#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gwh s THR 7 N 0.00 4.88 0.50 1.09 -4.23 -1.26 -4.99 115.64 111.63 1gwh s THR 7 Ca 0.00 0.30 0.24 0.00 -1.18 0.00 0.00 61.69 61.05 1gwh s THR 7 Cb 0.00 -3.83 0.41 0.00 1.34 0.00 0.00 72.50 70.42 1gwh s THR 7 CO 0.00 -0.75 1.94 -0.65 -0.54 0.00 0.00 174.62 174.62 1gwh h PRO 8 N 0.54 0.11 -0.23 3.99 0.11 -2.09 -2.28 132.00 132.16 1gwh h PRO 8 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1gwh h PRO 8 Cb 1.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1gwh h PRO 8 CO 0.62 0.07 0.00 0.72 -0.21 0.00 0.00 178.00 179.21 1gwh n HIS 9 N -4.38 0.76 -1.69 0.65 8.25 -1.26 -5.05 115.22 112.49 1gwh n HIS 9 Ca 0.14 -0.84 -0.36 0.00 -0.26 0.00 0.00 57.72 56.40 1gwh n HIS 9 Cb 0.70 -0.26 0.07 0.00 1.12 0.00 0.00 29.99 31.62 1gwh n HIS 9 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1gwh s ALA 10 N -2.60 2.32 0.00 -1.41 0.00 -0.86 -4.81 121.76 114.40 1gwh s ALA 10 Ca 0.38 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.38 1gwh s ALA 10 Cb 0.30 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1gwh s ALA 10 CO 0.09 -1.59 0.27 0.25 0.00 0.00 0.00 175.76 174.78 1gwh n THR 11 N -2.13 0.00 0.00 0.00 -2.24 -1.26 -5.02 114.28 103.63 1gwh n THR 11 Ca 0.14 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1gwh n THR 11 Cb 0.49 1.29 0.00 0.00 -2.10 0.00 0.00 70.33 70.02 1gwh n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gwh n GLY 12 N 0.10 1.81 3.73 3.38 0.00 -1.26 -4.90 105.19 108.06 1gwh n GLY 12 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1gwh n GLY 12 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gwh s SER 13 N -1.97 -0.25 0.31 1.61 1.04 -1.26 -5.09 113.70 108.09 1gwh s SER 13 Ca 0.00 -0.38 0.07 0.00 0.48 0.00 0.00 55.95 56.12 1gwh s SER 13 Cb 0.00 0.55 -0.06 0.00 0.10 0.00 0.00 66.02 66.61 1gwh s SER 13 CO 0.00 -1.00 -0.06 0.42 0.98 0.00 0.00 173.24 173.58 1gwh s THR 14 N -3.48 1.81 0.47 2.02 -4.23 -1.26 -1.34 115.64 109.62 1gwh s THR 14 Ca 0.10 -2.13 -0.08 0.00 -1.18 0.00 0.00 61.69 58.40 1gwh s THR 14 Cb -0.03 -2.56 0.11 0.00 1.34 0.00 0.00 72.50 71.36 1gwh s THR 14 CO 0.01 -0.23 0.62 0.54 -0.54 0.00 0.00 174.62 175.02 1gwh n ARG 15 N -0.67 -0.71 0.24 3.99 1.74 0.56 -4.60 116.66 117.21 1gwh n ARG 15 Ca -0.05 -0.97 0.12 0.00 -0.77 0.00 0.00 57.85 56.18 1gwh n ARG 15 Cb 0.64 -0.66 0.57 0.00 -1.02 0.00 0.00 32.46 31.99 1gwh n ARG 15 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1gwh h GLN 16 N 0.00 0.00 -0.12 5.56 4.20 -1.98 -2.51 115.11 120.26 1gwh h GLN 16 Ca -0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1gwh h GLN 16 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1gwh h GLN 16 CO 0.14 0.16 0.00 0.27 -0.67 0.00 0.00 178.83 178.73 1gwh n ASN 17 N -3.37 1.17 0.00 1.46 6.94 -1.26 -4.92 115.26 115.28 1gwh n ASN 17 Ca -0.00 -1.64 0.00 0.00 -0.02 0.00 0.00 54.58 52.92 1gwh n ASN 17 Cb 0.36 -0.08 0.00 0.00 -2.36 0.00 0.00 39.78 37.70 1gwh n ASN 17 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1gwh n GLY 18 N 1.02 1.37 3.80 4.83 0.00 -0.94 -5.05 105.19 110.20 1gwh n GLY 18 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1gwh n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gwh s ALA 19 N -2.99 3.03 0.25 4.61 0.00 -1.26 -4.76 121.76 120.64 1gwh s ALA 19 Ca 0.00 0.57 -0.30 0.00 0.00 0.00 0.00 51.96 52.23 1gwh s ALA 19 Cb 0.00 -3.22 -0.14 0.00 0.00 0.00 0.00 23.12 19.76 1gwh s ALA 19 CO 0.00 -0.09 1.23 -2.30 0.00 0.00 0.00 175.76 174.60 1gwh n PRO 20 N -0.38 1.68 0.17 0.00 -0.02 -1.26 -0.32 135.00 134.87 1gwh n PRO 20 Ca 0.06 0.60 0.11 0.00 -2.02 0.00 0.00 63.50 62.25 1gwh n PRO 20 Cb 0.52 -2.13 0.09 0.00 -0.02 0.00 0.00 33.50 31.95 1gwh n PRO 20 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gwh h ALA 21 N 3.20 0.78 0.00 3.55 0.00 -1.46 -3.41 119.26 121.91 1gwh h ALA 21 Ca -0.43 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1gwh h ALA 21 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1gwh h ALA 21 CO 0.69 0.05 0.00 0.28 0.00 0.00 0.00 179.25 180.27 1gwh n VAL 22 N -2.94 0.00 -3.72 0.00 0.31 -1.26 -4.76 118.33 105.96 1gwh n VAL 22 Ca 0.02 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.23 1gwh n VAL 22 Cb 0.56 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.37 1gwh n VAL 22 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1gwh s SER 23 N 0.00 -0.42 -0.04 4.52 0.15 -1.26 -4.99 113.70 111.66 1gwh s SER 23 Ca 0.00 0.76 0.18 0.00 0.70 0.00 0.00 55.95 57.59 1gwh s SER 23 Cb 0.00 0.67 0.60 0.00 -1.71 0.00 0.00 66.02 65.58 1gwh s SER 23 CO 0.00 -0.17 1.50 0.47 1.20 0.00 0.00 173.24 176.24 1gwh n ASP 24 N 3.87 3.80 0.00 5.45 9.92 -1.26 -4.60 116.55 133.74 1gwh n ASP 24 Ca -0.21 -2.17 0.00 0.00 -0.53 0.00 0.00 54.79 51.88 1gwh n ASP 24 Cb 0.55 -0.48 0.00 0.00 -0.64 0.00 0.00 41.12 40.55 1gwh n ASP 24 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1gwh n ARG 25 N 1.22 3.38 -3.96 -1.24 1.74 -1.26 -5.08 116.66 111.47 1gwh n ARG 25 Ca 0.22 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.18 1gwh n ARG 25 Cb 0.65 -0.61 -0.13 0.00 -1.02 0.00 0.00 32.46 31.35 1gwh n ARG 25 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1gwh s GLN 26 N -0.76 0.17 0.64 5.56 -1.52 -1.26 -5.16 119.66 117.33 1gwh s GLN 26 Ca 0.00 -0.19 -0.07 0.00 -1.95 0.00 0.00 55.36 53.15 1gwh s GLN 26 Cb 0.00 -0.07 0.02 0.00 -0.22 0.00 0.00 33.01 32.74 1gwh s GLN 26 CO 0.00 0.01 0.96 -1.12 -0.25 0.00 0.00 175.29 174.89 1gwh s SER 27 N -0.39 5.38 -0.38 5.90 0.01 -1.26 -4.83 113.70 118.13 1gwh s SER 27 Ca -0.03 0.72 -0.22 0.00 1.31 0.00 0.00 55.95 57.73 1gwh s SER 27 Cb -0.03 -1.60 0.01 0.00 0.21 0.00 0.00 66.02 64.61 1gwh s SER 27 CO -0.00 -1.23 0.72 -0.22 0.41 0.00 0.00 173.24 172.92 1gwh s LEU 28 N -5.11 4.22 0.26 2.44 2.96 -1.26 -5.03 118.68 117.15 1gwh s LEU 28 Ca 0.56 0.17 0.08 0.00 -0.22 0.00 0.00 54.13 54.71 1gwh s LEU 28 Cb -0.11 -2.91 -0.05 0.00 0.50 0.00 0.00 46.19 43.62 1gwh s LEU 28 CO 0.46 -0.72 -0.11 0.42 -1.32 0.00 0.00 176.35 175.09 1gwh s THR 29 N 2.98 1.81 -0.93 3.68 -4.23 -1.26 -2.06 115.64 115.62 1gwh s THR 29 Ca 0.28 -2.19 -0.21 0.00 -1.18 0.00 0.00 61.69 58.39 1gwh s THR 29 Cb -0.13 -2.31 0.09 0.00 1.34 0.00 0.00 72.50 71.48 1gwh s THR 29 CO 0.17 -0.40 1.26 -0.69 -0.54 0.00 0.00 174.62 174.42 1gwh s VAL 30 N -2.92 4.29 0.14 2.29 1.01 -0.95 -4.81 120.40 119.45 1gwh s VAL 30 Ca 0.27 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1gwh s VAL 30 Cb 0.01 -4.90 0.00 0.00 0.00 0.00 0.00 36.38 31.49 1gwh s VAL 30 CO 0.11 -1.71 0.00 0.61 0.00 0.00 0.00 175.10 174.11 1gwh n GLY 31 N 6.07 -2.14 0.25 4.51 0.00 -1.26 -2.39 105.19 110.24 1gwh n GLY 31 Ca 0.24 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.93 1gwh n GLY 31 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1gwh h SER 32 N -0.40 0.10 -0.02 1.61 4.64 -2.00 -2.95 113.55 114.53 1gwh h SER 32 Ca -0.02 