SER 980 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2c3p h SER 980 CO 0.00 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 176.78 2c3p n GLY 981 N 0.24 0.49 3.87 -0.77 0.00 -1.15 -5.02 105.19 102.86 2c3p n GLY 981 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2c3p n GLY 981 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c3p s GLU 982 N -0.21 3.17 -1.30 1.61 0.41 -1.26 -4.26 118.70 116.86 2c3p s GLU 982 Ca 0.00 0.62 -0.18 0.00 -0.41 0.00 0.00 54.97 55.00 2c3p s GLU 982 Cb 0.00 -2.04 0.06 0.00 -1.78 0.00 0.00 34.13 30.36 2c3p s GLU 982 CO 0.00 -0.85 1.77 -3.47 -0.49 0.00 0.00 175.26 172.22 2c3p n ASP 983 N -2.91 4.77 -4.38 -0.19 4.64 -1.26 -1.40 116.55 115.83 2c3p n ASP 983 Ca 0.07 -2.90 -0.19 0.00 -1.38 0.00 0.00 54.79 50.38 2c3p n ASP 983 Cb 0.56 -1.74 -0.10 0.00 -1.04 0.00 0.00 41.12 38.79 2c3p n ASP 983 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 2c3p s VAL 984 N 4.64 1.58 -0.13 5.18 -7.23 -1.22 -4.67 120.40 118.55 2c3p s VAL 984 Ca 0.55 -2.14 0.01 0.00 -1.81 0.00 0.00 61.98 58.58 2c3p s VAL 984 Cb 0.04 -2.25 0.02 0.00 0.56 0.00 0.00 36.38 34.74 2c3p s VAL 984 CO 0.08 -0.44 -0.15 0.20 -0.31 0.00 0.00 175.10 174.48 2c3p s ASN 985 N -3.37 2.64 -0.21 4.85 0.01 -0.16 -1.32 114.94 117.38 2c3p s ASN 985 Ca 0.26 -0.48 -0.06 0.00 -0.71 0.00 0.00 52.86 51.87 2c3p s ASN 985 Cb 0.02 -1.18 -0.03 0.00 0.41 0.00 0.00 41.25 40.48 2c3p s ASN 985 CO 0.09 -0.01 0.03 -0.69 -1.51 0.00 0.00 177.10 175.01 2c3p s VAL 986 N 1.22 4.20 -0.30 1.60 1.01 0.23 -0.05 120.40 128.30 2c3p s VAL 986 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.75 2c3p s VAL 986 Cb -0.14 -2.92 0.06 0.00 0.00 0.00 0.00 36.38 33.38 2c3p s VAL 986 CO -0.06 0.40 -0.02 0.12 0.00 0.00 0.00 175.10 175.54 2c3p s PHE 987 N 1.11 3.32 -0.25 5.22 5.36 0.31 -0.36 117.98 132.70 2c3p s PHE 987 Ca 0.03 -2.13 -0.12 0.00 -0.96 0.00 0.00 56.93 53.75 2c3p s PHE 987 Cb -0.14 -2.18 -0.05 0.00 -0.34 0.00 0.00 43.02 40.31 2c3p s PHE 987 CO 0.02 -0.85 0.25 0.08 -1.46 0.00 0.00 175.22 173.26 2c3p s VAL 988 N 1.17 5.29 -0.73 3.12 1.01 0.42 -2.26 120.40 128.42 2c3p s VAL 988 Ca -0.04 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.11 2c3p s VAL 988 Cb -0.20 -3.58 0.17 0.00 0.00 0.00 0.00 36.38 32.76 2c3p s VAL 988 CO -0.03 0.27 0.74 -0.04 0.00 0.00 0.00 175.10 176.04 2c3p s MET 989 N 1.46 3.36 -0.53 2.72 -1.94 -0.14 -0.57 119.30 123.64 2c3p s MET 989 Ca 0.11 -1.98 -0.29 0.00 -1.71 0.00 0.00 55.69 51.82 2c3p s MET 989 Cb -0.15 -4.43 0.03 0.00 2.01 0.00 0.00 34.83 32.29 2c3p s MET 989 CO 0.08 -1.41 1.20 0.34 -0.01 0.00 0.00 175.02 175.22 2c3p s ASP 990 N 2.96 6.49 0.00 3.03 -1.08 -0.30 -3.22 116.67 124.54 2c3p s ASP 990 Ca 0.15 0.29 0.22 0.00 -0.52 0.00 0.00 52.55 52.69 2c3p s ASP 990 Cb -0.17 -2.55 0.21 0.00 -1.46 0.00 0.00 42.92 38.95 2c3p s ASP 990 CO -0.03 -1.41 1.22 0.35 0.52 0.00 0.00 175.17 175.82 2c3p n THR 991 N 6.78 0.07 -1.66 1.71 -2.24 -1.26 -0.86 114.28 116.81 2c3p n THR 991 Ca 0.10 -0.54 -0.19 0.00 -2.27 0.00 0.00 64.05 61.16 2c3p n THR 991 Cb 0.49 1.39 -0.07 0.00 -2.10 0.00 0.00 70.33 70.04 2c3p n THR 991 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2c3p n GLU 992 N 1.27 -1.32 -3.68 -0.78 1.02 -1.26 -4.89 120.64 111.00 2c3p n GLU 992 Ca 0.14 1.11 -0.03 0.00 -0.02 0.00 0.00 57.16 58.36 2c3p n GLU 992 Cb 0.56 -5.44 -0.01 0.00 -0.02 0.00 0.00 31.44 26.53 2c3p n GLU 992 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2c3p s VAL 993 N -2.73 0.00 -0.71 2.62 -7.23 -1.26 -3.60 120.40 107.49 2c3p s VAL 993 Ca 0.00 -0.43 -0.23 0.00 -1.81 0.00 0.00 61.98 59.50 2c3p s VAL 993 Cb 0.00 -1.78 0.07 0.00 0.56 0.00 0.00 36.38 35.22 2c3p s VAL 993 CO 0.00 0.00 1.06 -0.31 -0.31 0.00 0.00 175.10 175.54 2c3p s TYR 994 N -3.04 2.62 -0.02 2.82 1.51 0.54 -4.51 117.35 117.27 2c3p s TYR 994 Ca 0.11 -0.53 -0.20 0.00 -1.01 0.00 0.00 57.07 55.45 2c3p s TYR 994 Cb -0.00 -4.38 -0.11 0.00 -0.11 0.00 0.00 41.96 37.36 2c3p s TYR 994 CO -0.01 -1.74 0.82 0.77 -1.11 0.00 0.00 175.55 174.28 2c3p h SER 995 N 9.62 -0.52 -0.93 2.29 0.02 -1.94 0.17 113.55 122.25 2c3p h SER 995 Ca -0.23 -0.03 0.20 0.00 -0.84 0.00 0.00 61.79 60.90 2c3p h SER 995 Cb 1.06 0.14 -0.11 0.00 0.14 0.00 0.00 62.40 63.62 2c3p h SER 995 CO 1.21 -0.10 0.49 -1.13 -1.14 0.00 0.00 176.83 176.16 2c3p h ASN 996 N -1.12 0.54 0.37 3.07 -1.24 -1.93 -1.28 115.58 113.99 2c3p h ASN 996 Ca -0.06 0.13 0.00 0.00 0.71 0.00 0.00 56.30 57.07 2c3p h ASN 996 Cb 0.52 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.62 2c3p h ASN 996 CO 0.10 0.12 -0.04 0.35 -1.29 0.00 0.00 177.43 176.67 2c3p n THR 997 N -4.92 0.00 0.00 -3.57 -2.24 -1.26 -4.88 114.28 97.41 2c3p n THR 997 Ca 0.22 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 2c3p n THR 997 Cb 0.61 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 2c3p n THR 997 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3p n GLY 998 N 1.23 1.63 3.13 3.38 0.00 -0.49 -4.86 105.19 109.22 2c3p n GLY 998 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 2c3p n GLY 998 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c3p n GLY 999 N -0.05 -0.23 3.82 -0.02 0.00 0.02 -4.77 105.19 103.96 2c3p n GLY 999 Ca 0.00 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2c3p n GLY 999 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c3p s GLN 1000N -5.96 4.24 0.55 1.61 1.11 -1.03 -1.37 119.66 118.80 2c3p s GLN 1000Ca 0.43 1.08 -0.21 0.00 0.01 0.00 0.00 55.36 56.67 2c3p s GLN 1000Cb -0.19 -2.29 -0.05 0.00 -1.01 0.00 0.00 33.01 29.47 2c3p s GLN 1000CO 0.57 0.04 1.25 0.45 0.01 0.00 0.00 175.29 177.61 2c3p s SER 1001N -2.12 5.41 0.24 5.90 0.15 0.29 -0.34 113.70 123.25 2c3p s SER 1001Ca 0.59 2.50 0.01 0.00 0.70 0.00 0.00 55.95 59.76 2c3p s SER 1001Cb -0.10 -2.61 -0.05 0.00 -1.71 0.00 0.00 66.02 61.54 2c3p s SER 1001CO 0.15 -1.45 0.08 -0.94 1.20 0.00 0.00 173.24 172.28 2c3p s SER 1002N -1.32 1.25 0.00 5.45 1.04 -1.26 -4.70 113.70 114.15 2c3p s SER 1002Ca 0.73 -1.34 0.10 0.00 0.48 0.00 0.00 55.95 55.92 2c3p s SER 1002Cb -0.34 0.14 0.50 0.00 0.10 0.00 0.00 66.02 66.43 2c3p s SER 1002CO 0.38 -0.69 1.24 0.29 0.98 0.00 0.00 173.24 175.44 2c3p n LYS 1003N -0.43 0.12 0.00 4.02 5.02 -1.26 -0.69 118.16 124.94 2c3p n LYS 1003Ca -0.01 0.21 0.12 0.00 -2.02 0.00 0.00 58.31 56.61 2c3p n LYS 1003Cb 0.66 -1.50 0.27 0.00 -0.02 0.00 0.00 35.03 34.44 2c3p n LYS 1003CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2c3p n ALA 1004N -1.33 3.42 -2.00 7.82 0.00 -1.26 -0.42 120.51 126.74 2c3p n ALA 1004Ca 0.04 -0.33 -0.41 0.00 0.00 0.00 0.00 53.44 52.74 2c3p n ALA 1004Cb 0.09 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 2c3p n ALA 1004CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2c3p s THR 1005N -3.01 3.10 0.72 0.00 2.01 0.14 -4.64 115.64 113.96 2c3p s THR 1005Ca 0.11 0.89 -0.11 0.00 0.31 0.00 0.00 61.69 62.88 2c3p s THR 1005Cb 0.17 -3.57 0.02 0.00 0.01 0.00 0.00 72.50 69.14 2c3p s THR 1005CO 0.69 0.12 1.07 -2.16 -0.69 0.00 0.00 174.62 173.66 2c3p s PRO 1006N 0.05 2.74 0.21 4.92 0.04 -1.26 -3.89 135.00 137.81 2c3p s PRO 1006Ca 0.59 0.75 -0.32 0.00 0.04 0.00 0.00 61.00 62.05 2c3p s PRO 1006Cb -0.38 -1.98 -0.13 0.00 0.04 0.00 0.00 34.50 32.05 2c3p s PRO 1006CO 0.38 -1.18 1.52 2.41 0.04 0.00 0.00 177.00 180.16 2c3p n THR 1007N -3.16 0.52 -0.84 1.26 -1.04 -1.25 -2.14 114.28 107.63 2c3p n THR 1007Ca 0.07 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 2c3p n THR 1007Cb 0.55 -1.