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1gwh h SER 32 Cb 0.39 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1gwh h SER 32 CO 0.01 0.16 -0.04 -0.62 -0.87 0.00 0.00 176.83 175.47 1gwh n GLU 33 N -4.43 2.12 -2.67 4.77 -0.58 -1.26 -5.01 120.64 113.57 1gwh n GLU 33 Ca -0.02 -1.69 -0.23 0.00 -0.42 0.00 0.00 57.16 54.81 1gwh n GLU 33 Cb 0.16 -1.47 0.09 0.00 -0.57 0.00 0.00 31.44 29.65 1gwh n GLU 33 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1gwh s GLY 34 N -2.05 1.76 0.78 0.62 0.00 -1.00 -5.04 107.32 102.40 1gwh s GLY 34 Ca 0.29 -1.76 -0.11 0.00 0.00 0.00 0.00 44.72 43.13 1gwh s GLY 34 CO 0.33 -1.25 1.08 2.56 0.00 0.00 0.00 173.10 175.83 1gwh s PRO 35 N -5.01 2.24 0.22 2.90 0.04 -1.26 -4.42 135.00 129.71 1gwh s PRO 35 Ca 0.64 0.90 -0.30 0.00 0.04 0.00 0.00 61.00 62.29 1gwh s PRO 35 Cb -0.06 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.48 1gwh s PRO 35 CO 0.43 -1.58 1.09 0.42 0.04 0.00 0.00 177.00 177.40 1gwh s ILE 36 N -3.02 3.72 0.31 0.56 1.01 -1.26 -2.23 121.20 120.28 1gwh s ILE 36 Ca 0.60 1.59 -0.10 0.00 0.00 0.00 0.00 60.65 62.75 1gwh s ILE 36 Cb -0.16 -4.01 -0.07 0.00 0.01 0.00 0.00 42.46 38.23 1gwh s ILE 36 CO 0.55 0.32 0.64 0.68 0.00 0.00 0.00 174.94 177.14 1gwh s VAL 37 N -0.65 4.87 0.49 2.92 -7.23 -0.87 -4.98 120.40 114.94 1gwh s VAL 37 Ca 0.47 0.50 0.14 0.00 -1.81 0.00 0.00 61.98 61.29 1gwh s VAL 37 Cb -0.30 -3.67 0.29 0.00 0.56 0.00 0.00 36.38 33.25 1gwh s VAL 37 CO 0.37 -0.27 2.10 0.25 -0.31 0.00 0.00 175.10 177.24 1gwh h LEU 38 N 1.94 0.15 -2.51 1.32 5.85 -1.96 -2.99 115.31 117.10 1gwh h LEU 38 Ca -0.47 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.15 1gwh h LEU 38 Cb 1.18 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.12 1gwh h LEU 38 CO 0.66 0.10 0.12 0.00 -0.34 0.00 0.00 178.44 178.98 1gwh n HIS 39 N -4.50 1.19 -2.43 1.25 1.44 -1.26 -4.61 115.22 106.30 1gwh n HIS 39 Ca 0.01 -0.64 -0.38 0.00 -2.01 0.00 0.00 57.72 54.69 1gwh n HIS 39 Cb 0.15 -0.41 -0.02 0.00 0.12 0.00 0.00 29.99 29.83 1gwh n HIS 39 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1gwh s ASP 40 N -0.28 6.27 0.40 4.39 3.68 -1.13 -4.78 116.67 125.22 1gwh s ASP 40 Ca 0.27 -2.00 0.20 0.00 2.13 0.00 0.00 52.55 53.15 1gwh s ASP 40 Cb 0.21 -2.58 0.81 0.00 -1.45 0.00 0.00 42.92 39.92 1gwh s ASP 40 CO 0.07 -1.75 1.80 0.71 0.13 0.00 0.00 175.17 176.13 1gwh h THR 41 N 6.01 0.84 -0.20 1.71 1.35 -1.92 -1.74 112.91 118.96 1gwh h THR 41 Ca 0.34 -1.32 -0.20 0.00 -0.55 0.00 0.00 66.41 64.68 1gwh h THR 41 Cb 0.92 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.15 1gwh h THR 41 CO 1.39 0.32 -0.66 -0.74 -0.25 0.00 0.00 175.52 175.58 1gwh h HIS 42 N 0.00 0.99 -0.27 4.73 -0.00 -1.92 0.17 115.15 118.84 1gwh h HIS 42 Ca -0.00 -0.39 -0.00 0.00 -0.00 0.00 0.00 60.37 59.97 1gwh h HIS 42 Cb 0.78 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 28.01 1gwh h HIS 42 CO 0.00 1.21 0.16 1.25 -0.00 0.00 0.00 177.93 180.55 1gwh h LEU 43 N 0.56 0.33 -0.24 0.26 5.85 -1.84 -1.65 115.31 118.58 1gwh h LEU 43 Ca -0.02 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1gwh h LEU 43 Cb 1.26 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 1gwh h LEU 43 CO 0.14 0.29 0.10 -0.07 -0.34 0.00 0.00 178.44 178.56 1gwh h LEU 44 N 0.34 0.32 -0.30 2.25 3.38 -1.25 -1.62 115.31 118.44 1gwh h LEU 44 Ca 0.10 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1gwh h LEU 44 Cb 0.03 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1gwh h LEU 44 CO -0.02 0.38 0.13 -0.33 0.09 0.00 0.00 178.44 178.69 1gwh h GLU 45 N 0.24 0.44 -0.53 1.13 5.08 -0.88 0.11 114.58 120.17 1gwh h GLU 45 Ca 0.08 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 1gwh h GLU 45 Cb 0.15 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1gwh h GLU 45 CO -0.01 0.44 -0.02 1.79 -1.00 0.00 0.00 179.01 180.21 1gwh h THR 46 N 0.33 1.27 -0.33 1.13 1.35 -1.26 -1.09 112.91 114.30 1gwh h THR 46 Ca 0.10 -1.13 -0.13 0.00 -0.55 0.00 0.00 66.41 64.70 1gwh h THR 46 Cb 0.16 0.94 -0.01 0.00 -1.73 0.00 0.00 68.15 67.52 1gwh h THR 46 CO -0.01 0.40 -0.30 0.45 -0.25 0.00 0.00 175.52 175.81 1gwh h HIS 47 N 0.82 0.94 -0.13 4.73 3.86 -1.18 -1.46 115.15 122.73 1gwh h HIS 47 Ca 0.15 -0.28 -0.07 0.00 -1.16 0.00 0.00 60.37 59.01 1gwh h HIS 47 Cb 0.56 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 1gwh h HIS 47 CO 0.04 1.05 -0.23 1.96 0.86 0.00 0.00 177.93 181.61 1gwh h GLN 48 N 0.57 0.23 -0.10 2.45 4.20 -0.69 -0.41 115.11 121.34 1gwh h GLN 48 Ca 0.06 -0.07 -0.16 0.00 0.06 0.00 0.00 58.65 58.54 1gwh h GLN 48 Cb 0.88 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.64 1gwh h GLN 48 CO 0.08 0.46 -0.55 1.25 -0.67 0.00 0.00 178.83 179.39 1gwh h HIS 49 N 0.21 0.75 -0.87 2.96 2.76 -1.15 -3.07 115.15 116.74 1gwh h HIS 49 Ca 0.04 -0.33 0.15 0.00 -2.20 0.00 0.00 60.37 58.02 1gwh h HIS 49 Cb 0.53 -0.11 -0.10 0.00 1.55 0.00 0.00 27.41 29.28 1gwh h HIS 49 CO 0.01 1.12 0.46 0.35 -1.30 0.00 0.00 177.93 178.57 1gwh h PHE 50 N 0.16 0.81 0.00 5.26 3.57 -0.95 -0.07 116.94 125.72 1gwh h PHE 50 Ca -0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1gwh h PHE 50 Cb 1.19 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1gwh h PHE 50 CO 0.11 0.19 0.00 0.09 -2.23 0.00 0.00 178.31 176.48 1gwh n ASN 51 N -4.85 0.13 -0.10 0.41 3.02 -0.19 -2.59 115.26 111.08 1gwh n ASN 51 Ca 0.18 0.53 0.06 0.00 -0.03 0.00 0.00 54.58 55.32 1gwh n ASN 51 Cb 0.45 -0.56 0.08 0.00 -0.61 0.00 0.00 39.78 39.14 1gwh n ASN 51 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1gwh n ARG 52 N -1.64 1.47 -0.12 3.52 1.74 -0.11 -4.74 116.66 116.77 1gwh n ARG 52 Ca 0.03 -2.02 -0.13 0.00 -0.77 0.00 0.00 57.85 54.97 1gwh n ARG 52 Cb 0.18 -1.20 -0.02 0.00 -1.02 0.00 0.00 32.46 30.39 1gwh n ARG 52 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 1gwh h MET 53 N 0.00 0.91 -6.77 5.56 2.86 -1.10 -3.45 114.93 112.94 1gwh h MET 53 Ca 0.00 -0.47 -0.50 0.00 -2.06 0.00 0.00 59.70 56.67 1gwh h MET 53 Cb 0.93 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.61 1gwh h MET 53 CO 0.00 1.12 0.46 -0.80 1.06 0.00 0.00 176.91 178.75 1gwh s ASN 54 N -6.77 7.31 0.29 1.22 0.01 -1.26 -5.05 114.94 110.68 1gwh s ASN 54 Ca -0.11 2.20 0.12 0.00 -0.71 0.00 0.00 52.86 54.35 1gwh s ASN 54 Cb 0.11 -2.62 -0.05 0.00 0.41 0.00 0.00 41.25 39.10 1gwh s ASN 54 CO 0.87 -0.13 -0.18 0.27 -1.51 0.00 0.00 177.10 176.43 1gwh s ILE 55 N -0.98 2.50 0.24 0.60 -4.36 -1.26 -5.09 121.20 112.85 1gwh s ILE 55 Ca 0.45 -2.36 -0.31 0.00 -0.26 0.00 0.00 60.65 58.17 1gwh s ILE 55 Cb -0.31 -2.37 -0.13 0.00 1.25 0.00 0.00 42.46 40.90 1gwh s ILE 55 CO 0.39 -0.38 1.45 -2.65 0.24 0.00 0.00 174.94 173.99 1gwh n PRO 56 N -0.66 2.13 -1.55 0.37 -0.02 -1.26 -4.94 135.00 129.08 1gwh n PRO 56 Ca -0.05 0.76 -0.32 0.00 -2.02 0.00 0.00 63.50 61.87 1gwh n PRO 56 Cb 0.60 -2.44 0.07 0.00 -0.02 0.00 0.00 33.50 31.71 1gwh n PRO 56 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1gwh