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.47 2c3p n THR 1007CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2c3p n GLY 1008N 2.77 0.95 3.77 3.41 0.00 0.13 -4.84 105.19 111.37 2c3p n GLY 1008Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2c3p n GLY 1008CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p s ALA 1009N -3.41 3.28 -0.14 4.61 0.00 -0.91 -4.44 121.76 120.75 2c3p s ALA 1009Ca 0.00 0.69 -0.17 0.00 0.00 0.00 0.00 51.96 52.47 2c3p s ALA 1009Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 2c3p s ALA 1009CO 0.00 0.03 0.45 0.08 0.00 0.00 0.00 175.76 176.31 2c3p s VAL 1010N -1.37 5.20 0.23 0.00 1.01 0.13 -0.97 120.40 124.62 2c3p s VAL 1010Ca 0.47 0.87 -0.22 0.00 0.00 0.00 0.00 61.98 63.10 2c3p s VAL 1010Cb -0.25 -3.79 0.04 0.00 0.00 0.00 0.00 36.38 32.38 2c3p s VAL 1010CO 0.32 0.31 0.72 0.00 0.00 0.00 0.00 175.10 176.45 2c3p s ALA 1011N 0.80 -1.38 0.28 5.51 0.00 -1.13 -4.79 121.76 121.05 2c3p s ALA 1011Ca 0.24 -0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.88 2c3p s ALA 1011Cb -0.15 0.82 -0.12 0.00 0.00 0.00 0.00 23.12 23.68 2c3p s ALA 1011CO 0.09 -0.96 1.63 0.15 0.00 0.00 0.00 175.76 176.67 2c3p s LYS 1012N -3.78 4.11 -0.38 0.00 -0.14 -0.47 -0.92 119.74 118.16 2c3p s LYS 1012Ca 0.09 2.60 0.00 0.00 -1.36 0.00 0.00 55.97 57.30 2c3p s LYS 1012Cb -0.04 -3.03 0.00 0.00 -1.68 0.00 0.00 37.83 33.08 2c3p s LYS 1012CO 0.01 -0.67 0.00 1.19 -0.76 0.00 0.00 175.35 175.12 2c3p n PHE 1013N 2.49 0.00 -2.68 3.18 3.01 -1.26 -0.54 117.46 121.65 2c3p n PHE 1013Ca 0.10 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.53 2c3p n PHE 1013Cb 0.37 -1.02 0.12 0.00 -0.01 0.00 0.00 39.48 38.94 2c3p n PHE 1013CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2c3p n ALA 1014N 1.07 2.76 1.24 4.37 0.00 -0.10 -4.90 120.51 124.95 2c3p n ALA 1014Ca -0.04 -1.16 0.06 0.00 0.00 0.00 0.00 53.44 52.30 2c3p n ALA 1014Cb 0.16 -0.84 0.33 0.00 0.00 0.00 0.00 19.45 19.11 2c3p n ALA 1014CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c3p n ALA 1015N -1.41 2.19 -0.65 0.00 0.00 -0.86 -1.08 120.51 118.69 2c3p n ALA 1015Ca -0.15 -0.07 0.04 0.00 0.00 0.00 0.00 53.44 53.26 2c3p n ALA 1015Cb 0.87 -1.18 0.06 0.00 0.00 0.00 0.00 19.45 19.20 2c3p n ALA 1015CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c3p n ALA 1016N -0.78 2.04 -0.00 0.00 0.00 -1.26 -4.93 120.51 115.58 2c3p n ALA 1016Ca 0.08 -1.64 0.00 0.00 0.00 0.00 0.00 53.44 51.88 2c3p n ALA 1016Cb 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.30 2c3p n ALA 1016CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3p n GLY 1017N -0.82 -0.06 3.72 0.00 0.00 -0.24 -4.94 105.19 102.84 2c3p n GLY 1017Ca 0.07 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 2c3p n GLY 1017CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2c3p s LYS 1018N -4.64 4.13 -0.21 1.61 2.20 -0.15 -4.64 119.74 118.05 2c3p s LYS 1018Ca 0.00 2.58 0.15 0.00 -0.36 0.00 0.00 55.97 58.34 2c3p s LYS 1018Cb 0.00 -3.07 0.80 0.00 -1.51 0.00 0.00 37.83 34.04 2c3p s LYS 1018CO 0.00 -0.72 1.72 0.54 -0.36 0.00 0.00 175.35 176.52 2c3p n ARG 1019N 3.70 4.66 -4.18 4.03 5.12 -1.26 0.20 116.66 128.92 2c3p n ARG 1019Ca 0.14 -3.07 -0.16 0.00 -1.93 0.00 0.00 57.85 52.83 2c3p n ARG 1019Cb 0.36 -2.20 -0.12 0.00 -1.16 0.00 0.00 32.46 29.34 2c3p n ARG 1019CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2c3p s THR 1020N -2.57 0.78 1.02 0.55 -4.23 -1.26 -5.04 115.64 104.88 2c3p s THR 1020Ca 0.53 -0.96 -0.12 0.00 -1.18 0.00 0.00 61.69 59.96 2c3p s THR 1020Cb 0.40 -0.76 0.20 0.00 1.34 0.00 0.00 72.50 73.68 2c3p s THR 1020CO 0.17 -0.17 1.09 -0.83 -0.54 0.00 0.00 174.62 174.34 2c3p s GLY 1021N -1.26 1.56 0.05 3.99 0.00 -1.26 -3.87 107.32 106.53 2c3p s GLY 1021Ca -0.04 -0.36 -0.31 0.00 0.00 0.00 0.00 44.72 44.02 2c3p s GLY 1021CO 0.01 0.27 1.32 1.25 0.00 0.00 0.00 173.10 175.95 2c3p s LYS 1022N -4.92 4.35 0.30 2.90 2.20 -1.25 -4.78 119.74 118.53 2c3p s LYS 1022Ca 0.66 1.91 -0.30 0.00 -0.36 0.00 0.00 55.97 57.88 2c3p s LYS 1022Cb -0.19 -3.41 -0.13 0.00 -1.51 0.00 0.00 37.83 32.60 2c3p s LYS 1022CO 0.58 -0.42 1.38 1.17 -0.36 0.00 0.00 175.35 177.70 2c3p n LYS 1023N 4.49 2.19 -2.82 4.03 4.81 0.44 -4.89 118.16 126.40 2c3p n LYS 1023Ca 0.11 0.77 -0.43 0.00 -0.87 0.00 0.00 58.31 57.89 2c3p n LYS 1023Cb 0.44 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.08 2c3p n LYS 1023CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2c3p n ASP 1024N 1.49 5.43 -0.23 3.14 -0.08 -1.26 -4.83 116.55 120.21 2c3p n ASP 1024Ca 0.08 -3.10 -0.02 0.00 -1.51 0.00 0.00 54.79 50.23 2c3p n ASP 1024Cb 0.34 -1.46 0.09 0.00 2.34 0.00 0.00 41.12 42.43 2c3p n ASP 1024CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2c3p h LEU 1025N 7.90 0.57 0.10 -2.67 5.85 -1.97 -2.04 115.31 123.06 2c3p h LEU 1025Ca 0.30 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.05 2c3p h LEU 1025Cb 0.75 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2c3p h LEU 1025CO 1.35 0.38 -0.15 0.00 -0.34 0.00 0.00 178.44 179.68 2c3p h ALA 1026N 1.33 -0.25 0.00 1.25 0.00 -1.99 -1.55 119.26 118.04 2c3p h ALA 1026Ca 0.29 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 2c3p h ALA 1026Cb 0.14 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2c3p h ALA 1026CO -0.16 -0.67 -0.24 0.00 0.00 0.00 0.00 179.25 178.18 2c3p h ARG 1027N -0.30 0.00 -0.35 0.00 3.08 -1.94 -1.26 114.38 113.61 2c3p h ARG 1027Ca 0.02 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 2c3p h ARG 1027Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 2c3p h ARG 1027CO -0.08 0.24 -0.26 0.52 -1.07 0.00 0.00 179.97 179.33 2c3p h MET 1028N 0.00 0.79 -0.10 0.04 2.86 -0.79 -3.10 114.93 114.63 2c3p h MET 1028Ca -0.00 -0.38 -0.13 0.00 -2.06 0.00 0.00 59.70 57.13 2c3p h MET 1028Cb 0.49 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2c3p h MET 1028CO 0.03 1.01 -0.51 0.28 1.06 0.00 0.00 176.91 178.79 2c3p h VAL 1029N 0.58 1.35 0.00 -2.22 2.07 -0.98 -2.97 116.25 114.08 2c3p h VAL 1029Ca 0.07 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.83 2c3p h VAL 1029Cb 0.82 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2c3p h VAL 1029CO 0.07 0.52 0.00 0.24 0.02 0.00 0.00 177.57 178.42 2c3p h MET 1030N 0.21 0.00 0.00 1.57 2.07 -1.16 -2.38 114.93 115.23 2c3p h MET 1030Ca 0.01 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.64 2c3p h MET 1030Cb 0.97 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.70 2c3p h MET 1030CO 0.08 0.00 0.00 0.25 1.07 0.00 0.00 176.91 178.31 2c3p n THR 1031N -2.93 0.98 -0.01 2.22 -2.24 -1.12 -1.96 114.28 109.22 2c3p n THR 1031Ca -0.01 0.38 -0.11 0.00 -2.27 0.00 0.00 64.05 62.03 2c3p n THR 1031Cb 0.16 -1.31 0.02 0.00 -2.10 0.00 0.00 70.33 67.10 2c3p n THR 1031CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 2c3p h TYR 1032N 0.00 0.81 0.00 4.78 0.05 -1.63 -3.47 116.97 117.51 2c3p h TYR 1032Ca 0.00 -0.30 0.00 0.00 0.05 0.00 0.00 58.73 58.48 2c3p h TYR 1032Cb 0.23 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.82 2c3p h TYR 1032CO 0.00 1.07 0.00 0.41 -1.05 0.00 0.00 178.16 178.59 2c3p n GLY 1033N 0.35 2.59 1.24 3.88 0.00 -0.83 -4.77 105.19 107.63 2c3p n GLY 1033Ca -0.04 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.04 2c3p n GLY 1033CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2c3p n TYR 1034N 0.00 1.18 -4.88 1.61 0.18 -1.26 -4.54 117.16 109.45 2c3p n TYR 1034Ca 0.00 -0.67 -0.33 0.00 1.88 0.00 0.00 57.90 58.79 2c3p n TYR 1034Cb 0.00 -0.24 -0.15 0.00 -0.38 0.00 0.00 39.34 38.57 2c3p n TYR 1034CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2c3p s VAL 1035N -1.99 2.84 -0.08 -3.48 1.01 -1.26 -4.47 120.40 112.98 2c3p s VAL 1035Ca 0.43 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 2c3p s VAL 1035Cb 0.30 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 2c3p s VAL 1035CO 0.18 0.54 1.21 -0.47 0.00 0.00 0.00 175.10 176.56 2c3p s TYR 1036N 0.29 3.12 -0.03 5.22 5.04 -0.15 -4.69 117.35 126.14 2c3p s TYR 1036Ca -0.11 1.17 0.05 0.00 -2.44 0.00 0.00 57.07 55.73 2c3p s TYR 1036Cb -0.16 -3.44 -0.01 0.00 0.35 0.00 0.00 41.96 38.70 2c3p s TYR 1036CO 0.06 -1.40 -0.17 0.08 -1.34 0.00 0.00 175.55 172.79 2c3p s VAL 1037N 2.48 1.37 0.03 3.14 1.01 -0.60 -0.53 120.40 127.29 2c3p s VAL 1037Ca 0.56 -0.70 -0.21 0.00 0.00 0.00 0.00 61.98 61.62 2c3p s VAL 1037Cb -0.24 -1.17 0.05 0.00 0.00 0.00 0.00 36.38 35.02 2c3p s VAL 1037CO 0.20 0.39 0.49 0.00 0.00 0.00 0.00 175.10 176.19 2c3p s ALA 1038N -0.09 -1.25 0.10 5.51 0.00 -0.44 0.13 121.76 125.71 2c3p s ALA 1038Ca -0.00 0.56 0.09 0.00 0.00 0.00 0.00 51.96 52.61 2c3p s ALA 1038Cb -0.10 0.32 -0.04 0.00 0.00 0.00 0.00 23.12 23.31 2c3p s ALA 1038CO 0.01 -0.47 -0.22 0.95 0.00 0.00 0.00 175.76 176.03 2c3p s THR 1039N -2.28 2.54 0.09 0.00 -4.23 -0.88 -1.28 115.64 109.59 2c3p s THR 1039Ca -0.06 -1.53 -0.03 0.00 -1.18 0.00 0.00 61.69 58.89 2c3p s THR 1039Cb -0.01 -2.12 -0.03 0.00 1.34 0.00 0.00 72.50 71.68 2c3p s THR 1039CO -0.01 0.17 0.05 0.68 -0.54 0.00 0.00 174.62 174.97 2c3p s VAL 1040N -1.04 0.16 -0.29 2.29 -7.23 -0.59 -4.00 120.40 109.70 2c3p s VAL 1040Ca 0.15 -1.72 0.03 0.00 -1.81 0.00 0.00 61.98 58.63 2c3p s VAL 1040Cb -0.10 -1.68 0.18 0.00 0.56 0.00 0.00 36.38 35.34 2c3p s VAL 1040CO 0.07 -0.74 0.52 -0.55 -0.31 0.00 0.00 175.10 174.09 2c3p s SER 1041N -2.95 -0.83 0.17 4.85 0.15 -1.26 -2.14 113.70 111.69 2c3p s SER 1041Ca 0.13 0.14 -0.18 0.00 0.70 0.00 0.00 55.95 56.73 2c3p s SER 1041Cb 0.07 1.70 0.11 0.00 -1.71 0.00 0.00 66.02 66.19 2c3p s SER 1041CO -0.06 -0.31 1.64 -0.03 1.20 0.00 0.00 173.24 175.68 2c3p h MET 1042N 8.06 -0.08 -0.09 5.44 4.05 -1.86 -1.00 114.93 129.46 2c3p h MET 1042Ca -0.08 0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.37 2c3p h MET 1042Cb 1.16 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.98 2c3p h MET 1042CO 0.21 -0.06 0.15 0.78 0.23 0.00 0.00 176.91 178.22 2c3p h GLY 1043N -0.09 0.00 0.36 1.39 0.00 -1.85 -2.63 103.07 100.26 2c3p h GLY 1043Ca 0.20 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.30 