s GLU 57 N -0.28 2.55 0.44 -0.52 -1.05 -1.26 -4.92 118.70 113.66 1gwh s GLU 57 Ca 0.69 1.32 -0.25 0.00 -0.15 0.00 0.00 54.97 56.58 1gwh s GLU 57 Cb -0.63 -1.92 -0.09 0.00 -0.44 0.00 0.00 34.13 31.05 1gwh s GLU 57 CO 0.48 -1.44 1.36 0.54 0.95 0.00 0.00 175.26 177.15 1gwh n ARG 58 N -2.86 2.09 -3.97 -4.83 1.74 -1.26 -4.97 116.66 102.60 1gwh n ARG 58 Ca 0.10 0.75 -0.30 0.00 -0.77 0.00 0.00 57.85 57.62 1gwh n ARG 58 Cb 0.52 -2.52 -0.16 0.00 -1.02 0.00 0.00 32.46 29.28 1gwh n ARG 58 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1gwh s ARG 59 N -2.36 1.81 0.00 5.56 3.52 -1.26 -3.35 118.95 122.88 1gwh s ARG 59 Ca 0.61 -0.90 0.00 0.00 -0.13 0.00 0.00 55.73 55.32 1gwh s ARG 59 Cb -0.47 -2.47 0.00 0.00 -1.56 0.00 0.00 34.95 30.44 1gwh s ARG 59 CO 0.57 -0.51 0.00 -0.35 -0.81 0.00 0.00 175.30 174.21 1gwh n PRO 60 N 4.68 1.34 -2.58 5.12 -0.05 -1.26 -5.04 135.00 137.22 1gwh n PRO 60 Ca -0.13 0.00 -0.10 0.00 -0.05 0.00 0.00 63.50 63.22 1gwh n PRO 60 Cb 0.45 0.00 0.02 0.00 -0.05 0.00 0.00 33.50 33.92 1gwh n PRO 60 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 175.50 176.17 1gwh n HIS 61 N -0.53 -0.86 -0.25 0.54 8.25 -0.37 -4.97 115.22 117.02 1gwh n HIS 61 Ca 0.00 0.22 -0.01 0.00 -0.26 0.00 0.00 57.72 57.68 1gwh n HIS 61 Cb 0.00 -2.56 0.11 0.00 1.12 0.00 0.00 29.99 28.67 1gwh n HIS 61 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1gwh h ALA 62 N 0.45 0.98 -2.51 -1.41 0.00 -1.70 -3.41 119.26 111.65 1gwh h ALA 62 Ca -0.24 0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.05 1gwh h ALA 62 Cb 1.16 -0.15 -0.15 0.00 0.00 0.00 0.00 17.79 18.66 1gwh h ALA 62 CO 0.25 0.10 -0.09 0.21 0.00 0.00 0.00 179.25 179.72 1gwh s LYS 63 N -6.08 3.73 0.10 0.00 2.47 -1.25 -4.66 119.74 114.05 1gwh s LYS 63 Ca -0.13 -0.08 -0.26 0.00 -1.56 0.00 0.00 55.97 53.94 1gwh s LYS 63 Cb 0.17 -3.76 0.09 0.00 -1.46 0.00 0.00 37.83 32.86 1gwh s LYS 63 CO 0.77 -0.54 1.11 0.20 0.16 0.00 0.00 175.35 177.05 1gwh s GLY 64 N 1.71 -0.12 0.35 5.54 0.00 -1.26 -1.55 107.32 111.99 1gwh s GLY 64 Ca 0.18 0.05 -0.16 0.00 0.00 0.00 0.00 44.72 44.79 1gwh s GLY 64 CO 0.12 1.83 0.74 -0.45 0.00 0.00 0.00 173.10 175.34 1gwh s SER 65 N -3.26 0.00 0.00 1.64 0.15 -0.54 -4.99 113.70 106.70 1gwh s SER 65 Ca 0.19 -1.04 0.00 0.00 0.70 0.00 0.00 55.95 55.80 1gwh s SER 65 Cb -0.00 0.80 0.00 0.00 -1.71 0.00 0.00 66.02 65.11 1gwh s SER 65 CO 0.02 -1.57 0.00 0.61 1.20 0.00 0.00 173.24 173.49 1gwh n GLY 66 N -0.51 1.63 3.46 9.45 0.00 -1.26 -0.23 105.19 117.72 1gwh n GLY 66 Ca -0.07 -0.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.91 1gwh n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gwh s ALA 67 N -1.00 -1.56 0.33 4.61 0.00 -0.73 -4.53 121.76 118.89 1gwh s ALA 67 Ca 0.00 0.41 0.01 0.00 0.00 0.00 0.00 51.96 52.38 1gwh s ALA 67 Cb 0.00 0.88 -0.03 0.00 0.00 0.00 0.00 23.12 23.97 1gwh s ALA 67 CO 0.00 -0.79 0.52 -0.06 0.00 0.00 0.00 175.76 175.43 1gwh s PHE 68 N -3.77 3.49 0.00 0.00 0.40 0.57 -1.29 117.98 117.39 1gwh s PHE 68 Ca 0.02 0.33 0.00 0.00 -0.60 0.00 0.00 56.93 56.68 1gwh s PHE 68 Cb -0.01 -1.87 0.00 0.00 0.51 0.00 0.00 43.02 41.64 1gwh s PHE 68 CO -0.11 0.17 0.00 0.41 0.70 0.00 0.00 175.22 176.38 1gwh n GLY 69 N -1.65 2.68 3.21 4.36 0.00 -0.31 -1.18 105.19 112.30 1gwh n GLY 69 Ca -0.05 -0.49 -0.13 0.00 0.00 0.00 0.00 46.02 45.35 1gwh n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1gwh s GLU 70 N 1.74 0.47 -0.12 1.61 2.12 -0.10 -1.11 118.70 123.30 1gwh s GLU 70 Ca 0.00 0.20 0.01 0.00 0.36 0.00 0.00 54.97 55.54 1gwh s GLU 70 Cb 0.00 0.22 -0.01 0.00 0.26 0.00 0.00 34.13 34.60 1gwh s GLU 70 CO 0.00 -0.09 -0.16 0.12 -0.54 0.00 0.00 175.26 174.59 1gwh s PHE 71 N -0.37 2.74 -0.15 5.30 5.36 0.16 -0.90 117.98 130.13 1gwh s PHE 71 Ca -0.05 -0.78 0.01 0.00 -0.96 0.00 0.00 56.93 55.15 1gwh s PHE 71 Cb -0.03 -1.81 0.00 0.00 -0.34 0.00 0.00 43.02 40.83 1gwh s PHE 71 CO 0.02 -0.29 -0.18 -2.00 -1.46 0.00 0.00 175.22 171.31 1gwh s GLU 72 N 0.38 3.15 -0.10 10.12 2.12 -0.55 -0.92 118.70 132.91 1gwh s GLU 72 Ca -0.13 -0.79 -0.30 0.00 0.36 0.00 0.00 54.97 54.12 1gwh s GLU 72 Cb -0.16 -2.55 -0.01 0.00 0.26 0.00 0.00 34.13 31.66 1gwh s GLU 72 CO 0.06 0.02 1.00 0.08 -0.54 0.00 0.00 175.26 175.89 1gwh s VAL 73 N 0.77 4.79 -0.12 3.70 1.01 -0.62 -1.32 120.40 128.61 1gwh s VAL 73 Ca -0.07 2.04 0.01 0.00 0.00 0.00 0.00 61.98 63.97 1gwh s VAL 73 Cb -0.16 -4.31 -0.00 0.00 0.00 0.00 0.00 36.38 31.91 1gwh s VAL 73 CO 0.00 0.01 0.30 0.35 0.00 0.00 0.00 175.10 175.77 1gwh n THR 74 N 4.53 0.00 -4.54 3.92 -2.24 -0.65 -3.51 114.28 111.79 1gwh n THR 74 Ca 0.09 -0.49 -0.25 0.00 -2.27 0.00 0.00 64.05 61.13 1gwh n THR 74 Cb 0.49 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.63 1gwh n THR 74 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1gwh s GLU 75 N -0.60 1.82 -0.42 -0.78 0.41 -0.89 -4.99 118.70 113.26 1gwh s GLU 75 Ca 0.01 -2.05 -0.09 0.00 -0.41 0.00 0.00 54.97 52.44 1gwh s GLU 75 Cb 0.01 -1.12 0.08 0.00 -1.78 0.00 0.00 34.13 31.32 1gwh s GLU 75 CO 0.03 -0.20 0.25 0.34 -0.49 0.00 0.00 175.26 175.20 1gwh s ASP 76 N -3.60 5.61 -0.20 -0.19 -1.08 -1.26 -4.58 116.67 111.36 1gwh s ASP 76 Ca 0.32 -1.52 0.14 0.00 -0.52 0.00 0.00 52.55 50.97 1gwh s ASP 76 Cb 0.08 -1.98 0.44 0.00 -1.46 0.00 0.00 42.92 40.00 1gwh s ASP 76 CO 0.15 -0.53 1.33 1.33 0.52 0.00 0.00 175.17 177.96 1gwh n VAL 77 N 4.90 2.24 0.25 1.11 0.24 -1.26 -4.73 118.33 121.08 1gwh n VAL 77 Ca -0.10 -2.46 0.12 0.00 -2.04 0.00 0.00 64.34 59.86 1gwh n VAL 77 Cb 0.43 -0.27 0.67 0.00 -1.47 0.00 0.00 33.84 33.20 1gwh n VAL 77 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1gwh h SER 78 N 0.94 0.00 0.61 -1.34 4.64 -1.83 -0.49 113.55 116.09 1gwh h SER 78 Ca 0.06 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 1gwh h SER 78 Cb 1.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1gwh h SER 78 CO 0.17 0.14 -0.06 0.07 -0.87 0.00 0.00 176.83 176.28 1gwh h LYS 79 N 0.00 0.00 0.00 4.77 2.10 -1.99 -3.23 116.57 118.22 1gwh h LYS 79 Ca -0.00 0.00 -0.35 0.00 -2.00 0.00 0.00 60.65 58.29 1gwh h LYS 79 Cb 0.39 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.66 1gwh h LYS 79 CO 0.02 0.06 -2.25 0.66 -2.00 0.00 0.00 179.45 175.94 1gwh n TYR 80 N -3.28 0.22 -3.84 0.07 4.02 -0.21 -4.75 117.16 109.38 1gwh n TYR 80 Ca -0.01 0.08 -0.12 0.00 -0.01 0.00 0.00 57.90 57.84 1gwh n TYR 80 Cb 0.25 -1.04 -0.10 0.00 -0.02 0.00 0.00 39.34 38.43 1gwh n TYR 80 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1gwh s THR 81 N -2.51 0.06 -2.30 -0.72 -1.32 -1.08 -3.44 115.64 104.33 1gwh s THR 81 Ca -0.10 -0.48 0.27 0.00 -1.21 0.00 0.00 61.69 60.17 1gwh s THR 81 Cb 0.07 -0.42 0.37 0.00 -1.51 0.00 0.00 72.50 71.01 1gwh s THR 81 CO 0.82 -0.26 1.57 2.29 -2.21 0.00 0.00 174.62 176.83 1gwh n LYS 82 N 1.83 1.46 -1.69 7.08 2.85 -0.59 -4.44 118.16 124.66 1gwh n LYS 82 Ca -0.20 -0.95 -0.44 0.00 -1.05 0.00 0.00 58.31 55.67 1gwh n LYS 82 Cb 0.56 -1.48 -0.03 0.00 -0.65 0.00 0.00 35.03 33.43 1gwh n LYS 82 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1gwh n ALA 83 N 0.06 2.15 -0.27 0.58 0.00 -1.23 -4.84 120.51 116.96 1gwh n ALA 83 Ca 0.15 0.38 0.02 0.00 0.00 0.00 0.00 53.44 54.00 1gwh n ALA 83 Cb 0.40 -2.49 0.23 0.00 0.00 0.00 0.00 19.45 17.58 1gwh n ALA 83 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1gwh h LEU 84 N 7.16 0.91 -2.25 0.00 3.38 -1.94 -2.16 115.31 120.43 1gwh h LEU 84 Ca -0.45 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.54 1gwh h LEU 84 Cb 1.23 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.76 1gwh h LEU 84 CO 0.94 0.63 0.10 1.62 0.09 0.00 0.00 178.44 181.81 1gwh h VAL 85 N 1.06 0.63 -0.26 1.22 3.04 -1.94 -2.56 116.25 117.45 1gwh h VAL 85 Ca 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.02 1gwh h VAL 85 Cb 0.01 0.93 0.00 0.00 -2.01 0.00 0.00 31.29 30.22 1gwh h VAL 85 CO -0.10 0.00 0.00 0.49 -1.01 0.00 0.00 177.57 176.95 1gwh n PHE 86 N -4.03 0.80 -2.53 3.17 3.72 -0.81 -4.81 117.46 112.96 1gwh n PHE 86 Ca -0.01 -0.82 -0.32 0.00 -0.05 0.00 0.00 57.45 56.25 1gwh n PHE 86 Cb 0.20 -0.26 -0.05 0.00 -0.94 0.00 0.00 39.48 38.44 1gwh n PHE 86 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1gwh s GLN 87 N -2.51 4.04 0.13 -1.08 -1.52 -0.97 -4.56 119.66 113.20 1gwh s GLN 87 Ca 0.38 1.01 -0.35 0.00 -1.95 0.00 0.00 55.36 54.45 1gwh s GLN 87 Cb 0.30 -2.15 -0.16 0.00 -0.22 0.00 0.00 33.01 30.78 1gwh s GLN 87 CO 0.09 -0.20 1.29 -2.30 -0.25 0.00 0.00 175.29 173.93 1gwh n PRO 88 N -1.28 1.29 -0.74 2.91 -0.02 -1.26 -2.01 135.00 133.89 1gwh n PRO 88 Ca 0.07 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1gwh n PRO 88 Cb 0.54 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1gwh n PRO 88 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gwh n GLY 89 N 2.37 1.33 3.73 -1.23 0.00 -1.23 -4.99 105.19 105.17 1gwh n GLY 89 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1gwh n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gwh s THR 90 N -3.55 3.69 -0.11 2.61 2.01 -0.85 -4.73 115.64 114.72 1gwh s THR 90 Ca 0.00 1.36 0.00 0.00 0.31 0.00 0.00 61.69 63.36 1gwh s THR 90 Cb 0.00 -3.87 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 1gwh s THR 90 CO 0.00 0.18 -0.12 -0.54 -0.69 0.00 0.00 174.62 173.45 1gwh s LYS 91 N 0.15 3.17 -0.03 4.92 1.02 -1.26 -1.59 119.74 126.12 1gwh s LYS 91 Ca 0.55 -0.66 0.01 0.00 0.02 0.00 0.00 55.97 55.89 1gwh s LYS 91 Cb -0.32 -2.60 0.01 0.00 -0.52 0.00 0.00 37.83 34.41 1gwh s LYS 91 CO 0.34 0.34 -0.05 0.99 -0.92 0.00 0.00 175.35 176.06 1gwh s THR 92 N 0.02 0.49 0.39 2.17 2.01 -0.09 -4.97 115.64 115.65 1gwh s THR 92 Ca -0.04 -0.15 -0.27 0.00 0.31 0.00 0.00 61.69 61.55 1gwh s THR 92 Cb -0.14 -0.49 -0.09 0.00 0.01 0.00 0.00 72.50 71.78 1gwh s THR 92 CO 0.04 0.19 1.36 -0.70 -0.69 0.00 0.00 174.62 174.83 1gwh s GLU 93 N 0.61 4.04 0.19 4.92 2.12 -1.26 -0.66 118.70 128.66 1gwh s GLU 93 Ca -0.08 2.30 0.04 0.00 0.36 0.00 0.00 54.97 57.60 1gwh s GLU 93 Cb -0.11 -2.86 -0.05 0.00 0.26 0.00 0.00 34.13 31.37 1gwh s GLU 93 CO -0.00 -0.48 -0.04 0.95 -0.54 0.00 0.00 175.26 175.14 1gwh s THR 94 N -1.19 1.07 -0.03 -1.70 -4.23 -0.27 -1.27 115.64 108.02 1gwh s THR 94 Ca 0.55 -2.04 0.01 0.00 -1.18 0.00 0.00 61.69 59.03 1gwh s THR 94 Cb -0.41 -2.13 0.01 0.00 1.34 0.00 0.00 72.50 71.32 1gwh s THR 94 CO 0.54 -0.51 -0.04 -0.22 -0.54 0.00 0.00 174.62 173.86 1gwh s LEU 95 N -3.24 1.52 -0.09 4.79 2.96 -0.75 -1.16 118.68 122.71 1gwh s LEU 95 Ca 0.23 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1gwh s LEU 95 Cb 0.04 -0.34 0.02 0.00 0.50 0.00 0.00 46.19 46.41 1gwh s LEU 95 CO 0.05 -0.02 -0.09 -0.22 -1.32 0.00 0.00 176.35 174.74 1gwh s LEU 96 N 0.58 1.39 -0.17 -0.68 0.20 -0.41 -0.50 118.68 119.10 1gwh s LEU 96 Ca -0.07 -0.29 -0.03 0.00 0.69 0.00 0.00 54.13 54.43 1gwh s LEU 96 Cb -0.10 -0.81 -0.02 0.00 -0.43 0.00 0.00 46.19 44.82 1gwh s LEU 96 CO -0.00 -0.05 -0.05 -0.60 -0.29 0.00 0.00 176.35 175.36 1gwh s ARG 97 N 1.22 3.57 0.19 1.98 3.52 -0.28 -1.76 118.95 127.38 1gwh s ARG 97 Ca -0.04 -0.57 0.04 0.00 -0.13 0.00 0.00 55.73 55.03 1gwh s ARG 97 Cb -0.14 -2.90 -0.03 0.00 -1.56 0.00 0.00 34.95 30.32 1gwh s ARG 97 CO -0.03 0.14 0.28 -0.06 -0.81 0.00 0.00 175.30 174.82 1gwh s PHE 98 N 0.60 3.38 0.04 5.12 0.40 0.68 -1.42 117.98 126.78 1gwh s PHE 98 Ca -0.03 0.03 -0.27 0.00 -0.60 0.00 0.00 56.93 56.05 1gwh s PHE 98 Cb -0.15 -1.58 0.09 0.00 0.51 0.00 0.00 43.02 41.89 1gwh s PHE 98 CO 0.03 0.49 0.84 -1.54 0.70 0.00 0.00 175.22 175.74 1gwh s SER 99 N -3.51 -0.39 0.54 1.36 1.04 -1.19 -1.46 113.70 110.10 1gwh s SER 99 Ca 0.34 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.73 1gwh s SER 99 Cb -0.10 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1gwh s SER 99 CO 0.27 -0.71 0.00 0.35 0.98 0.00 0.00 173.24 174.13 1gwh n THR 100 N -0.29 0.00 -0.02 2.02 -2.24 -0.59 -0.27 114.28 112.89 1gwh n THR 100 Ca -0.10 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.61 1gwh n THR 100 Cb 0.62 -1.55 -0.02 0.00 -2.10 0.00 0.00 70.33 67.28 1gwh n THR 100 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1gwh n VAL 101 N -1.53 0.93 0.08 2.28 0.31 -1.22 -3.85 118.33 115.33 1gwh n VAL 101 Ca 0.00 0.10 -0.20 0.00 -0.01 0.00 0.00 64.34 64.23 1gwh n VAL 101 Cb 0.00 -1.74 -0.15 0.00 -0.91 0.00 0.00 33.84 31.04 1gwh n VAL 101 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1gwh h ALA 102 N -0.34 0.18 -2.40 3.52 0.00 -1.90 -0.98 119.26 117.34 1gwh h ALA 102 Ca -0.12 -1.09 -0.50 0.00 0.00 0.00 0.00 54.91 53.20 1gwh h ALA 102 Cb 0.77 0.33 0.08 0.00 0.00 0.00 0.00 17.79 18.97 1gwh h ALA 102 CO -0.07 1.05 0.38 0.20 0.00 0.00 0.00 179.25 180.81 1gwh s GLY 103 N -4.97 2.17 0.71 0.00 0.00 -1.26 -4.86 107.32 99.11 1gwh s GLY 103 Ca -0.11 0.48 -0.08 0.00 0.00 0.00 0.00 44.72 45.00 1gwh s GLY 103 CO 0.86 0.81 0.97 1.18 0.00 0.00 0.00 173.10 176.92 1gwh n GLU 104 N -2.11 -0.61 -1.67 2.90 4.71 -1.26 -3.96 120.64 118.63 1gwh n GLU 104 Ca 0.09 -1.88 -0.45 0.00 -0.01 0.00 0.00 57.16 54.92 1gwh n GLU 104 Cb 0.52 -0.87 -0.03 0.00 -1.01 0.00 0.00 31.44 30.05 1gwh n GLU 104 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1gwh n LEU 105 N 0.00 3.15 0.00 -4.62 7.94 -1.26 -1.50 117.00 120.70 1gwh n LEU 105 Ca 0.13 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.17 1gwh n LEU 105 Cb 0.47 -1.43 0.00 0.00 0.53 0.00 0.00 43.42 42.99 1gwh n LEU 105 CO 0.33 -0.44 0.00 0.61 -1.11 0.00 0.00 177.39 176.78 1gwh n GLY 106 N 2.31 2.36 3.72 -3.96 0.00 -1.26 -5.01 105.19 103.35 1gwh n GLY 106 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1gwh n GLY 106 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gwh n SER 107 N 0.00 1.93 -4.77 1.61 3.41 -0.56 -4.91 113.62 110.33 1gwh n SER 107 Ca 0.00 0.83 -0.40 0.00 -0.26 0.00 0.00 58.87 59.04 1gwh n SER 107 Cb 0.00 -1.54 0.02 0.00 -0.26 0.00 0.00 64.21 