2c3p h GLY 1043CO -0.47 0.00 -1.24 -1.82 0.00 0.00 0.00 176.54 173.01 2c3p h TYR 1044N 0.00 0.28 -1.21 5.60 3.20 -1.36 -3.35 116.97 120.13 2c3p h TYR 1044Ca 0.04 -0.21 0.03 0.00 3.14 0.00 0.00 58.73 61.73 2c3p h TYR 1044Cb 0.33 -0.01 -0.23 0.00 1.54 0.00 0.00 36.73 38.36 2c3p h TYR 1044CO 0.00 1.48 -0.33 0.45 -1.64 0.00 0.00 178.16 178.13 2c3p s SER 1045N -6.89 -1.02 0.20 -2.11 0.15 -0.89 -5.00 113.70 98.13 2c3p s SER 1045Ca -0.22 0.68 -0.04 0.00 0.70 0.00 0.00 55.95 57.07 2c3p s SER 1045Cb 0.04 1.92 0.13 0.00 -1.71 0.00 0.00 66.02 66.40 2c3p s SER 1045CO 0.71 -0.27 1.54 0.11 1.20 0.00 0.00 173.24 176.54 2c3p h LYS 1046N 8.04 0.66 -0.32 5.44 1.57 -1.82 -2.56 116.57 127.58 2c3p h LYS 1046Ca -0.21 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.20 2c3p h LYS 1046Cb 1.16 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 2c3p h LYS 1046CO 0.26 0.96 0.14 1.96 -0.57 0.00 0.00 179.45 182.20 2c3p h GLN 1047N 0.53 0.47 -0.42 3.15 4.20 -1.94 -0.57 115.11 120.54 2c3p h GLN 1047Ca 0.04 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 2c3p h GLN 1047Cb 0.96 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.64 2c3p h GLN 1047CO 0.09 0.46 0.15 0.37 -0.67 0.00 0.00 178.83 179.23 2c3p h GLN 1048N 0.38 0.60 -0.05 1.46 -0.00 -1.95 0.13 115.11 115.67 2c3p h GLN 1048Ca 0.11 -0.08 -0.00 0.00 -0.00 0.00 0.00 58.65 58.67 2c3p h GLN 1048Cb 0.16 -0.11 -0.00 0.00 0.00 0.00 0.00 27.48 27.53 2c3p h GLN 1048CO -0.01 0.51 0.01 0.35 0.00 0.00 0.00 178.83 179.69 2c3p h PHE 1049N 0.59 0.08 -0.83 3.99 3.57 -1.00 0.26 116.94 123.61 2c3p h PHE 1049Ca 0.14 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 2c3p h PHE 1049Cb 0.15 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 2c3p h PHE 1049CO 0.01 0.26 0.38 -0.07 -2.23 0.00 0.00 178.31 176.66 2c3p h LEU 1050N -0.12 1.09 -0.60 0.59 3.38 -0.62 -0.25 115.31 118.78 2c3p h LEU 1050Ca 0.02 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2c3p h LEU 1050Cb 0.22 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2c3p h LEU 1050CO -0.00 0.93 0.27 0.50 0.09 0.00 0.00 178.44 180.24 2c3p h LYS 1051N 1.18 0.88 -0.38 1.13 3.64 -0.47 -1.50 116.57 121.05 2c3p h LYS 1051Ca 0.28 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2c3p h LYS 1051Cb 0.14 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2c3p h LYS 1051CO -0.03 0.72 0.17 0.28 -2.27 0.00 0.00 179.45 178.32 2c3p h VAL 1052N 0.83 1.18 -0.14 2.00 2.07 -0.45 -0.92 116.25 120.83 2c3p h VAL 1052Ca 0.21 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 67.22 2c3p h VAL 1052Cb 0.15 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2c3p h VAL 1052CO -0.02 0.20 -0.06 -0.07 0.02 0.00 0.00 177.57 177.64 2c3p h LEU 1053N 0.48 -0.20 -0.69 2.57 3.38 -0.68 0.24 115.31 120.41 2c3p h LEU 1053Ca 0.13 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2c3p h LEU 1053Cb 0.15 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 2c3p h LEU 1053CO -0.01 -0.08 0.39 0.11 0.09 0.00 0.00 178.44 178.94 2c3p h LYS 1054N -0.04 0.96 -0.29 1.13 1.79 -1.13 -1.53 116.57 117.46 2c3p h LYS 1054Ca 0.07 -0.11 -0.16 0.00 -2.18 0.00 0.00 60.65 58.27 2c3p h LYS 1054Cb 0.15 -0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 30.61 2c3p h LYS 1054CO -0.16 0.71 -0.46 0.93 -1.08 0.00 0.00 179.45 179.38 2c3p h GLU 1055N 0.95 0.82 -0.09 3.15 5.08 -0.85 -2.16 114.58 121.48 2c3p h GLU 1055Ca 0.24 -0.50 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2c3p h GLU 1055Cb 0.02 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2c3p h GLU 1055CO -0.04 1.13 0.01 0.00 -1.00 0.00 0.00 179.01 179.11 2c3p h ALA 1056N 0.68 0.12 -0.54 3.43 0.00 -0.42 -2.08 119.26 120.46 2c3p h ALA 1056Ca 0.02 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2c3p h ALA 1056Cb 1.06 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2c3p h ALA 1056CO 0.11 -0.21 0.07 1.49 0.00 0.00 0.00 179.25 180.70 2c3p h GLU 1057N -0.10 0.86 0.00 0.00 4.22 -1.35 -2.70 114.58 115.51 2c3p h GLU 1057Ca 0.03 -0.21 0.00 0.00 0.08 0.00 0.00 59.36 59.26 2c3p h GLU 1057Cb 0.32 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2c3p h GLU 1057CO 0.00 0.81 0.00 -1.13 -2.18 0.00 0.00 179.01 176.52 2c3p n SER 1058N -4.24 0.36 -4.70 1.04 3.41 -0.81 -4.79 113.62 103.89 2c3p n SER 1058Ca 0.03 0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 58.76 2c3p n SER 1058Cb 0.27 -0.63 -0.03 0.00 -0.26 0.00 0.00 64.21 63.56 2c3p n SER 1058CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2c3p s PHE 1059N -3.04 2.88 -1.29 7.33 5.36 -0.79 -4.89 117.98 123.54 2c3p s PHE 1059Ca 0.13 0.67 -0.09 0.00 -0.96 0.00 0.00 56.93 56.67 2c3p s PHE 1059Cb 0.16 -3.81 0.16 0.00 -0.34 0.00 0.00 43.02 39.18 2c3p s PHE 1059CO 0.56 -3.06 1.95 -0.35 -1.46 0.00 0.00 175.22 172.86 2c3p n PRO 1060N 4.73 3.71 -0.59 10.12 -0.04 -1.26 -4.77 135.00 146.90 2c3p n PRO 1060Ca 0.14 -3.48 0.00 0.00 -0.04 0.00 0.00 63.50 60.11 2c3p n PRO 1060Cb 0.41 -2.90 0.00 0.00 -0.04 0.00 0.00 33.50 30.97 2c3p n PRO 1060CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2c3p n GLY 1061N 2.71 0.67 3.76 0.55 0.00 -1.26 -4.84 105.19 106.78 2c3p n GLY 1061Ca 0.43 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 2c3p n GLY 1061CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2c3p s PRO 1062N 0.10 4.73 -0.02 1.61 0.02 -0.50 -3.38 135.00 137.57 2c3p s PRO 1062Ca 0.00 1.39 0.03 0.00 0.02 0.00 0.00 61.00 62.45 2c3p s PRO 1062Cb 0.00 -3.12 -0.00 0.00 0.02 0.00 0.00 34.50 31.40 2c3p s PRO 1062CO 0.00 0.45 -0.12 -1.12 -0.33 0.00 0.00 177.00 175.88 2c3p s SER 1063N -1.32 1.48 -0.13 2.53 0.01 -0.43 -0.98 113.70 114.85 2c3p s SER 1063Ca 0.43 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.46 2c3p s SER 1063Cb -0.23 -0.32 0.02 0.00 0.21 0.00 0.00 66.02 65.70 2c3p s SER 1063CO 0.29 0.11 -0.13 -0.22 0.41 0.00 0.00 173.24 173.70 2c3p s LEU 1064N 0.00 1.56 -0.18 2.44 2.96 0.31 0.74 118.68 126.51 2c3p s LEU 1064Ca -0.01 -0.43 0.01 0.00 -0.22 0.00 0.00 54.13 53.48 2c3p s LEU 1064Cb -0.08 -1.08 0.03 0.00 0.50 0.00 0.00 46.19 45.55 2c3p s LEU 1064CO 0.00 -0.06 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.12 2c3p s VAL 1065N 1.48 1.82 -0.27 1.68 1.01 0.52 -1.33 120.40 125.30 2c3p s VAL 1065Ca 0.04 -0.88 -0.07 0.00 0.00 0.00 0.00 61.98 61.06 2c3p s VAL 1065Cb -0.13 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 2c3p s VAL 1065CO -0.09 0.41 0.08 -0.63 0.00 0.00 0.00 175.10 174.87 2c3p s ILE 1066N 1.37 4.20 -0.09 2.22 1.01 -0.41 -0.43 121.20 129.07 2c3p s ILE 1066Ca 0.03 -0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.29 2c3p s ILE 1066Cb -0.14 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 2c3p s ILE 1066CO -0.11 0.23 0.00 0.00 0.00 0.00 0.00 174.94 175.07 2c3p s ALA 1067N 1.57 3.28 -0.30 9.38 0.00 0.26 -1.54 121.76 134.41 2c3p s ALA 1067Ca 0.05 -0.80 -0.29 0.00 0.00 0.00 0.00 51.96 50.92 2c3p s ALA 1067Cb -0.16 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.47 2c3p s ALA 1067CO 0.03 0.57 1.30 -0.47 0.00 0.00 0.00 175.76 177.19 2c3p s TYR 1068N -0.82 2.68 -0.20 0.00 5.04 -0.91 -1.15 117.35 121.99 2c3p s TYR 1068Ca 0.12 0.86 -0.02 0.00 -2.44 0.00 0.00 57.07 55.60 2c3p s TYR 1068Cb -0.11 -3.92 -0.00 0.00 0.35 0.00 0.00 41.96 38.27 2c3p s TYR 1068CO 0.02 -1.72 -0.09 0.00 -1.34 0.00 0.00 175.55 172.42 2c3p s ALA 1069N 4.40 2.68 0.65 3.97 0.00 -0.04 -4.76 121.76 128.65 2c3p s ALA 1069Ca 0.56 -1.14 -0.13 0.00 0.00 0.00 0.00 51.96 51.26 2c3p s ALA 1069Cb -0.17 -1.51 -0.01 0.00 0.00 0.00 0.00 23.12 21.43 2c3p s ALA 1069CO 0.23 -0.31 1.06 0.95 0.00 0.00 0.00 175.76 177.70 2c3p s THR 1070N 1.26 3.92 -0.12 0.00 -4.23 -1.26 -4.15 115.64 111.06 2c3p s THR 1070Ca 0.03 0.74 -0.26 0.00 -1.18 0.00 0.00 61.69 61.03 2c3p s THR 1070Cb -0.14 -3.38 0.06 0.00 1.34 0.00 0.00 72.50 70.38 2c3p s THR 1070CO -0.04 -0.70 0.63 0.00 -0.54 0.00 0.00 174.62 173.96 2c3p h ILE 1072N 3.55 0.54 0.00 0.00 3.07 -1.94 0.90 117.51 123.63 2c3p h ILE 1072Ca -0.28 -0.01 -0.01 0.00 1.55 0.00 0.00 64.86 66.11 2c3p h ILE 1072Cb 1.15 0.50 -0.00 0.00 -0.27 0.00 0.00 36.82 38.20 2c3p h ILE 1072CO 0.27 0.01 -0.05 0.78 -1.05 0.00 0.00 178.15 178.11 2c3p h ASN 1073N 0.04 0.00 1.42 2.16 -0.26 -1.96 -1.08 115.58 115.90 2c3p h ASN 1073Ca 0.45 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.19 2c3p h ASN 1073Cb 1.73 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.99 2c3p h ASN 1073CO -0.03 0.05 0.00 0.00 -1.06 0.00 0.00 177.43 176.40 2c3p n GLN 1074N -3.55 0.26 -3.13 0.81 6.02 0.31 -4.66 117.38 113.44 2c3p n GLN 1074Ca -0.02 0.23 -0.10 0.00 -0.01 0.00 0.00 57.00 57.09 2c3p n GLN 1074Cb 0.17 -1.81 0.05 0.00 1.02 0.00 0.00 30.24 29.66 2c3p n GLN 1074CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2c3p