62.43 1gwh n SER 107 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 1gwh s PRO 108 N -3.30 3.68 0.44 4.33 0.02 -1.26 -4.89 135.00 134.02 1gwh s PRO 108 Ca 0.82 2.44 0.19 0.00 0.02 0.00 0.00 61.00 64.48 1gwh s PRO 108 Cb -0.38 -2.66 1.03 0.00 0.02 0.00 0.00 34.50 32.51 1gwh s PRO 108 CO 0.41 -0.83 1.93 -0.44 -0.33 0.00 0.00 177.00 177.74 1gwh h ASP 109 N 2.33 0.00 -0.94 2.53 3.32 -0.93 -3.27 116.42 119.46 1gwh h ASP 109 Ca -0.51 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.07 1gwh h ASP 109 Cb 1.27 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 40.54 1gwh h ASP 109 CO 0.61 0.24 0.59 0.35 -1.72 0.00 0.00 179.24 179.32 1gwh n THR 110 N -3.87 3.12 -2.22 0.35 -2.24 -1.26 -4.93 114.28 103.22 1gwh n THR 110 Ca -0.02 -1.83 -0.35 0.00 -2.27 0.00 0.00 64.05 59.58 1gwh n THR 110 Cb 0.33 -0.47 0.01 0.00 -2.10 0.00 0.00 70.33 68.10 1gwh n THR 110 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1gwh s TRP 111 N -3.18 2.67 -0.01 4.78 0.52 -1.24 -4.63 118.94 117.85 1gwh s TRP 111 Ca 0.55 1.54 -0.30 0.00 0.02 0.00 0.00 56.10 57.92 1gwh s TRP 111 Cb 0.46 -3.28 -0.06 0.00 -1.15 0.00 0.00 33.47 29.45 1gwh s TRP 111 CO 0.11 -1.58 1.46 0.50 0.02 0.00 0.00 176.95 177.46 1gwh s ARG 112 N -3.35 4.25 -0.03 4.98 3.52 -0.93 -4.87 118.95 122.53 1gwh s ARG 112 Ca 0.72 2.03 -0.31 0.00 -0.13 0.00 0.00 55.73 58.05 1gwh s ARG 112 Cb -0.24 -3.64 0.12 0.00 -1.56 0.00 0.00 34.95 29.63 1gwh s ARG 112 CO 0.28 -0.64 1.22 0.34 -0.81 0.00 0.00 175.30 175.69 1gwh s ASP 113 N 2.15 -0.10 0.54 -2.12 3.68 -1.04 -4.96 116.67 114.81 1gwh s ASP 113 Ca 0.66 -0.14 -0.19 0.00 2.13 0.00 0.00 52.55 55.01 1gwh s ASP 113 Cb -0.32 0.20 -0.06 0.00 -1.45 0.00 0.00 42.92 41.29 1gwh s ASP 113 CO 0.27 -0.37 1.12 -0.69 0.13 0.00 0.00 175.17 175.63 1gwh s VAL 114 N -2.55 3.24 -0.04 1.11 1.01 -1.26 -4.69 120.40 117.21 1gwh s VAL 114 Ca 0.13 0.77 0.04 0.00 0.00 0.00 0.00 61.98 62.91 1gwh s VAL 114 Cb 0.03 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 1gwh s VAL 114 CO -0.03 -0.17 -0.14 -0.13 0.00 0.00 0.00 175.10 174.62 1gwh s ARG 115 N -3.31 2.50 0.40 2.72 3.00 -1.26 -3.46 118.95 119.54 1gwh s ARG 115 Ca 0.72 -0.70 -0.16 0.00 0.00 0.00 0.00 55.73 55.59 1gwh s ARG 115 Cb -0.23 -2.38 -0.09 0.00 0.00 0.00 0.00 34.95 32.25 1gwh s ARG 115 CO 0.27 0.62 0.85 0.20 0.00 0.00 0.00 175.30 177.24 1gwh s GLY 116 N -0.79 2.24 -0.42 -3.53 0.00 0.63 -0.17 107.32 105.28 1gwh s GLY 116 Ca 0.12 0.14 0.04 0.00 0.00 0.00 0.00 44.72 45.02 1gwh s GLY 116 CO 0.01 0.37 0.39 -0.12 0.00 0.00 0.00 173.10 173.75 1gwh s PHE 117 N -2.22 0.76 -0.34 1.90 2.19 -0.37 -3.15 117.98 116.74 1gwh s PHE 117 Ca 0.57 -2.12 -0.12 0.00 0.33 0.00 0.00 56.93 55.59 1gwh s PHE 117 Cb -0.10 -0.76 -0.01 0.00 -1.31 0.00 0.00 43.02 40.84 1gwh s PHE 117 CO 0.21 -0.88 0.22 0.00 1.83 0.00 0.00 175.22 176.60 1gwh s ALA 118 N 0.16 3.44 -0.14 11.12 0.00 -0.51 -0.71 121.76 135.13 1gwh s ALA 118 Ca 0.33 -1.41 0.02 0.00 0.00 0.00 0.00 51.96 50.90 1gwh s ALA 118 Cb 0.04 -2.61 0.01 0.00 0.00 0.00 0.00 23.12 20.56 1gwh s ALA 118 CO -0.18 -0.99 -0.18 -1.17 0.00 0.00 0.00 175.76 173.24 1gwh s LEU 119 N 1.69 1.93 -0.09 0.00 2.96 -0.41 -1.13 118.68 123.63 1gwh s LEU 119 Ca 0.06 -0.54 -0.01 0.00 -0.22 0.00 0.00 54.13 53.42 1gwh s LEU 119 Cb -0.17 -1.30 -0.03 0.00 0.50 0.00 0.00 46.19 45.18 1gwh s LEU 119 CO 0.09 0.03 -0.06 -0.60 -1.32 0.00 0.00 176.35 174.49 1gwh s ARG 120 N 1.05 3.03 -0.18 1.98 3.52 0.35 -0.17 118.95 128.52 1gwh s ARG 120 Ca -0.03 -0.53 -0.02 0.00 -0.13 0.00 0.00 55.73 55.01 1gwh s ARG 120 Cb -0.15 -2.69 -0.01 0.00 -1.56 0.00 0.00 34.95 30.54 1gwh s ARG 120 CO -0.05 0.54 -0.08 -0.06 -0.81 0.00 0.00 175.30 174.84 1gwh s PHE 121 N -0.47 2.90 -1.17 5.12 0.40 0.19 -1.81 117.98 123.14 1gwh s PHE 121 Ca 0.07 -0.82 -0.16 0.00 -0.60 0.00 0.00 56.93 55.42 1gwh s PHE 121 Cb -0.12 -1.99 0.14 0.00 0.51 0.00 0.00 43.02 41.56 1gwh s PHE 121 CO 0.02 -0.40 1.45 0.71 0.70 0.00 0.00 175.22 177.70 1gwh s TYR 122 N 0.98 3.24 0.56 0.36 2.02 -0.39 -1.07 117.35 123.04 1gwh s TYR 122 Ca -0.01 -1.84 -0.04 0.00 -0.37 0.00 0.00 57.07 54.81 1gwh s TYR 122 Cb -0.15 -4.42 0.01 0.00 -0.40 0.00 0.00 41.96 36.99 1gwh s TYR 122 CO -0.00 -1.53 0.85 0.95 -1.57 0.00 0.00 175.55 174.25 1gwh s THR 123 N 2.49 3.74 -0.54 -0.71 -4.23 -0.82 -4.53 115.64 111.05 1gwh s THR 123 Ca 0.44 -0.11 0.20 0.00 -1.18 0.00 0.00 61.69 61.04 1gwh s THR 123 Cb -0.02 -3.46 0.21 0.00 1.34 0.00 0.00 72.50 70.57 1gwh s THR 123 CO -0.00 -0.44 1.62 -0.62 -0.54 0.00 0.00 174.62 174.63 1gwh n GLU 124 N -2.47 0.14 -0.73 3.99 -0.58 -1.26 -2.67 120.64 117.06 1gwh n GLU 124 Ca 0.04 0.44 0.04 0.00 -0.42 0.00 0.00 57.16 57.27 1gwh n GLU 124 Cb 0.58 -1.81 0.19 0.00 -0.57 0.00 0.00 31.44 29.83 1gwh n GLU 124 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1gwh n GLU 125 N -2.08 1.58 0.00 3.49 2.13 -1.26 -4.68 120.64 119.82 1gwh n GLU 125 Ca 0.01 -3.26 0.00 0.00 0.66 0.00 0.00 57.16 54.57 1gwh n GLU 125 Cb 0.17 -1.54 0.00 0.00 0.27 0.00 0.00 31.44 30.33 1gwh n GLU 125 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1gwh n GLY 126 N -0.99 2.22 3.68 8.31 0.00 -1.09 -4.74 105.19 112.57 1gwh n GLY 126 Ca 0.19 -2.13 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1gwh n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gwh s ASN 127 N 0.00 7.21 -0.29 1.61 0.01 -1.26 -1.94 114.94 120.28 1gwh s ASN 127 Ca 0.00 1.49 -0.08 0.00 -0.71 0.00 0.00 52.86 53.57 1gwh s ASN 127 Cb 0.00 -2.55 -0.00 0.00 0.41 0.00 0.00 41.25 39.11 1gwh s ASN 127 CO 0.00 -0.50 0.10 -0.47 -1.51 0.00 0.00 177.10 174.72 1gwh s TYR 128 N 2.30 3.14 -0.20 2.20 5.04 -0.23 -4.53 117.35 125.07 1gwh s TYR 128 Ca 0.47 -0.76 -0.06 0.00 -2.44 0.00 0.00 57.07 54.28 1gwh s TYR 128 Cb -0.17 -2.28 -0.03 0.00 0.35 0.00 0.00 41.96 39.83 1gwh s TYR 128 CO 0.15 -0.50 0.02 -0.51 -1.34 0.00 0.00 175.55 173.37 1gwh s ASP 129 N 1.55 5.04 -0.46 4.32 -0.00 -0.63 -0.64 116.67 125.86 1gwh s ASP 129 Ca 0.04 -0.13 -0.03 0.00 -0.00 0.00 0.00 52.55 52.42 1gwh s ASP 129 Cb -0.17 -1.86 0.12 0.00 -0.00 0.00 0.00 42.92 41.01 1gwh s ASP 129 CO 0.04 0.08 0.27 -0.22 -0.00 0.00 0.00 175.17 175.34 1gwh s LEU 130 N 0.89 5.30 -0.70 1.23 1.98 0.76 -4.62 118.68 123.52 1gwh s LEU 130 Ca 0.02 -2.18 -0.14 0.00 -2.89 0.00 0.00 54.13 48.93 1gwh s LEU 130 Cb -0.14 -1.85 0.18 0.00 0.66 0.00 0.00 46.19 45.04 1gwh s LEU 130 CO 0.02 -0.52 0.64 -0.69 -1.89 0.00 0.00 176.35 173.91 1gwh s VAL 131 N 0.92 5.38 0.26 1.68 1.01 -1.26 -1.28 120.40 127.10 1gwh s VAL 131 Ca 0.10 -2.08 0.03 0.00 0.00 0.00 0.00 61.98 60.03 1gwh s VAL 131 Cb -0.23 -4.38 0.03 0.00 0.00 0.00 0.00 36.38 31.80 1gwh s VAL 131 CO -0.04 -0.96 0.22 0.61 0.00 0.00 0.00 175.10 174.94 1gwh n GLY 132 N 4.49 2.73 3.49 4.51 0.00 0.11 -4.96 105.19 115.56 1gwh n GLY 132 Ca 0.02 -2.22 -0.25 0.00 0.00 0.00 0.00 46.02 43.57 1gwh n GLY 132 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gwh s ASN 133 N -2.53 2.70 -0.13 1.61 0.01 -0.91 -1.24 114.94 114.45 1gwh s ASN 133 Ca 0.17 -1.72 0.05 0.00 -0.71 0.00 0.00 52.86 50.65 1gwh s ASN 133 Cb -0.01 0.56 0.34 0.00 0.41 0.00 0.00 41.25 42.55 1gwh s ASN 133 CO 0.11 -0.98 1.14 -0.46 -1.51 0.00 0.00 177.10 175.39 1gwh n ASN 134 N -1.41 3.13 -3.91 -1.22 6.94 0.77 -0.78 115.26 118.79 1gwh n ASN 134 Ca -0.04 -2.48 -0.11 0.00 -0.02 0.00 0.00 54.58 51.93 1gwh n ASN 134 Cb 0.64 -0.60 -0.12 0.00 -2.36 0.00 0.00 39.78 37.34 1gwh n ASN 134 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1gwh s THR 135 N -1.68 0.06 -1.26 5.53 -1.32 -1.26 -4.77 115.64 110.94 1gwh s THR 135 Ca 0.24 -0.46 0.27 0.00 -1.21 0.00 0.00 61.69 60.53 1gwh s THR 135 Cb 0.19 -0.20 0.38 0.00 -1.51 0.00 0.00 72.50 71.36 1gwh s THR 135 CO 0.06 -0.25 1.91 -0.81 -2.21 0.00 0.00 174.62 173.32 1gwh n PRO 136 N 2.25 0.23 -4.51 7.08 -0.04 -1.26 -4.50 135.00 134.25 1gwh n PRO 136 Ca -0.18 0.03 -0.25 0.00 -0.04 0.00 0.00 63.50 63.06 1gwh n PRO 136 Cb 0.57 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 1gwh n PRO 136 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1gwh s ILE 137 N -2.74 0.78 0.31 0.52 -4.36 -1.26 -4.29 121.20 110.16 1gwh s ILE 137 Ca 0.21 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.63 1gwh s ILE 137 Cb 0.18 -2.45 -0.03 0.00 1.25 0.00 0.00 42.46 41.41 1gwh s ILE 137 CO 0.45 0.00 0.18 0.12 0.24 0.00 0.00 174.94 175.92 1gwh s PHE 138 N -3.21 1.62 -0.27 1.37 5.36 -0.73 -4.98 117.98 117.15 1gwh s PHE 138 Ca 0.26 -1.42 0.28 0.00 -0.96 0.00 0.00 56.93 55.09 1gwh s PHE 138 Cb 0.04 -0.84 0.97 0.00 -0.34 0.00 0.00 43.02 42.84 1gwh s PHE 138 CO 0.14 -0.57 1.81 0.74 -1.46 0.00 0.00 175.22 175.88 1gwh h PHE 139 N 2.18 0.00 -4.14 10.12 -1.00 -1.88 -3.39 116.94 118.83 1gwh h PHE 139 Ca -0.32 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.32 1gwh h PHE 139 Cb 1.25 0.00 -0.17 0.00 3.61 0.00 0.00 35.95 40.64 1gwh h PHE 139 CO 1.17 0.00 -0.69 -0.51 -1.61 0.00 0.00 178.31 176.67 1gwh s LEU 140 N -5.59 2.42 0.00 1.54 1.43 -1.26 -2.63 118.68 114.59 1gwh s LEU 140 Ca 0.04 -0.85 0.00 0.00 -1.03 0.00 0.00 54.13 52.29 1gwh s LEU 140 Cb 0.09 0.15 0.00 0.00 0.03 0.00 0.00 46.19 46.46 1gwh s LEU 140 CO 0.55 -0.50 0.73 -2.11 0.23 0.00 0.00 176.35 175.25 1gwh n ARG 141 N 0.54 0.89 -3.77 1.70 1.85 -1.26 -4.51 116.66 112.09 1gwh n ARG 141 Ca -0.17 -0.97 -0.15 0.00 -1.00 0.00 0.00 57.85 55.56 1gwh n ARG 141 Cb 0.59 -1.00 -0.16 0.00 -1.05 0.00 0.00 32.46 30.84 1gwh n ARG 141 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1gwh s ASP 142 N -0.47 0.07 0.26 2.89 2.15 -1.26 -4.24 116.67 116.08 1gwh s ASP 142 Ca 0.00 0.04 0.23 0.00 0.43 0.00 0.00 52.55 53.24 1gwh s ASP 142 Cb 0.00 -0.07 0.99 0.00 -0.30 0.00 0.00 42.92 43.54 1gwh s ASP 142 CO 0.00 -0.13 1.69 -0.81 -0.17 0.00 0.00 175.17 175.75 1gwh n PRO 143 N 4.17 0.18 0.26 4.34 -0.04 -1.26 -2.06 135.00 140.59 1gwh n PRO 143 Ca -0.28 0.46 0.09 0.00 -0.04 0.00 0.00 63.50 63.73 1gwh n PRO 143 Cb 0.50 -1.87 0.67 0.00 -0.04 0.00 0.00 33.50 32.76 1gwh n PRO 143 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1gwh h MET 144 N 0.00 0.00 0.00 0.54 4.05 -1.96 -2.25 114.93 115.31 1gwh h MET 144 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1gwh h MET 144 Cb 0.29 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.09 1gwh h MET 144 CO 0.00 0.05 -0.26 1.63 0.23 0.00 0.00 176.91 178.56 1gwh n LYS 145 N -4.31 0.12 -0.18 0.39 5.02 -0.87 -4.21 118.16 114.12 1gwh n LYS 145 Ca -0.03 0.07 -0.09 0.00 -2.02 0.00 0.00 58.31 56.24 1gwh n LYS 145 Cb 0.13 -1.61 0.04 0.00 -0.02 0.00 0.00 35.03 33.57 1gwh n LYS 145 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1gwh h PHE 146 N 0.00 1.11 -0.27 2.13 3.04 -1.55 -1.26 116.94 120.15 1gwh h PHE 146 Ca 0.00 -0.22 -0.02 0.00 3.98 0.00 0.00 57.97 61.71 1gwh h PHE 146 Cb 0.61 -0.28 -0.01 0.00 2.56 0.00 0.00 35.95 38.83 1gwh h PHE 146 CO 0.00 1.03 0.11 1.79 -2.02 0.00 0.00 178.31 179.22 1gwh h THR 147 N 0.90 1.18 -0.45 4.41 1.35 -1.75 -1.40 112.91 117.14 1gwh h THR 147 Ca 0.14 -0.54 0.04 0.00 -0.55 0.00 0.00 66.41 65.50 1gwh h THR 147 Cb 0.65 1.02 -0.04 0.00 -1.73 0.00 0.00 68.15 68.05 1gwh h THR 147 CO 0.04 0.18 0.22 0.45 -0.25 0.00 0.00 175.52 176.16 1gwh h HIS 148 N 0.29 0.39 0.15 4.73 3.86 -1.75 -1.61 115.15 121.22 1gwh h HIS 148 Ca 0.09 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.33 1gwh h HIS 148 Cb 0.19 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.53 1gwh h HIS 148 CO -0.01 0.19 -0.19 0.35 0.86 0.00 0.00 177.93 179.14 1gwh h PHE 149 N 0.43 -0.49 -0.59 2.45 3.04 -0.93 -0.75 116.94 120.10 1gwh h PHE 149 Ca 0.20 0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.11 1gwh h PHE 149 Cb 0.13 0.19 -0.03 0.00 2.56 0.00 0.00 35.95 38.81 1gwh h PHE 149 CO -0.11 -0.28 0.19 0.82 -2.02 0.00 0.00 178.31 176.92 1gwh h ILE 150 N -0.39 1.24 -0.69 1.41 1.08 -1.14 -1.63 117.51 117.40 1gwh h ILE 150 Ca 0.01 -0.81 -0.01 0.00 -0.39 0.00 0.00 64.86 63.67 1gwh h ILE 150 Cb 0.38 0.64 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 1gwh h ILE 150 CO -0.07 0.31 0.40 0.03 -0.69 0.00 0.00 178.15 178.13 1gwh h ARG 151 N 0.84 0.94 0.00 2.37 3.08 -1.14 -1.87 114.38 118.60 1gwh h ARG 151 Ca 0.19 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.13 1gwh h ARG 151 Cb 0.27 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1gwh h ARG 151 CO -0.01 0.67 -0.15 0.66 -1.07 0.00 0.00 179.97 180.08 1gwh h SER 152 N 0.95 0.00 0.65 7.04 4.64 -0.23 -2.23 113.55 124.38 1gwh h SER 152 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1gwh h SER 152 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1gwh h SER 152 CO -0.04 0.15 -0.16 0.00 -0.87 0.00 0.00 176.83 175.90 1gwh n GLN 153 N -3.88 0.23 0.00 4.77 1.13 -0.74 -3.92 117.38 114.98 1gwh n GLN 153 Ca -0.02 -0.07 0.00 0.00 -1.94 0.00 0.00 57.00 54.97 1gwh n GLN 153 Cb 0.24 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.09 1gwh n GLN 153 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1gwh n LYS 154 N -1.32 0.00 -4.38 -1.09 5.02 -0.84 -4.89 118.16 110.65 1gwh n LYS 154 Ca 0.09 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.10 1gwh n LYS 154 Cb 0.31 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.21 1gwh n LYS 154 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1gwh s ARG 155 N 3.70 1.57 0.45 1.97 0.52 -1.26 -4.17 118.95 121.74 1gwh s ARG 155 Ca 0.00 -1.40 -0.24 0.00 -0.52 0.00 0.00 55.73 53.57 1gwh s ARG 155 Cb 0.00 -1.93 -0.08 0.00 0.52 0.00 0.00 34.95 33.46 1gwh s ARG 155 CO 0.00 0.43 1.29 -0.51 0.02 0.00 0.00 175.30 176.53 1gwh s LEU 156 N -2.41 4.09 0.41 2.53 1.43 0.33 -4.86 118.68 120.20 1gwh s LEU 156 Ca 0.19 2.61 0.14 0.00 -1.03 0.00 0.00 54.13 56.03 1gwh s LEU 156 Cb -0.09 -4.05 0.85 0.00 0.03 0.00 0.00 46.19 42.93 1gwh s LEU 156 CO 0.09 -1.03 1.90 1.55 0.23 0.00 0.00 176.35 179.10 1gwh h PRO 157 N 2.28 0.00 0.00 1.29 0.13 -1.98 -1.70 132.00 132.02 1gwh h PRO 157 Ca -0.50 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.45 1gwh h PRO 157 Cb 1.