n GLY 1075N 1.21 -1.12 3.65 1.08 0.00 -0.41 -2.31 105.19 107.29 2c3p n GLY 1075Ca 0.05 0.52 -0.42 0.00 0.00 0.00 0.00 46.02 46.17 2c3p n GLY 1075CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c3p s LEU 1076N -4.92 4.13 0.34 0.99 1.43 -1.26 0.01 118.68 119.40 2c3p s LEU 1076Ca 0.32 2.12 0.10 0.00 -1.03 0.00 0.00 54.13 55.64 2c3p s LEU 1076Cb -0.04 -3.53 0.87 0.00 0.03 0.00 0.00 46.19 43.52 2c3p s LEU 1076CO 0.71 -1.15 1.78 0.03 0.23 0.00 0.00 176.35 177.95 2c3p h ARG 1077N 10.67 0.61 -0.56 1.70 2.47 -1.52 -2.47 114.38 125.28 2c3p h ARG 1077Ca -0.40 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.28 2c3p h ARG 1077Cb 1.19 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 2c3p h ARG 1077CO 0.97 0.40 0.00 1.63 0.56 0.00 0.00 179.97 183.53 2c3p n LYS 1078N -4.72 3.46 0.00 0.04 5.02 -1.26 -5.06 118.16 115.63 2c3p n LYS 1078Ca 0.24 -2.75 0.00 0.00 -2.02 0.00 0.00 58.31 53.78 2c3p n LYS 1078Cb 0.67 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 2c3p n LYS 1078CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c3p n GLY 1079N 0.84 2.45 0.12 0.72 0.00 -0.93 -4.72 105.19 103.67 2c3p n GLY 1079Ca 0.23 -1.92 0.12 0.00 0.00 0.00 0.00 46.02 44.45 2c3p n GLY 1079CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c3p n MET 1080N 1.30 0.20 0.00 1.61 2.81 -1.26 -2.50 117.12 119.28 2c3p n MET 1080Ca 0.00 0.37 0.06 0.00 -1.81 0.00 0.00 57.70 56.32 2c3p n MET 1080Cb 0.00 -1.84 0.35 0.00 -0.71 0.00 0.00 33.22 31.03 2c3p n MET 1080CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c3p n GLY 1081N 0.30 -0.42 0.88 3.03 0.00 -1.19 -1.27 105.19 106.52 2c3p n GLY 1081Ca 0.03 -0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.05 2c3p n GLY 1081CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2c3p n LYS 1082N -1.03 2.94 0.01 1.61 4.76 -1.04 -3.65 118.16 121.75 2c3p n LYS 1082Ca 0.09 -2.32 -0.10 0.00 -2.87 0.00 0.00 58.31 53.11 2c3p n LYS 1082Cb 0.05 -1.44 -0.03 0.00 -1.84 0.00 0.00 35.03 31.76 2c3p n LYS 1082CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 2c3p h SER 1083N 2.57 -0.45 -0.39 4.39 0.02 -1.40 0.33 113.55 118.62 2c3p h SER 1083Ca 0.00 0.08 0.07 0.00 -0.84 0.00 0.00 61.79 61.11 2c3p h SER 1083Cb 0.92 0.21 -0.07 0.00 0.14 0.00 0.00 62.40 63.61 2c3p h SER 1083CO 0.05 -0.19 -0.02 1.56 -1.14 0.00 0.00 176.83 177.08 2c3p h GLN 1084N -0.19 0.08 -0.68 3.45 1.08 -1.83 0.48 115.11 117.50 2c3p h GLN 1084Ca 0.08 -0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.24 2c3p h GLN 1084Cb 0.31 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.70 2c3p h GLN 1084CO -0.22 0.05 0.26 0.22 -0.95 0.00 0.00 178.83 178.19 2c3p h ASP 1085N 0.08 0.93 -0.63 1.46 3.58 -1.71 0.37 116.42 120.49 2c3p h ASP 1085Ca 0.19 -0.14 -0.09 0.00 0.42 0.00 0.00 57.03 57.41 2c3p h ASP 1085Cb 0.28 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.07 2c3p h ASP 1085CO -0.34 0.84 0.03 0.58 -2.88 0.00 0.00 179.24 177.47 2c3p h VAL 1086N 0.98 1.27 -0.64 2.25 2.07 0.80 -0.17 116.25 122.81 2c3p h VAL 1086Ca 0.23 -1.13 -0.04 0.00 0.82 0.00 0.00 66.70 66.58 2c3p h VAL 1086Cb 0.21 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2c3p h VAL 1086CO -0.02 0.41 0.22 0.24 0.02 0.00 0.00 177.57 178.44 2c3p h MET 1087N 1.00 0.95 0.36 1.57 2.86 0.45 0.18 114.93 122.30 2c3p h MET 1087Ca 0.18 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 2c3p h MET 1087Cb 0.53 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.04 2c3p h MET 1087CO 0.03 0.81 -0.17 -0.97 1.06 0.00 0.00 176.91 177.66 2c3p h ASN 1088N 0.93 -0.41 -0.64 1.22 -0.00 -0.34 -2.96 115.58 113.38 2c3p h ASN 1088Ca 0.21 -0.02 -0.02 0.00 -0.00 0.00 0.00 56.30 56.47 2c3p h ASN 1088Cb 0.24 0.11 -0.03 0.00 -0.00 0.00 0.00 38.32 38.63 2c3p h ASN 1088CO -0.01 -0.24 0.32 0.74 -0.00 0.00 0.00 177.43 178.23 2c3p h THR 1089N -0.54 1.22 -0.97 -3.57 2.02 -0.80 -1.35 112.91 108.92 2c3p h THR 1089Ca -0.05 -0.61 0.16 0.00 0.77 0.00 0.00 66.41 66.68 2c3p h THR 1089Cb 0.40 0.37 -0.09 0.00 -1.74 0.00 0.00 68.15 67.09 2c3p h THR 1089CO 0.08 0.26 0.61 0.00 0.37 0.00 0.00 175.52 176.84 2c3p h ALA 1090N 1.40 1.73 0.08 6.16 0.00 -0.50 0.13 119.26 128.26 2c3p h ALA 1090Ca 0.23 0.04 -0.17 0.00 0.00 0.00 0.00 54.91 55.01 2c3p h ALA 1090Cb 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2c3p h ALA 1090CO -0.03 -0.03 -0.83 0.28 0.00 0.00 0.00 179.25 178.64 2c3p h VAL 1091N 0.77 1.37 -0.89 0.00 2.07 -1.29 0.31 116.25 118.59 2c3p h VAL 1091Ca 0.52 -2.40 0.04 0.00 0.82 0.00 0.00 66.70 65.68 2c3p h VAL 1091Cb 0.78 2.98 -0.05 0.00 -1.52 0.00 0.00 31.29 33.47 2c3p h VAL 1091CO -0.28 0.63 0.58 0.11 0.02 0.00 0.00 177.57 178.62 2c3p h LYS 1092N -0.61 1.05 0.00 1.57 1.57 -0.72 -0.46 116.57 118.97 2c3p h LYS 1092Ca -0.18 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2c3p h LYS 1092Cb 1.46 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2c3p h LYS 1092CO 0.03 0.70 0.00 0.66 -0.57 0.00 0.00 179.45 180.27 2c3p h SER 1093N 1.09 0.00 0.00 0.86 4.64 -0.91 -2.41 113.55 116.81 2c3p h SER 1093Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2c3p h SER 1093Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2c3p h SER 1093CO -0.11 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.46 2c3p n GLY 1094N -0.21 0.75 0.26 -0.77 0.00 -0.18 -4.15 105.19 100.89 2c3p n GLY 1094Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 2c3p n GLY 1094CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2c3p h TYR 1095N 0.00 1.03 -2.58 1.61 3.20 -1.60 -3.36 116.97 115.28 2c3p h TYR 1095Ca 0.00 -0.25 -0.60 0.00 3.14 0.00 0.00 58.73 61.02 2c3p h TYR 1095Cb 0.00 -0.24 -0.41 0.00 1.54 0.00 0.00 36.73 37.62 2c3p h TYR 1095CO 0.00 1.04 -0.73 1.87 -1.64 0.00 0.00 178.16 178.70 2c3p n TRP 1096N -4.19 1.99 -2.08 -3.82 -0.00 0.10 -5.00 117.44 104.44 2c3p n TRP 1096Ca -0.01 -3.96 -0.39 0.00 -0.00 0.00 0.00 57.50 53.14 2c3p n TRP 1096Cb 0.44 -0.38 -0.00 0.00 -0.00 0.00 0.00 31.31 31.36 2c3p n TRP 1096CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2c3p s PRO 1097N -1.35 3.80 -0.11 5.87 0.04 -1.26 -4.18 135.00 137.81 2c3p s PRO 1097Ca 0.32 2.05 -0.05 0.00 0.04 0.00 0.00 61.00 63.35 2c3p s PRO 1097Cb 0.05 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 2c3p s PRO 1097CO -0.13 -0.60 0.08 -0.51 0.04 0.00 0.00 177.00 175.88 2c3p s LEU 1098N -2.75 4.02 0.34 -3.56 1.43 -1.26 -4.85 118.68 112.05 2c3p s LEU 1098Ca 0.61 0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 53.85 2c3p s LEU 1098Cb -0.35 -1.96 0.04 0.00 0.03 0.00 0.00 46.19 43.94 2c3p s LEU 1098CO 0.44 0.38 0.74 0.72 0.23 0.00 0.00 176.35 178.86 2c3p s PHE 1099N -0.86 0.05 -0.09 0.29 -0.12 -1.26 0.51 117.98 116.51 2c3p s PHE 1099Ca 0.13 -0.62 -0.06 0.00 -0.05 0.00 0.00 56.93 56.33 2c3p s PHE 1099Cb -0.12 0.73 0.03 0.00 -0.63 0.00 0.00 43.02 43.03 2c3p s PHE 1099CO 0.03 -1.41 0.22 1.03 -0.05 0.00 0.00 175.22 175.05 2c3p s ARG 1100N -3.01 0.22 -0.30 1.99 0.52 -0.30 -2.08 118.95 115.99 2c3p s ARG 1100Ca 0.15 0.42 -0.00 0.00 -0.52 0.00 0.00 55.73 55.77 2c3p s ARG 1100Cb -0.05 -0.02 0.06 0.00 0.52 0.00 0.00 34.95 35.46 2c3p s ARG 1100CO 0.10 -0.11 -0.02 -0.47 0.02 0.00 0.00 175.30 174.83 2c3p s TYR 1101N 0.76 3.32 -0.34 -0.53 5.04 0.34 -0.46 117.35 125.48 2c3p s TYR 1101Ca -0.05 -2.12 -0.01 0.00 -2.44 0.00 0.00 57.07 52.45 2c3p s TYR 1101Cb -0.07 -2.19 0.08 0.00 0.35 0.00 0.00 41.96 40.13 2c3p s TYR 1101CO -0.04 -0.85 0.07 0.34 -1.34 0.00 0.00 175.55 173.73 2c3p s ASP 1102N 1.23 4.97 0.61 4.32 -1.08 0.50 -1.56 116.67 125.65 2c3p s ASP 1102Ca -0.04 -1.67 0.31 0.00 -0.52 0.00 0.00 52.55 50.62 2c3p s ASP 1102Cb -0.20 -1.73 1.74 0.00 -1.46 0.00 0.00 42.92 41.27 2c3p s ASP 1102CO -0.03 -0.37 2.11 -0.65 0.52 0.00 0.00 175.17 176.76 2c3p h PRO 1103N 7.94 0.00 0.00 4.34 0.11 -1.84 -2.41 132.00 140.15 2c3p h PRO 1103Ca -0.16 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.90 2c3p h PRO 1103Cb 1.