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 1gwh h PRO 157 CO 0.61 0.29 -1.12 -0.40 -0.23 0.00 0.00 178.00 177.14 1gwh n ASP 158 N -4.19 1.85 0.11 1.44 5.75 -1.26 -4.58 116.55 115.67 1gwh n ASP 158 Ca -0.02 0.47 0.12 0.00 -0.01 0.00 0.00 54.79 55.34 1gwh n ASP 158 Cb 0.33 -0.94 0.00 0.00 -1.03 0.00 0.00 41.12 39.48 1gwh n ASP 158 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1gwh h SER 159 N -1.00 0.00 -0.55 -1.12 4.64 -1.82 -3.48 113.55 110.22 1gwh h SER 159 Ca -0.28 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.88 1gwh h SER 159 Cb 1.14 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.18 1gwh h SER 159 CO -0.17 0.00 -0.16 0.61 -0.87 0.00 0.00 176.83 176.24 1gwh n GLY 160 N 1.18 0.75 3.75 -0.77 0.00 -0.64 -4.98 105.19 104.48 1gwh n GLY 160 Ca 0.00 -0.66 -0.32 0.00 0.00 0.00 0.00 46.02 45.04 1gwh n GLY 160 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gwh s LEU 161 N -1.88 3.72 0.54 0.99 1.43 -1.26 -4.74 118.68 117.49 1gwh s LEU 161 Ca 0.00 0.02 -0.20 0.00 -1.03 0.00 0.00 54.13 52.92 1gwh s LEU 161 Cb 0.00 -2.28 -0.06 0.00 0.03 0.00 0.00 46.19 43.88 1gwh s LEU 161 CO 0.00 0.23 1.13 -0.13 0.23 0.00 0.00 176.35 177.80 1gwh s ARG 162 N -2.00 3.38 -0.17 1.70 0.52 -1.26 -0.51 118.95 120.61 1gwh s ARG 162 Ca 0.25 1.61 -0.05 0.00 -0.52 0.00 0.00 55.73 57.02 1gwh s ARG 162 Cb -0.12 -2.01 0.08 0.00 0.52 0.00 0.00 34.95 33.42 1gwh s ARG 162 CO 0.17 -0.83 0.31 0.34 0.02 0.00 0.00 175.30 175.31 1gwh s ASP 163 N -1.77 0.31 0.47 0.23 2.15 -1.26 -4.59 116.67 112.21 1gwh s ASP 163 Ca 0.72 0.55 0.14 0.00 0.43 0.00 0.00 52.55 54.40 1gwh s ASP 163 Cb -0.24 0.87 1.08 0.00 -0.30 0.00 0.00 42.92 44.33 1gwh s ASP 163 CO 0.27 -0.26 2.05 0.00 -0.17 0.00 0.00 175.17 177.06 1gwh h ALA 164 N 8.25 1.80 -0.59 3.66 0.00 -1.67 -2.33 119.26 128.38 1gwh h ALA 164 Ca -0.15 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1gwh h ALA 164 Cb 1.12 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1gwh h ALA 164 CO 0.16 0.15 0.36 1.15 0.00 0.00 0.00 179.25 181.08 1gwh h THR 165 N 0.03 1.17 -0.66 0.00 2.02 -1.91 -0.58 112.91 112.98 1gwh h THR 165 Ca 0.01 -0.37 -0.05 0.00 0.77 0.00 0.00 66.41 66.77 1gwh h THR 165 Cb 0.20 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 66.94 1gwh h THR 165 CO 0.01 0.17 0.23 -0.03 0.37 0.00 0.00 175.52 176.28 1gwh h MET 166 N 0.80 1.00 -0.09 6.66 -1.53 -1.76 -0.46 114.93 119.55 1gwh h MET 166 Ca 0.21 -0.20 -0.00 0.00 -3.44 0.00 0.00 59.70 56.27 1gwh h MET 166 Cb -0.03 -0.15 -0.00 0.00 -0.55 0.00 0.00 31.60 30.86 1gwh h MET 166 CO -0.04 0.86 0.05 1.96 0.14 0.00 0.00 176.91 179.87 1gwh h GLN 167 N 0.94 0.13 -0.09 0.39 4.20 -1.03 -1.95 115.11 117.71 1gwh h GLN 167 Ca 0.22 -0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.79 1gwh h GLN 167 Cb 0.25 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1gwh h GLN 167 CO -0.01 0.20 -0.45 -1.49 -0.67 0.00 0.00 178.83 176.41 1gwh h TRP 168 N 0.03 0.25 -0.32 2.96 4.06 -1.06 -1.37 115.95 120.50 1gwh h TRP 168 Ca 0.03 -0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.91 1gwh h TRP 168 Cb 0.11 -0.05 -0.02 0.00 -1.00 0.00 0.00 29.16 28.20 1gwh h TRP 168 CO -0.03 0.63 0.21 0.22 -3.56 0.00 0.00 178.44 175.90 1gwh h ASP 169 N 0.17 0.35 -0.01 -3.49 3.58 -0.93 0.21 116.42 116.31 1gwh h ASP 169 Ca 0.01 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 1gwh h ASP 169 Cb 0.87 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.83 1gwh h ASP 169 CO 0.07 0.26 0.00 0.15 -2.88 0.00 0.00 179.24 176.84 1gwh h PHE 170 N 0.42 0.01 -0.43 0.28 3.57 -1.23 -2.47 116.94 117.09 1gwh h PHE 170 Ca 0.12 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.58 1gwh h PHE 170 Cb -0.04 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1gwh h PHE 170 CO -0.06 0.20 0.12 -1.49 -2.23 0.00 0.00 178.31 174.86 1gwh h TRP 171 N -0.19 0.70 0.00 0.41 6.55 -1.09 -2.26 115.95 120.07 1gwh h TRP 171 Ca 0.00 -0.08 -0.05 0.00 0.95 0.00 0.00 58.89 59.72 1gwh h TRP 171 Cb 0.20 -0.20 -0.01 0.00 -0.86 0.00 0.00 29.16 28.29 1gwh h TRP 171 CO -0.01 0.65 -0.23 1.79 -1.05 0.00 0.00 178.44 179.59 1gwh h THR 172 N 0.55 0.60 -0.01 1.49 1.35 -0.98 -2.26 112.91 113.65 1gwh h THR 172 Ca 0.14 -1.07 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 1gwh h THR 172 Cb 0.28 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1gwh h THR 172 CO -0.00 0.22 -0.09 0.59 -0.25 0.00 0.00 175.52 175.99 1gwh n ASN 173 N -3.46 0.91 -3.37 5.36 3.02 -0.93 -4.34 115.26 112.45 1gwh n ASN 173 Ca -0.00 -1.04 -0.26 0.00 -0.03 0.00 0.00 54.58 53.25 1gwh n ASN 173 Cb 0.41 0.01 -0.09 0.00 -0.61 0.00 0.00 39.78 39.50 1gwh n ASN 173 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1gwh n ASN 174 N -0.48 0.97 0.23 6.41 3.02 -0.85 -4.99 115.26 119.57 1gwh n ASN 174 Ca 0.17 -2.80 0.15 0.00 -0.03 0.00 0.00 54.58 52.07 1gwh n ASN 174 Cb 0.30 -0.63 0.81 0.00 -0.61 0.00 0.00 39.78 39.65 1gwh n ASN 174 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1gwh h PRO 175 N 4.64 0.00 0.00 3.52 0.13 -1.75 -0.23 132.00 138.30 1gwh h PRO 175 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1gwh h PRO 175 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1gwh h PRO 175 CO 0.53 0.00 0.17 1.05 -0.23 0.00 0.00 178.00 179.53 1gwh h GLU 176 N 0.00 0.00 0.00 0.86 4.11 -1.87 -1.92 114.58 115.76 1gwh h GLU 176 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1gwh h GLU 176 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1gwh h GLU 176 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 179.01 177.95 1gwh n SER 177 N -2.97 0.42 -0.35 3.06 3.41 -0.10 -4.20 113.62 112.90 1gwh n SER 177 Ca -0.02 0.61 -0.03 0.00 -0.26 0.00 0.00 58.87 59.16 1gwh n SER 177 Cb 0.23 -0.69 0.09 0.00 -0.26 0.00 0.00 64.21 63.58 1gwh n SER 177 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gwh h ALA 178 N 2.33 1.18 0.10 7.33 0.00 -1.55 -0.82 119.26 127.82 1gwh h ALA 178 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1gwh h ALA 178 Cb 0.30 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1gwh h ALA 178 CO 0.00 0.62 -0.05 1.25 0.00 0.00 0.00 179.25 181.07 1gwh h HIS 179 N 1.27 -0.12 -0.15 0.00 6.17 -1.73 -0.97 115.15 119.63 1gwh h HIS 179 Ca 0.34 -0.00 -0.16 0.00 0.71 0.00 0.00 60.37 61.25 1gwh h HIS 179 Cb -0.08 0.04 -0.01 0.00 2.52 0.00 0.00 27.41 29.88 1gwh h HIS 179 CO 0.00 -0.03 -0.59 0.37 0.71 0.00 0.00 177.93 178.39 1gwh h GLN 180 N -0.18 0.49 -0.64 5.26 5.75 -1.70 -2.54 115.11 121.55 1gwh h GLN 180 Ca -0.01 -0.33 -0.06 0.00 -0.15 0.00 0.00 58.65 58.10 1gwh h GLN 180 Cb 0.14 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 1gwh h GLN 180 CO 0.02 0.94 0.17 0.28 -2.65 0.00 0.00 178.83 177.58 1gwh h VAL 181 N 0.37 1.25 -0.36 2.39 2.07 -1.01 0.17 116.25 