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2c3p h PRO 1103CO 0.58 0.00 -0.24 0.07 -0.21 0.00 0.00 178.00 178.20 2c3p h ARG 1104N 0.00 0.00 -0.67 1.05 0.11 -1.94 -2.53 114.38 110.40 2c3p h ARG 1104Ca 0.07 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 60.08 2c3p h ARG 1104Cb 0.45 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.50 2c3p h ARG 1104CO -0.00 0.24 0.16 -0.07 0.10 0.00 0.00 179.97 180.40 2c3p h LEU 1105N 0.00 1.02 -1.14 0.08 3.38 -1.71 -2.24 115.31 114.70 2c3p h LEU 1105Ca -0.00 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 2c3p h LEU 1105Cb 0.89 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 2c3p h LEU 1105CO 0.03 0.99 -0.06 0.00 0.09 0.00 0.00 178.44 179.49 2c3p h ALA 1106N 1.07 1.29 0.00 1.53 0.00 -1.08 0.29 119.26 122.36 2c3p h ALA 1106Ca 0.21 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2c3p h ALA 1106Cb 0.36 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2c3p h ALA 1106CO 0.00 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.73 2c3p n ALA 1107N -2.48 1.34 -1.69 0.00 0.00 -0.87 -1.48 120.51 115.33 2c3p n ALA 1107Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2c3p n ALA 1107Cb 0.28 -1.36 0.17 0.00 0.00 0.00 0.00 19.45 18.55 2c3p n ALA 1107CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c3p n GLN 1108N -2.28 1.95 0.00 0.00 10.64 -0.09 -4.97 117.38 122.62 2c3p n GLN 1108Ca 0.00 -3.46 0.00 0.00 -1.83 0.00 0.00 57.00 51.72 2c3p n GLN 1108Cb 0.13 -1.72 0.00 0.00 -0.86 0.00 0.00 30.24 27.79 2c3p n GLN 1108CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2c3p n GLY 1109N -1.03 2.41 3.91 2.61 0.00 -0.55 -5.01 105.19 107.53 2c3p n GLY 1109Ca 0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.98 2c3p n GLY 1109CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c3p s LYS 1110N 0.00 3.59 -0.04 1.61 1.02 -0.14 -4.91 119.74 120.88 2c3p s LYS 1110Ca 0.00 0.11 -0.30 0.00 0.02 0.00 0.00 55.97 55.80 2c3p s LYS 1110Cb 0.00 -2.48 -0.06 0.00 -0.52 0.00 0.00 37.83 34.77 2c3p s LYS 1110CO 0.00 -0.03 1.72 1.21 -0.92 0.00 0.00 175.35 177.33 2c3p s ASN 1111N -3.76 6.62 0.50 2.83 3.84 -1.26 -2.10 114.94 121.61 2c3p s ASN 1111Ca 0.46 2.32 0.20 0.00 0.21 0.00 0.00 52.86 56.05 2c3p s ASN 1111Cb -0.10 -2.53 1.28 0.00 -0.55 0.00 0.00 41.25 39.34 2c3p s ASN 1111CO 0.38 -0.95 2.08 1.55 -2.79 0.00 0.00 177.10 177.37 2c3p h PRO 1112N 9.76 0.00 -5.99 0.43 0.13 -1.88 -3.43 132.00 131.02 2c3p h PRO 1112Ca -0.41 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.15 2c3p h PRO 1112Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 2c3p h PRO 1112CO 0.95 0.10 0.15 0.12 -0.23 0.00 0.00 178.00 179.10 2c3p s PHE 1113N -4.64 3.53 -0.03 1.56 5.36 -1.26 -0.37 117.98 122.13 2c3p s PHE 1113Ca -0.04 1.23 0.01 0.00 -0.96 0.00 0.00 56.93 57.17 2c3p s PHE 1113Cb 0.15 -2.85 0.02 0.00 -0.34 0.00 0.00 43.02 40.01 2c3p s PHE 1113CO 0.65 -0.00 -0.02 -0.65 -1.46 0.00 0.00 175.22 173.74 2c3p s GLN 1114N 1.16 0.51 0.18 10.12 -0.21 0.39 -4.57 119.66 127.24 2c3p s GLN 1114Ca 0.37 -0.01 -0.27 0.00 0.02 0.00 0.00 55.36 55.47 2c3p s GLN 1114Cb -0.17 -0.61 -0.08 0.00 1.00 0.00 0.00 33.01 33.14 2c3p s GLN 1114CO 0.17 -0.10 0.84 -0.51 -2.12 0.00 0.00 175.29 173.57 2c3p s LEU 1115N 0.92 4.60 0.00 2.90 1.43 -1.26 -1.16 118.68 126.11 2c3p s LEU 1115Ca -0.10 1.74 0.06 0.00 -1.03 0.00 0.00 54.13 54.80 2c3p s LEU 1115Cb -0.14 -3.41 0.05 0.00 0.03 0.00 0.00 46.19 42.72 2c3p s LEU 1115CO -0.01 0.16 0.69 0.47 0.23 0.00 0.00 176.35 177.89 2c3p n ASP 1116N 1.74 1.50 -4.37 2.29 8.00 0.18 -4.93 116.55 120.97 2c3p n ASP 1116Ca -0.04 -1.25 -0.18 0.00 0.71 0.00 0.00 54.79 54.03 2c3p n ASP 1116Cb 0.48 -0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.48 2c3p n ASP 1116CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2c3p s SER 1117N -0.50 1.67 0.34 -2.24 1.04 -1.15 -4.86 113.70 108.01 2c3p s SER 1117Ca 0.07 -1.37 0.07 0.00 0.48 0.00 0.00 55.95 55.19 2c3p s SER 1117Cb 0.05 0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.22 2c3p s SER 1117CO 0.07 -0.67 0.48 -0.54 0.98 0.00 0.00 173.24 173.56 2c3p s LYS 1118N -3.97 3.08 0.69 4.02 1.02 -1.26 -4.90 119.74 118.42 2c3p s LYS 1118Ca 0.37 -1.04 -0.16 0.00 0.02 0.00 0.00 55.97 55.15 2c3p s LYS 1118Cb 0.08 -2.81 -0.03 0.00 -0.52 0.00 0.00 37.83 34.55 2c3p s LYS 1118CO 0.14 0.03 0.73 0.00 -0.92 0.00 0.00 175.35 175.33 2c3p n ALA 1119N -1.66 -0.84 -1.58 5.17 0.00 -1.26 -4.75 120.51 115.58 2c3p n ALA 1119Ca 0.01 -0.17 -0.51 0.00 0.00 0.00 0.00 53.44 52.77 2c3p n ALA 1119Cb 0.58 -1.97 -0.05 0.00 0.00 0.00 0.00 19.45 18.01 2c3p n ALA 1119CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2c3p n PRO 1120N -1.08 1.12 -0.31 0.00 -0.02 -1.26 -4.81 135.00 128.64 2c3p n PRO 1120Ca 0.12 0.40 0.07 0.00 -2.02 0.00 0.00 63.50 62.07 2c3p n PRO 1120Cb 0.49 -1.98 0.22 0.00 -0.02 0.00 0.00 33.50 32.21 2c3p n PRO 1120CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2c3p n ASP 1121N 2.30 2.88 0.00 2.55 5.68 -0.91 -4.93 116.55 124.13 2c3p n ASP 1121Ca 0.17 -2.12 0.00 0.00 -0.50 0.00 0.00 54.79 52.34 2c3p n ASP 1121Cb 0.21 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 39.81 2c3p n ASP 1121CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2c3p n GLY 1122N 1.11 0.70 1.01 6.12 0.00 -1.26 -4.93 105.19 107.93 2c3p n GLY 1122Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 2c3p n GLY 1122CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2c3p n SER 1123N 0.00 2.97 -0.29 1.61 3.41 -1.26 -4.54 113.62 115.51 2c3p n SER 1123Ca 0.00 -1.94 0.05 0.00 -0.26 0.00 0.00 58.87 56.72 2c3p n SER 1123Cb 0.00 -0.28 0.19 0.00 -0.26 0.00 0.00 64.21 63.86 2c3p n SER 1123CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 2c3p h VAL 1124N 3.58 0.82 -0.35 -3.33 3.04 -1.92 -1.85 116.25 116.24 2c3p h VAL 1124Ca 0.00 -0.24 0.05 0.00 -1.01 0.00 0.00 66.70 65.50 2c3p h VAL 1124Cb 0.80 0.06 -0.04 0.00 -2.01 0.00 0.00 31.29 30.09 2c3p h VAL 1124CO 0.00 0.13 0.08 -0.08 -1.01 0.00 0.00 177.57 176.69 2c3p h GLU 1125N 0.70 0.20 0.00 4.17 4.57 -1.95 0.17 114.58 122.45 2c3p h GLU 1125Ca 0.43 -0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.51 2c3p h GLU 1125Cb 0.50 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 2c3p h GLU 1125CO -0.30 0.13 -0.40 1.05 -1.18 0.00 0.00 179.01 178.31 2c3p h GLU 1126N 0.21 0.00 -0.00 1.92 9.09 -1.79 -0.90 114.58 123.11 2c3p h GLU 1126Ca 0.16 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.57 2c3p h GLU 1126Cb 0.17 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.27 2c3p h GLU 1126CO -0.20 0.40 0.00 0.35 0.05 0.00 0.00 179.01 179.61 2c3p h PHE 1127N 0.00 0.00 0.14 2.06 3.57 -0.35 -2.08 116.94 120.28 2c3p h PHE 1127Ca -0.00 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2c3p h PHE 1127Cb 0.79 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.53 2c3p h PHE 1127CO 0.00 0.13 -0.07 -0.07 -2.23 0.00 0.00 178.31 176.07 2c3p h LEU 1128N -0.13 -0.16 -1.54 0.59 3.38 -0.56 -3.10 115.31 113.79 2c3p h LEU 1128Ca 0.00 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2c3p h LEU 1128Cb 0.13 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2c3p h LEU 1128CO -0.00 0.18 0.03 0.24 0.09 0.00 0.00 178.44 178.98 2c3p h MET 1129N -0.52 0.00 -0.16 1.13 2.86 -1.17 -0.18 114.93 116.89 2c3p h MET 1129Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2c3p h MET 1129Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.07 2c3p h MET 1129CO 0.03 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.00 2c3p n ALA 1130N -1.79 2.53 -3.36 6.32 0.00 -0.79 -4.63 120.51 118.79 2c3p n ALA 1130Ca -0.02 -0.46 -0.27 0.00 0.00 0.00 0.00 53.44 52.70 2c3p n ALA 1130Cb 0.06 -1.11 -0.17 0.00 0.00 0.00 0.00 19.45 18.24 2c3p n ALA 1130CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2c3p s GLN 1131N -1.80 2.05 0.38 0.00 -0.21 -0.08 -1.25 119.66 118.75 2c3p s GLN 1131Ca 0.30 -0.55 0.04 0.00 0.02 0.00 0.00 55.36 55.18 2c3p s GLN 1131Cb 0.16 -1.64 0.74 0.00 1.00 0.00 0.00 33.01 33.26 2c3p s GLN 1131CO 0.24 0.08 2.03 -0.97 -2.12 0.00 0.00 175.29 174.55 2c3p h ASN 1132N 6.85 0.61 0.00 5.90 -1.24 -0.17 0.79 115.58 128.33 2c3p h ASN 1132Ca -0.28 -0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.72 2c3p h ASN 1132Cb 1.20 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 40.10 2c3p h ASN 1132CO 0.47 0.44 0.15 -2.11 -1.29 0.00 0.00 177.43 175.10 2c3p n ARG 1133N -4.46 0.10 -0.04 6.67 1.85 -0.98 -0.70 116.66 119.11 2c3p n ARG 1133Ca 0.05 0.57 -0.06 0.00 -1.00 0.00 0.00 57.85 57.41 2c3p n ARG 1133Cb 0.05 -1.97 -0.03 0.00 -1.05 0.00 0.00 32.46 29.45 2c3p n ARG 1133CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2c3p n PHE 1134N -2.04 0.00 -0.32 2.89 3.01 -0.39 0.17 117.46 120.78 2c3p n PHE 1134Ca -0.01 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.43 2c3p n PHE 1134Cb 0.18 -0.28 0.14 0.00 -0.01 0.00 0.00 39.48 39.51 2c3p n PHE 1134CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2c3p h ALA 1135N -0.08 1.30 -0.84 4.37 0.00 -0.30 -2.70 119.26 121.01 2c3p h ALA 1135Ca -0.17 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.71 2c3p h ALA 1135Cb 1.23 -0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 2c3p h ALA 1135CO -0.05 0.62 0.55 -0.39 0.00 0.00 0.00 179.25 179.98 2c3p h VAL 1136N 1.23 1.07 -0.52 0.00 -1.51 -1.17 -1.05 116.25 114.30 2c3p h VAL 1136Ca 0.32 -0.33 -0.04 0.00 -1.23 0.00 0.00 66.70 65.42 2c3p h VAL 1136Cb -0.08 0.02 -0.02 0.00 -2.13 0.00 0.00 31.29 29.08 2c3p h VAL 1136CO -0.06 0.18 0.16 0.25 -1.23 0.00 0.00 177.57 176.86 2c3p h LEU 1137N 0.96 0.76 -0.85 4.19 5.85 -1.71 -0.73 115.31 123.79 2c3p h LEU 1137Ca 0.36 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.89 2c3p h LEU 1137Cb 0.17 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 2c3p h LEU 1137CO -0.12 0.77 0.56 -0.78 -0.34 0.00 0.00 178.44 178.52 2c3p h ASP 1138N 0.71 0.94 0.71 1.25 3.58 -1.08 1.04 116.42 123.57 2c3p h ASP 1138Ca 0.17 -0.01 -0.13 0.00 0.42 0.00 0.00 57.03 57.47 2c3p h ASP 1138Cb 0.29 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 2c3p h ASP 1138CO -0.00 0.66 -0.63 0.03 -2.88 0.00 0.00 179.24 176.42 2c3p h ARG 1139N 1.11 0.00 0.05 0.28 3.08 -1.12 -2.56 114.38 115.21 2c3p h ARG 1139Ca 0.33 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 60.01 2c3p h ARG 1139Cb -0.06 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.95 2c3p h ARG 1139CO -0.09 0.63 -2.21 0.43 -1.07 0.00 0.00 179.97 177.66 2c3p n SER 1140N -3.70 1.72 -3.19 7.04 7.64 -0.30 -4.67 113.62 118.16 2c3p n SER 1140Ca -0.01 0.06 -0.22 0.00 1.01 0.00 0.00 58.87 59.72 2c3p n SER 1140Cb 0.64 -0.41 -0.05 0.00 -1.01 0.00 0.00 64.21 63.39 2c3p n SER 1140CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2c3p n PHE 1141N -3.27 0.43 -0.34 1.43 3.01 0.35 -4.97 117.46 114.09 2c3p n PHE 1141Ca -0.36 -3.74 0.16 0.00 1.01 0.00 0.00 57.45 54.52 2c3p n PHE 1141Cb 1.04 -0.40 0.36 0.00 -0.01 0.00 0.00 39.48 40.47 2c3p n PHE 1141CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2c3p h PRO 1142N 3.52 0.59 0.53 -1.08 0.13 -1.47 0.40 132.00 134.61 2c3p h PRO 1142Ca 0.10 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.16 2c3p h PRO 1142Cb 0.88 -0.13 0.01 0.00 0.13 0.00 0.00 31.00 31.88 2c3p h PRO 1142CO 0.53 0.39 -0.25 1.05 -0.23 0.00 0.00 178.00 179.48 2c3p h GLU 1143N 0.60 -0.69 -0.40 0.86 9.09 -1.90 -1.17 114.58 120.98 2c3p h GLU 1143Ca 0.62 0.05 -0.15 0.00 0.05 0.00 0.00 59.36 59.93 2c3p h GLU 1143Cb 1.13 0.16 -0.01 0.00 -1.65 0.00 0.00 28.75 28.38 2c3p h GLU 1143CO -0.46 -0.42 -0.34 -0.44 0.05 0.00 0.00 179.01 177.41 2c3p h ASP 1144N -0.81 0.96 -0.68 3.06 3.32 -1.79 -2.97 116.42 117.52 2c3p h ASP 1144Ca -0.07 -0.42 0.05 0.00 0.02 0.00 0.00 57.03 56.61 2c3p h ASP 1144Cb 0.59 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.82 2c3p h ASP 1144CO 0.12 1.20 0.39 0.00 -1.72 0.00 0.00 179.24 179.23 2c3p h ALA 1145N 0.85 0.90 -0.04 3.45 0.00 -0.23 0.34 119.26 124.53 2c3p h ALA 1145Ca 0.07 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2c3p h ALA 1145Cb 0.92 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2c3p h ALA 1145CO 0.09 0.10 0.00 -0.22 0.00 0.00 0.00 179.25 179.22 2c3p h LYS 1146N 0.74 0.02 -0.32 0.00 3.64 -1.16 0.00 116.57 119.49 2c3p h LYS 1146Ca 0.29 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.73 2c3p h LYS 1146Cb 0.14 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.90 2c3p h LYS 1146CO -0.16 0.01 -0.01 0.00 -2.27 0.00 0.00 179.45 177.03 2c3p h ARG 1147N 0.02 0.08 -0.37 1.90 3.08 -1.20 -1.17 114.38 116.72 2c3p h ARG 1147Ca 0.02 -0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 2c3p h ARG 1147Cb 0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2c3p h ARG 1147CO -0.03 0.05 -0.05 -0.07 -1.07 0.00 0.00 179.97 178.80 2c3p h LEU 1148N 0.09 0.58 -0.69 3.04 3.38 -0.02 0.14 115.31 121.82 2c3p h LEU 1148Ca 0.15 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 2c3p h LEU 1148Cb 0.21 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2c3p h LEU 1148CO -0.26 0.68 -0.59 0.03 0.09 0.00 0.00 178.44 178.39 2c3p h ARG 1149N 0.56 0.20 -0.15 1.13 3.08 -0.60 -1.36 114.38 117.24 2c3p h ARG 1149Ca 0.11 -0.13 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 2c3p h ARG 1149Cb 0.44 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2c3p h ARG 1149CO 0.02 0.73 -0.52 0.00 -1.07 0.00 0.00 179.97 179.14 2c3p h ALA 1150N 1.24 0.83 -0.61 0.04 0.00 -0.65 -1.92 119.26 118.19 2c3p h ALA 1150Ca -0.01 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.32 2c3p h ALA 1150Cb 1.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2c3p h ALA 1150CO 0.09 0.68 0.03 0.37 0.00 0.00 0.00 179.25 180.41 2c3p h GLN 1151N 0.33 1.05 -0.52 0.00 4.15 -0.62 -0.68 115.11 118.81 2c3p h GLN 1151Ca 0.01 -0.31 -0.04 0.00 0.77 0.00 0.00 58.65 59.08 2c3p h GLN 1151Cb 1.02 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.58 2c3p h GLN 1151CO 0.09 1.01 0.17 0.28 -1.93 0.00 0.00 178.83 178.45 2c3p h VAL 1152N 0.97 1.23 -0.60 2.39 2.07 -1.09 0.34 116.25 121.56 2c3p h VAL 1152Ca 0.18 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.90 2c3p h VAL 1152Cb 0.52 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 2c3p h VAL 1152CO 0.03 0.28 0.18 0.00 0.02 0.00 0.00 177.57 178.07 2c3p h ALA 1153N 1.03 1.19 -0.27 1.67 0.00 -1.01 -0.77 119.26 121.09 2c3p h ALA 1153Ca 0.17 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2c3p h ALA 1153Cb 0.26 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2c3p h ALA 1153CO -0.01 0.56 -0.31 1.25 0.00 0.00 0.00 179.25 180.75 2c3p h HIS 1154N 0.88 0.84 0.36 0.00 6.17 -0.65 -1.79 115.15 120.96 2c3p h HIS 1154Ca 0.20 -0.26 -0.01 0.00 0.71 0.00 0.00 60.37 61.01 2c3p h HIS 1154Cb 0.27 -0.17 -0.01 0.00 2.52 0.00 0.00 27.41 30.02 2c3p h HIS 1154CO 0.02 1.01 -0.24 0.93 0.71 0.00 0.00 177.93 180.35 2c3p h GLU 1155N 0.42 -0.57 -0.55 5.26 5.08 0.04 -0.69 114.58 123.58 2c3p h GLU 1155Ca 0.04 0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2c3p h GLU 1155Cb 0.88 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.24 2c3p h GLU 1155CO 0.07 -0.38 0.36 1.37 -1.00 0.00 0.00 179.01 179.44 2c3p h LEU 1156N -0.59 0.62 -0.42 1.33 8.10 -1.18 0.12 115.31 123.29 2c3p h LEU 1156Ca -0.04 -0.02 -0.03 0.00 0.11 0.00 0.00 57.88 57.90 2c3p h LEU 1156Cb 0.50 -0.16 -0.02 0.00 -0.44 0.00 0.00 40.66 40.55 2c3p h LEU 1156CO 0.02 0.45 0.13 -0.78 -4.11 0.00 0.00 178.44 174.15 2c3p h ASP 1157N 0.74 0.61 0.13 0.17 3.58 -0.96 0.06 116.42 120.74 2c3p h ASP 1157Ca 0.20 -0.21 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 2c3p h ASP 1157Cb -0.08 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 40.81 2c3p h ASP 1157CO -0.04 0.66 -0.06 0.58 -2.88 0.00 0.00 179.24 177.49 2c3p h VAL 1158N 0.53 1.01 -0.52 2.25 2.07 -0.25 -2.59 116.25 118.75 2c3p h VAL 1158Ca 0.13 -0.57 0.10 0.00 0.82 0.00 0.00 66.70 67.19 2c3p h VAL 1158Cb 0.27 1.36 -0.09 0.00 -1.52 0.00 0.00 31.29 31.31 2c3p h VAL 1158CO -0.00 0.14 -0.03 -0.09 0.02 0.00 0.00 177.57 177.60 2c3p h ARG 1159N -0.43 0.08 -0.99 1.57 2.43 -0.69 -0.43 114.38 115.92 2c3p h ARG 1159Ca -0.02 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 2c3p h ARG 1159Cb 0.35 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.83 2c3p h ARG 1159CO 0.03 0.06 0.65 0.35 -1.51 0.00 0.00 179.97 179.55 2c3p h PHE 1160N 0.09 1.23 -0.18 2.20 3.57 -0.94 -0.54 116.94 122.37 2c3p h PHE 1160Ca 0.26 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.75 2c3p h PHE 1160Cb 0.40 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2c3p h PHE 1160CO -0.35 0.75 -0.09 0.87 -2.23 0.00 0.00 178.31 177.26 2c3p h LYS 1161N 1.31 0.27 -0.13 1.11 1.57 -0.73 0.16 116.57 120.12 2c3p h LYS 1161Ca 0.38 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.92 2c3p h LYS 1161Cb -0.09 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 2c3p h LYS 1161CO -0.10 0.37 -0.65 0.93 -0.57 0.00 0.00 179.45 179.44 2c3p h GLU 1162N 0.26 0.51 -0.36 3.15 5.08 0.15 -2.08 114.58 121.29 2c3p h GLU 1162Ca 0.06 -0.37 -0.13 0.00 -1.00 0.00 0.00 59.36 57.92 2c3p h GLU 1162Cb 0.33 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2c3p h GLU 1162CO 0.02 0.99 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.68 2c3p h LEU 1163N 0.37 0.85 -0.55 1.33 3.38 -0.54 -0.84 115.31 119.31 2c3p h LEU 1163Ca -0.02 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.55 2c3p h LEU 1163Cb 1.22 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.69 2c3p h LEU 1163CO 0.12 1.11 0.31 -0.33 0.09 0.00 0.00 178.44 179.74 2c3p h GLU 1164N 0.60 0.58 -0.31 1.13 5.08 -0.61 -0.28 114.58 120.77 2c3p h GLU 1164Ca 0.07 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.29 2c3p h GLU 1164Cb 0.84 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2c3p h GLU 1164CO 0.07 0.38 -0.23 1.25 -1.00 0.00 0.00 179.01 179.49 2c3p h HIS 1165N 0.60 0.67 -0.64 4.33 2.76 -1.20 -1.09 115.15 120.57 2c3p h HIS 1165Ca 0.24 -0.14 0.04 0.00 -2.20 0.00 0.00 60.37 58.30 2c3p h HIS 1165Cb 0.10 -0.16 -0.05 0.00 1.55 0.00 0.00 27.41 28.85 2c3p h HIS 1165CO -0.08 0.78 0.38 0.52 -1.30 0.00 0.00 177.93 178.23 2c3p h MET 1166N 0.53 0.71 0.00 5.26 2.86 -0.16 0.26 114.93 124.39 2c3p h MET 1166Ca 0.08 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2c3p h MET 1166Cb 0.68 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2c3p h MET 1166CO 0.05 0.47 0.00 0.00 1.06 0.00 0.00 176.91 178.49 2c3p h ALA 1167N 1.30 1.00 0.00 6.32 0.00 -0.65 -2.87 119.26 124.36 2c3p h ALA 1167Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2c3p h ALA 1167Cb 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2c3p h ALA 1167CO -0.14 0.00 -1.30 0.00 0.00 0.00 0.00 179.25 177.82 2c3p n ALA 1168N -2.07 2.51 -1.04 0.00 0.00 -0.44 -4.98 120.51 114.48 2c3p n ALA 1168Ca 0.01 -0.35 -0.35 0.00 0.00 0.00 0.00 53.44 52.76 2c3p n ALA 1168Cb 0.33 -1.00 0.09 0.00 0.00 0.00 0.00 19.45 18.87 2c3p n ALA 1168CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2c3p n THR 1169N -2.61 0.83 0.00 0.00 5.66 0.79 -4.93 114.28 114.02 2c3p n THR 1169Ca -0.02 -0.32 0.00 0.00 -3.05 0.00 0.00 64.05 60.65 2c3p n THR 1169Cb 0.59 -0.60 0.00 0.00 -1.55 0.00 0.00 70.33 68.77 2c3p n THR 1169CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2c3p n ASN 1170N -0.29 2.04 -4.61 1.09 4.05 -1.26 -4.91 115.26 111.37 2c3p n ASN 1170Ca 0.07 -0.29 -0.39 0.00 0.45 0.00 0.00 54.58 54.43 2c3p n ASN 1170Cb 0.52 1.00 -0.10 0.00 1.23 0.00 0.00 39.78 42.43 2c3p n ASN 1170CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2c3p s ILE 1171N -1.41 5.23 -0.06 -1.44 -1.09 -1.26 -5.04 121.20 116.13 2c3p s ILE 1171Ca 0.00 0.44 -0.22 0.00 -2.23 0.00 0.00 60.65 58.64 2c3p s ILE 1171Cb 0.00 -3.64 0.05 0.00 -1.58 0.00 0.00 42.46 37.29 2c3p s ILE 1171CO 0.00 0.20 0.51 0.72 -1.23 0.00 0.00 174.94 175.14 2c3p s PHE 1172N 1.86 -0.45 0.03 3.97 -0.71 -1.26 -5.11 117.98 116.31 2c3p s PHE 1172Ca 0.13 0.83 -0.30 0.00 -1.04 0.00 0.00 56.93 56.54 2c3p s PHE 1172Cb -0.16 0.25 -0.08 0.00 -1.21 0.00 0.00 43.02 41.82 2c3p s PHE 1172CO 0.10 -0.47 1.72 -1.21 -1.34 0.00 0.00 175.22 174.02 2c3p s GLU 1173N -1.00 4.18 0.09 1.99 2.02 -1.26 -5.01 118.70 119.71 2c3p s GLU 1173Ca -0.10 2.35 0.09 0.00 0.02 0.00 0.00 54.97 57.33 2c3p s GLU 1173Cb -0.03 -3.81 -0.03 0.00 0.10 0.00 0.00 34.13 30.36 2c3p s GLU 1173CO 0.06 -0.81 -0.23 -1.12 0.02 0.00 0.00 175.26 173.18 2c3p s SER 1174N 3.05 2.79 -0.30 -0.19 0.01 -1.26 -4.86 113.70 112.94 2c3p s SER 1174Ca 0.77 -0.65 -0.36 0.00 1.31 0.00 0.00 55.95 57.02 2c3p s SER 1174Cb -0.39 -0.19 0.17 0.00 0.21 0.00 0.00 66.02 65.82 2c3p s SER 1174CO 0.33 0.14 1.39 0.72 0.41 0.00 0.00 173.24 176.23 2c3p s PHE 1175N -1.01 -0.00 0.69 2.43 -0.12 -1.26 -5.04 117.98 113.67 2c3p s PHE 1175Ca 0.09 0.00 -0.11 0.00 -0.05 0.00 0.00 56.93 56.86 2c3p s PHE 1175Cb -0.10 0.50 0.01 0.00 -0.63 0.00 0.00 43.02 42.80 2c3p s PHE 1175CO 0.04 -0.01 1.08 0.00 -0.05 0.00 0.00 175.22 176.29 2c3p s ALA 1176N -1.68 2.93 0.38 1.99 0.00 -1.26 -4.59 121.76 119.54 2c3p s ALA 1176Ca 0.11 -0.31 0.13 0.00 0.00 0.00 0.00 51.96 51.90 2c3p s ALA 1176Cb -0.01 -3.03 0.77 0.00 0.00 0.00 0.00 23.12 20.85 2c3p s ALA 1176CO -0.04 -1.06 1.85 -1.00 0.00 0.00 0.00 175.76 175.51 2c3p h PRO 1177N -0.59 0.00 0.00 0.00 0.13 -2.00 -3.48 132.00 126.05 2c3p h PRO 1177Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2c3p h PRO 1177Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2c3p h PRO 1177CO 0.63 0.34 0.00 0.00 -0.23 0.00 0.00 178.00 178.75 2c3p n ALA 1178N -2.47 0.00 0.00 -0.56 0.00 -1.26 -5.12 120.51 111.10 2c3p n ALA 1178Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2c3p n ALA 1178Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 2c3p n ALA 1178CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3p n GLY 1179N 0.00 2.16 0.00 0.00 0.00 -1.26 -5.12 105.19 100.97 2c3p n GLY 1179Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2c3p n GLY 1179CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c3p n GLY 1180N 1.52 0.54 7.00 -0.02 0.00 -1.26 -5.09 105.19 107.88 2c3p n GLY 1180Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2c3p n GLY 1180CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2c3p n LYS 1181N 0.00 0.00 -2.25 1.61 5.02 -1.26 -4.97 118.16 116.31 2c3p n LYS 1181Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2c3p n LYS 1181Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2c3p n LYS 1181CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2c3p n ALA 1182N 5.70 -2.02 -1.54 7.82 0.00 -1.26 -4.83 120.51 124.39 2c3p n ALA 1182Ca 0.00 0.49 -0.52 0.00 0.00 0.00 0.00 53.44 53.41 2c3p n ALA 1182Cb 0.00 -1.48 -0.05 0.00 0.00 0.00 0.00 19.45 17.92 2c3p n ALA 1182CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2c3p n ASP 1183N 1.88 0.74 0.00 0.00 2.03 -1.26 -4.88 116.55 115.07 2c3p n ASP 1183Ca 0.00 1.14 0.00 0.00 0.52 0.00 0.00 54.79 56.45 2c3p n ASP 1183Cb 0.00 -1.11 0.00 0.00 -0.72 0.00 0.00 41.12 39.29 2c3p n ASP 1183CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2c3p n GLY 1184N 1.97 4.15 3.17 0.27 0.00 -1.26 -5.16 105.19 108.34 2c3p n GLY 1184Ca 0.17 -1.56 -0.09 0.00 0.00 0.00 0.00 46.02 44.55 2c3p n GLY 1184CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c3p s SER 1185N 0.00 0.28 -0.19 1.61 1.04 -1.26 -5.16 113.70 110.02 2c3p s SER 1185Ca 0.00 -0.97 -0.16 0.00 0.48 0.00 0.00 55.95 55.30 2c3p s SER 1185Cb 0.00 0.30 0.05 0.00 0.10 0.00 0.00 66.02 66.47 2c3p s SER 1185CO 0.00 -0.72 0.49 0.54 0.98 0.00 0.00 173.24 174.54 2c3p s VAL 1186N -3.96 -0.00 0.19 5.02 0.11 -1.26 -5.15 120.40 115.36 2c3p s VAL 1186Ca 0.14 0.01 -0.25 0.00 -2.93 0.00 0.00 61.98 58.95 2c3p s VAL 1186Cb 0.06 -0.69 -0.08 0.00 -1.53 0.00 0.00 36.38 34.14 2c3p s VAL 1186CO -0.05 0.01 0.79 -0.62 -3.33 0.00 0.00 175.10 171.90 2c3p s ASP 1187N 0.52 7.35 0.15 3.54 -1.08 -1.26 -4.94 116.67 120.95 2c3p s ASP 1187Ca -0.02 1.64 0.11 0.00 -0.52 0.00 0.00 52.55 53.76 2c3p s ASP 1187Cb -0.04 -2.50 0.59 0.00 -1.46 0.00 0.00 42.92 39.51 2c3p s ASP 1187CO -0.03 0.15 1.35 2.22 0.52 0.00 0.00 175.17 179.39 2c3p n PHE 1188N 1.35 0.36 0.89 -5.34 1.16 -1.26 -1.72 117.46 112.90 2c3p n PHE 1188Ca -0.04 0.18 0.10 0.00 -1.87 0.00 0.00 57.45 55.82 2c3p n PHE 1188Cb 0.49 -0.79 -0.09 0.00 -1.61 0.00 0.00 39.48 37.48 2c3p n PHE 1188CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2c3p n GLY 1189N -1.25 -1.03 3.67 4.97 0.00 -1.26 -4.87 105.19 105.42 2c3p n GLY 1189Ca -0.00 -0.57 -0.48 0.00 0.00 0.00 0.00 46.02 44.97 2c3p n GLY 1189CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c3p n GLU 1190N -1.59 2.02 -1.21 1.61 1.02 -0.70 -1.77 120.64 120.02 2c3p n GLU 1190Ca 0.03 0.73 -0.07 0.00 -0.02 0.00 0.00 57.16 57.83 2c3p n GLU 1190Cb 0.36 -2.51 -0.03 0.00 -0.02 0.00 0.00 31.44 29.24 2c3p n GLU 1190CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c3p n GLY 1191N 3.66 0.78 3.75 0.62 0.00 -1.26 -4.98 105.19 107.77 2c3p n GLY 1191Ca 0.19 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2c3p n GLY 1191CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3p s ALA 1192N -1.81 2.53 0.05 4.61 0.00 -0.73 -4.93 121.76 121.48 2c3p s ALA 1192Ca 0.00 1.00 0.14 0.00 0.00 0.00 0.00 51.96 53.10 2c3p s ALA 1192Cb 0.00 -3.45 0.22 0.00 0.00 0.00 0.00 23.12 19.89 2c3p s ALA 1192CO 0.00 -1.19 1.51 0.93 0.00 0.00 0.00 175.76 177.01 2c3p h GLU 1193N 0.84 0.00 -5.43 0.00 3.07 -1.93 -3.46 114.58 107.67 2c3p h GLU 1193Ca -0.50 0.00 -0.46 0.00 -0.50 0.00 0.00 59.36 57.89 2c3p h GLU 1193Cb 1.30 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 29.07 2c3p h GLU 1193CO 0.55 0.58 -0.68 -0.06 -1.40 0.00 0.00 179.01 178.00 2c3p s PHE 1194N -3.17 1.83 0.29 4.33 0.40 -1.26 -4.49 117.98 115.91 2c3p s PHE 1194Ca 0.02 -0.72 -0.29 0.00 -0.60 0.00 0.00 56.93 55.33 2c3p s PHE 1194Cb 0.10 -1.02 -0.13 0.00 0.51 0.00 0.00 43.02 42.48 2c3p s PHE 1194CO 0.75 0.23 1.20 0.00 0.70 0.00 0.00 175.22 178.09 2c3p n THR 1196N 0.68 0.00 -4.14 0.00 -1.04 -1.26 -4.94 114.28 103.58 2c3p n THR 1196Ca 0.08 -0.45 -0.11 0.00 -2.04 0.00 0.00 64.05 61.54 2c3p n THR 1196Cb 0.33 1.11 -0.10 0.00 -1.82 0.00 0.00 70.33 69.84 2c3p n THR 1196CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2c3p s ARG 1197N -0.91 0.74 0.39 -2.82 0.52 -1.26 -5.00 118.95 110.61 2c3p s ARG 1197Ca 0.07 -1.20 0.01 0.00 -0.52 0.00 0.00 55.73 54.09 2c3p s ARG 1197Cb 0.06 -0.16 0.08 0.00 0.52 0.00 0.00 34.95 35.44 2c3p s ARG 1197CO 0.14 -0.02 0.54 -0.40 0.02 0.00 0.00 175.30 175.59 2c3p n ASP 1198N 0.28 0.85 -0.46 0.23 3.85 -1.26 -5.01 116.55 115.04 2c3p n ASP 1198Ca -0.15 -1.69 0.04 0.00 -0.71 0.00 0.00 54.79 52.28 2c3p n ASP 1198Cb 0.60 -0.34 0.11 0.00 -1.35 0.00 0.00 41.12 40.13 2c3p n ASP 1198CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2c3p n ASP 1199N -2.88 1.32 -4.86 -1.12 8.00 -1.26 -4.81 116.55 110.95 2c3p n ASP 1199Ca 0.09 -2.01 -0.31 0.00 0.71 0.00 0.00 54.79 53.27 2c3p n ASP 1199Cb 0.33 -0.17 -0.02 0.00 -0.02 0.00 0.00 41.12 41.24 2c3p n ASP 1199CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2c3p s THR 1200N -1.68 4.62 0.24 -3.53 2.01 -1.26 -4.97 115.64 111.07 2c3p s THR 1200Ca 0.16 1.04 0.24 0.00 0.31 0.00 0.00 61.69 63.44 2c3p s THR 1200Cb 0.08 -3.77 0.23 0.00 0.01 0.00 0.00 72.50 69.06 2c3p s THR 1200CO 0.11 -0.81 1.89 -0.65 -0.69 0.00 0.00 174.62 174.47 2c3p h PRO 1201N 0.57 0.00 -0.19 4.92 0.11 -1.97 -3.06 132.00 132.39 2c3p h PRO 1201Ca -0.46 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 2c3p h PRO 1201Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2c3p h PRO 1201CO 0.62 0.22 -0.19 0.52 -0.21 0.00 0.00 178.00 178.96 2c3p h MET 1202N 0.00 0.32 -0.00 1.05 2.86 -1.97 -3.14 114.93 114.05 2c3p h MET 1202Ca -0.00 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2c3p h MET 1202Cb 0.63 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.26 2c3p h MET 1202CO 0.03 0.51 -0.79 -1.33 1.06 0.00 0.00 176.91 176.39 2c3p n MET 1203N -4.20 0.30 -1.70 1.72 2.81 -1.16 -4.95 117.12 109.94 2c3p n MET 1203Ca -0.00 -0.24 -0.43 0.00 -1.81 0.00 0.00 57.70 55.22 2c3p n MET 1203Cb 0.33 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.32 2c3p n MET 1203CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c3p n ALA 1204N -1.15 2.22 -2.24 3.04 0.00 -1.18 -4.96 120.51 116.24 2c3p n ALA 1204Ca 0.06 0.41 -0.14 0.00 0.00 0.00 0.00 53.44 53.77 2c3p n ALA 1204Cb 0.36 -2.44 -0.10 0.00 0.00 0.00 0.00 19.45 17.27 2c3p n ALA 1204CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2c3p s ARG 1205N 0.74 1.09 0.29 0.00 1.81 -1.26 -5.00 118.95 116.62 2c3p s ARG 1205Ca 0.74 -1.51 0.04 0.00 -1.72 0.00 0.00 55.73 53.28 2c3p s ARG 1205Cb -0.57 -0.34 0.70 0.00 -0.45 0.00 0.00 34.95 34.29 2c3p s ARG 1205CO 0.37 -0.09 1.73 -1.35 -0.68 0.00 0.00 175.30 175.29 2c3p h PRO 1206N 2.72 0.52 -0.17 3.54 0.11 -2.04 -0.77 132.00 135.91 2c3p h PRO 1206Ca -0.37 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2c3p h PRO 1206Cb 1.20 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2c3p h PRO 1206CO 0.63 0.34 0.00 -0.25 -0.21 0.00 0.00 178.00 178.52 2c3p n ASP 1207N -4.94 2.20 -4.89 -2.05 8.00 -1.26 -4.94 116.55 108.68 2c3p n ASP 1207Ca 0.22 -1.77 -0.30 0.00 0.71 0.00 0.00 54.79 53.65 2c3p n ASP 1207Cb 0.60 -0.10 0.06 0.00 -0.02 0.00 0.00 41.12 41.66 2c3p n ASP 1207CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2c3p s SER 1208N -1.69 5.19 0.00 -2.24 1.04 -0.30 -4.60 113.70 111.11 2c3p s SER 1208Ca 0.34 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.82 2c3p s SER 1208Cb 0.20 -1.77 0.00 0.00 0.10 0.00 0.00 66.02 64.55 2c3p s SER 1208CO 0.29 -1.49 0.00 0.61 0.98 0.00 0.00 173.24 173.63 2c3p n GLY 1209N -3.06 1.40 3.77 7.32 0.00 -1.26 -4.84 105.19 108.51 2c3p n GLY 1209Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 2c3p n GLY 1209CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c3p s GLU 1210N 0.00 2.90 0.48 1.61 2.02 -1.26 -4.99 118.70 119.45 2c3p s GLU 1210Ca 0.00 1.48 -0.22 0.00 0.02 0.00 0.00 54.97 56.25 2c3p s GLU 1210Cb 0.00 -1.96 -0.07 0.00 0.10 0.00 0.00 34.13 32.20 2c3p s GLU 1210CO 0.00 -1.19 1.14 0.00 0.02 0.00 0.00 175.26 175.24 2c3p s ALA 1211N -2.16 2.91 0.19 5.21 0.00 -1.26 -5.03 121.76 121.61 2c3p s ALA 1211Ca 0.69 0.88 -0.23 0.00 0.00 0.00 0.00 51.96 53.30 2c3p s ALA 1211Cb -0.22 -3.37 0.05 0.00 0.00 0.00 0.00 23.12 19.59 2c3p s ALA 1211CO 0.38 -0.64 0.77 0.00 0.00 0.00 0.00 175.76 176.26 2c3p s ASP 1213N -2.83 6.90 -0.14 0.00 -1.08 -1.26 -4.73 116.67 113.53 2c3p s ASP 1213Ca 0.08 0.98 0.09 0.00 -0.52 0.00 0.00 52.55 53.18 2c3p s ASP 1213Cb -0.03 -2.54 0.49 0.00 -1.46 0.00 0.00 42.92 39.38 2c3p s ASP 1213CO -0.01 -0.91 1.26 1.67 0.52 0.00 0.00 175.17 177.70 2c3p n GLN 1214N 6.95 3.31 -2.24 4.34 7.27 -1.26 0.97 117.38 136.71 2c3p n GLN 1214Ca 0.12 -1.89 -0.18 0.00 0.07 0.00 0.00 57.00 55.11 2c3p n GLN 1214Cb 0.47 -1.94 -0.02 0.00 2.41 0.00 0.00 30.24 31.17 2c3p n GLN 1214CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2c3p n ASN 1215N 0.40 -5.31 -0.67 1.69 3.02 -1.26 -4.88 115.26 108.26 2c3p n ASN 1215Ca 0.17 0.04 0.12 0.00 -0.03 0.00 0.00 54.58 54.88 2c3p n ASN 1215Cb 0.80 -4.38 0.07 0.00 -0.61 0.00 0.00 39.78 35.67 2c3p n ASN 1215CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2c3p n ARG 1216N -2.72 1.65 -0.13 3.52 1.74 -1.26 -4.17 116.66 115.28 2c3p n ARG 1216Ca -0.21 -1.34 0.04 0.00 -0.77 0.00 0.00 57.85 55.57 2c3p n ARG 1216Cb 0.66 -1.47 0.11 0.00 -1.02 0.00 0.00 32.46 30.74 2c3p n ARG 1216CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2c3p n ALA 1217N 0.50 2.14 0.00 7.54 0.00 -1.26 -5.10 120.51 124.33 2c3p n ALA 1217Ca 0.12 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.42 2c3p n ALA 1217Cb 0.51 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2c3p n ALA 1217CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3p n GLY 1218N 0.20 -2.31 3.70 0.00 0.00 -1.26 -4.47 105.19 101.05 2c3p n GLY 1218Ca 0.09 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 44.13 2c3p n GLY 1218CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c3p s THR 1219N -0.35 2.48 0.29 2.61 2.01 -1.26 -4.75 115.64 116.67 2c3p s THR 1219Ca 0.00 0.16 -0.03 0.00 0.31 0.00 0.00 61.69 62.13 2c3p s THR 1219Cb 0.00 -2.34 0.26 0.00 0.01 0.00 0.00 72.50 70.44 2c3p s THR 1219CO 0.00 -0.20 1.96 0.28 -0.69 0.00 0.00 174.62 175.96 2c3p h SER 1220N -1.64 0.99 -0.20 3.53 0.02 -1.99 0.88 113.55 115.15 2c3p h SER 1220Ca -0.44 -0.02 -0.21 0.00 -0.84 0.00 0.00 61.79 60.28 2c3p h SER 1220Cb 1.26 -0.24 0.01 0.00 0.14 0.00 0.00 62.40 63.56 2c3p h SER 1220CO 0.45 0.71 -0.69 -0.08 -1.14 0.00 0.00 176.83 176.08 2c3p h GLU 1221N 1.17 0.83 -0.60 3.45 4.81 -1.98 -1.37 114.58 120.88 2c3p h GLU 1221Ca 0.32 -0.62 -0.07 0.00 -0.13 0.00 0.00 59.36 58.87 2c3p h GLU 1221Cb -0.11 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2c3p h GLU 1221CO -0.08 1.24 0.10 1.96 -0.73 0.00 0.00 179.01 181.50 2c3p h GLN 1222N 0.60 0.98 -0.32 1.92 4.20 -1.80 0.23 115.11 120.92 2c3p h GLN 1222Ca -0.03 -0.26 -0.10 0.00 0.06 0.00 0.00 58.65 58.32 2c3p h GLN 1222Cb 1.32 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.97 2c3p h GLN 1222CO 0.15 0.93 -0.20 1.96 -0.67 0.00 0.00 178.83 180.99 2c3p h GLN 1223N 0.89 0.61 0.12 1.46 4.20 -0.84 0.12 115.11 121.67 2c3p h GLN 1223Ca 0.18 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2c3p h GLN 1223Cb 0.42 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2c3p h GLN 1223CO 0.01 0.77 -0.06 0.78 -0.67 0.00 0.00 178.83 179.66 2c3p h GLY 1224N 0.99 -0.17 1.11 3.46 0.00 -0.67 -1.43 103.07 106.36 2c3p h GLY 1224Ca 0.08 0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.51 2c3p h GLY 1224CO 0.05 -0.06 0.53 -1.80 0.00 0.00 0.00 176.54 175.26 2c3p h ASP 1225N -0.52 0.87 -0.09 0.19 3.58 -0.47 0.10 116.42 120.08 2c3p h ASP 1225Ca -0.02 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.35 2c3p h ASP 1225Cb 0.42 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 2c3p h ASP 1225CO 0.03 0.60 -0.15 0.25 -2.88 0.00 0.00 179.24 177.09 2c3p h LEU 1226N 1.01 0.43 -0.48 2.28 5.85 -0.65 -0.78 115.31 122.97 2c3p h LEU 1226Ca 0.32 -0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 2c3p h LEU 1226Cb 0.02 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2c3p h LEU 1226CO -0.09 0.60 -0.14 -1.28 -0.34 0.00 0.00 178.44 177.20 2c3p h SER 1227N 0.41 0.94 -0.32 1.25 0.87 0.28 -0.02 113.55 116.97 2c3p h SER 1227Ca 0.07 -0.37 -0.07 0.00 -1.23 0.00 0.00 61.79 60.19 2c3p h SER 1227Cb 0.50 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2c3p h SER 1227CO 0.03 1.10 -0.08 0.11 -0.53 0.00 0.00 176.83 177.46 2c3p h LYS 1228N 0.78 0.62 0.00 2.24 1.57 -0.90 -2.27 116.57 118.60 2c3p h LYS 1228Ca 0.12 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 2c3p h LYS 1228Cb 0.70 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 2c3p h LYS 1228CO 0.05 0.80 -0.10 0.00 -0.57 0.00 0.00 179.45 179.63 2c3p h ARG 1229N 0.40 0.00 -0.67 3.15 3.08 -0.94 -1.48 114.38 117.92 2c3p h ARG 1229Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2c3p h ARG 1229Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.62 2c3p h ARG 1229CO 0.03 0.10 0.00 -2.37 -1.07 0.00 0.00 179.97 176.66 2c3p n THR 1230N -4.12 1.73 0.00 2.04 5.66 -0.04 -4.79 114.28 114.76 2c3p n THR 1230Ca -0.03 -1.15 0.00 0.00 -3.05 0.00 0.00 64.05 59.83 2c3p n THR 1230Cb 0.18 0.15 0.00 0.00 -1.55 0.00 0.00 70.33 69.11 2c3p n THR 1230CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 2c3p n LYS 1231N 1.19 0.00 -0.49 1.09 2.85 -0.56 -5.02 118.16 117.22 2c3p n LYS 1231Ca 0.26 0.08 0.00 0.00 -1.05 0.00 0.00 58.31 57.60 2c3p n LYS 1231Cb 0.86 -0.12 0.00 0.00 -0.65 0.00 0.00 35.03 35.12 2c3p n LYS 1231CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98