121.12 1gwh h VAL 181 Ca -0.00 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.65 1gwh h VAL 181 Cb 1.13 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1gwh h VAL 181 CO 0.11 0.34 0.21 0.74 0.02 0.00 0.00 177.57 178.99 1gwh h THR 182 N 0.95 1.04 -0.35 2.57 2.02 -1.07 -1.04 112.91 117.03 1gwh h THR 182 Ca 0.21 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.24 1gwh h THR 182 Cb 0.32 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1gwh h THR 182 CO -0.00 0.08 0.21 0.22 0.37 0.00 0.00 175.52 176.40 1gwh h TYR 183 N 0.43 0.46 -0.81 3.16 5.03 -1.05 -2.13 116.97 122.06 1gwh h TYR 183 Ca 0.14 -0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.42 1gwh h TYR 183 Cb -0.00 -0.15 -0.04 0.00 1.55 0.00 0.00 36.73 38.09 1gwh h TYR 183 CO -0.07 0.34 0.38 1.25 -1.32 0.00 0.00 178.16 178.74 1gwh h LEU 184 N 0.46 1.06 -0.03 2.82 5.85 -0.74 -2.82 115.31 121.91 1gwh h LEU 184 Ca 0.13 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1gwh h LEU 184 Cb 0.01 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.77 1gwh h LEU 184 CO -0.02 0.90 0.00 0.23 -0.34 0.00 0.00 178.44 179.21 1gwh n MET 185 N -4.34 0.21 -0.05 1.25 2.81 -0.42 -3.34 117.12 113.24 1gwh n MET 185 Ca 0.08 0.19 0.00 0.00 -1.81 0.00 0.00 57.70 56.15 1gwh n MET 185 Cb 0.14 -1.75 0.00 0.00 -0.71 0.00 0.00 33.22 30.90 1gwh n MET 185 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1gwh n GLY 186 N 1.27 -0.94 0.37 3.03 0.00 -0.81 -4.73 105.19 103.37 1gwh n GLY 186 Ca 0.06 -1.69 0.10 0.00 0.00 0.00 0.00 46.02 44.48 1gwh n GLY 186 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1gwh h PRO 187 N 0.00 0.70 0.00 1.61 0.11 -1.88 -2.69 132.00 129.85 1gwh h PRO 187 Ca 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1gwh h PRO 187 Cb 0.00 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 30.95 1gwh h PRO 187 CO 0.00 0.46 0.00 0.54 -0.21 0.00 0.00 178.00 178.79 1gwh n ARG 188 N -4.52 0.67 0.14 1.05 1.74 -1.26 -3.21 116.66 111.28 1gwh n ARG 188 Ca 0.15 0.01 0.11 0.00 -0.77 0.00 0.00 57.85 57.36 1gwh n ARG 188 Cb 0.38 -1.50 0.52 0.00 -1.02 0.00 0.00 32.46 30.84 1gwh n ARG 188 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gwh n GLY 189 N 0.60 -1.12 2.43 -0.13 0.00 -1.02 -4.15 105.19 101.79 1gwh n GLY 189 Ca 0.17 0.12 -0.27 0.00 0.00 0.00 0.00 46.02 46.05 1gwh n GLY 189 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gwh n LEU 190 N -2.24 0.41 -4.78 0.99 4.77 -1.20 -2.51 117.00 112.45 1gwh n LEU 190 Ca 0.01 -4.63 -0.41 0.00 -0.03 0.00 0.00 56.01 50.95 1gwh n LEU 190 Cb 0.16 0.30 -0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1gwh n LEU 190 CO 0.16 1.90 1.15 -2.16 -1.33 0.00 0.00 177.39 177.11 1gwh s PRO 191 N -0.58 4.10 0.09 3.23 0.04 -1.26 -0.14 135.00 140.48 1gwh s PRO 191 Ca 0.33 2.59 -0.17 0.00 0.04 0.00 0.00 61.00 63.78 1gwh s PRO 191 Cb 0.06 -2.96 -0.08 0.00 0.04 0.00 0.00 34.50 31.56 1gwh s PRO 191 CO -0.17 -0.55 1.48 -0.09 0.04 0.00 0.00 177.00 177.71 1gwh h ARG 192 N 3.04 0.54 -4.17 4.56 2.43 -1.30 -3.42 114.38 116.06 1gwh h ARG 192 Ca -0.51 -0.22 -0.14 0.00 -0.81 0.00 0.00 59.98 58.30 1gwh h ARG 192 Cb 1.24 -0.03 -0.14 0.00 -0.42 0.00 0.00 29.97 30.62 1gwh h ARG 192 CO 0.65 0.76 -0.51 0.95 -1.51 0.00 0.00 179.97 180.31 1gwh s THR 193 N -4.72 0.10 0.31 0.20 -4.23 -1.26 -4.91 115.64 101.13 1gwh s THR 193 Ca -0.13 -1.66 0.26 0.00 -1.18 0.00 0.00 61.69 58.97 1gwh s THR 193 Cb 0.08 -1.88 0.26 0.00 1.34 0.00 0.00 72.50 72.30 1gwh s THR 193 CO 0.78 -0.46 1.97 -0.50 -0.54 0.00 0.00 174.62 175.87 1gwh h TRP 194 N 2.76 0.00 0.00 3.99 6.55 -1.88 -2.28 115.95 125.09 1gwh h TRP 194 Ca -0.34 0.00 -0.02 0.00 0.95 0.00 0.00 58.89 59.49 1gwh h TRP 194 Cb 1.21 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.50 1gwh h TRP 194 CO 0.43 0.17 -0.08 0.00 -1.05 0.00 0.00 178.44 177.91 1gwh h ARG 195 N 0.00 0.00 -1.12 0.49 3.08 -1.96 -3.29 114.38 111.58 1gwh h ARG 195 Ca -0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1gwh h ARG 195 Cb 0.51 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 30.17 1gwh h ARG 195 CO 0.02 0.08 -0.34 0.39 -1.07 0.00 0.00 179.97 179.05 1gwh n GLU 196 N -3.25 3.34 -3.86 0.04 1.02 -0.86 -4.46 120.64 112.61 1gwh n GLU 196 Ca -0.00 -4.06 -0.11 0.00 -0.02 0.00 0.00 57.16 52.96 1gwh n GLU 196 Cb 0.32 -2.27 -0.10 0.00 -0.02 0.00 0.00 31.44 29.37 1gwh n GLU 196 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gwh s MET 197 N -3.67 0.51 0.48 3.49 0.23 -1.24 -1.80 119.30 117.31 1gwh s MET 197 Ca 0.53 -0.40 -0.08 0.00 -1.03 0.00 0.00 55.69 54.71 1gwh s MET 197 Cb 0.43 0.21 -0.05 0.00 -1.53 0.00 0.00 34.83 33.89 1gwh s MET 197 CO -0.07 -0.13 0.82 -0.80 -2.03 0.00 0.00 175.02 172.81 1gwh s ASN 198 N -1.43 6.35 0.17 -1.18 0.01 -1.26 -4.46 114.94 113.14 1gwh s ASN 198 Ca -0.14 1.08 0.11 0.00 -0.71 0.00 0.00 52.86 53.20 1gwh s ASN 198 Cb -0.07 -2.31 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 1gwh s ASN 198 CO 0.02 -0.56 -0.23 -0.83 -1.51 0.00 0.00 177.10 173.98 1gwh s GLY 199 N -3.79 1.68 -0.03 0.66 0.00 -0.23 -4.31 107.32 101.30 1gwh s GLY 199 Ca 0.50 -1.56 -0.09 0.00 0.00 0.00 0.00 44.72 43.57 1gwh s GLY 199 CO 0.41 -1.57 0.20 -0.19 0.00 0.00 0.00 173.10 171.95 1gwh s TYR 200 N -1.48 -0.10 0.19 1.90 2.02 0.04 0.12 117.35 120.05 1gwh s TYR 200 Ca 0.19 0.19 0.18 0.00 -0.37 0.00 0.00 57.07 57.26 1gwh s TYR 200 Cb -0.09 0.02 0.66 0.00 -0.40 0.00 0.00 41.96 42.16 1gwh s TYR 200 CO 0.09 -0.25 1.73 0.78 -1.57 0.00 0.00 175.55 176.33 1gwh h GLY 201 N 4.72 0.00 0.00 0.71 0.00 -1.65 -2.41 103.07 104.44 1gwh h GLY 201 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1gwh h GLY 201 CO 0.39 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.37 1gwh n SER 202 N -3.58 0.00 -4.77 0.19 7.64 -1.26 -4.74 113.62 107.10 1gwh n SER 202 Ca -0.00 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.54 1gwh n SER 202 Cb 0.51 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.74 1gwh n SER 202 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1gwh s HIS 203 N 0.00 2.59 0.06 1.43 3.76 -1.26 -4.79 115.29 117.08 1gwh s HIS 203 Ca 0.00 1.55 -0.31 0.00 -0.15 0.00 0.00 55.06 56.15 1gwh s HIS 203 Cb 0.00 -3.25 -0.06 0.00 1.11 0.00 0.00 32.58 30.38 1gwh s HIS 203 CO 0.00 -1.74 1.34 0.99 -0.85 0.00 0.00 174.74 174.48 1gwh s THR 204 N -2.07 3.65 0.40 1.30 2.01 -1.26 -4.61 115.64 115.06 1gwh s THR 204 Ca 0.70 1.14 0.08 0.00 0.31 0.00 0.00 61.69 63.92 1gwh s THR 204 Cb -0.23 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 1gwh s THR 204 CO 0.36 0.06 0.22 -0.31 -0.69 0.00 0.00 174.62 174.26 1gwh s TYR 205 N 1.53 2.65 -0.17 4.92 1.51 -0.09 -4.30 117.35 123.40 1gwh s TYR 205 Ca 0.62 -0.52 -0.07 0.00 -1.01 0.00 0.00 57.07 56.10 1gwh s TYR 205 Cb -0.33 -1.95 -0.04 0.00 -0.11 0.00 0.00 41.96 39.54 1gwh s TYR 205 CO 0.28 0.14 0.04 -1.17 -1.11 0.00 0.00 175.55 173.74 1gwh s LEU 206 N -3.95 3.72 -0.07 -1.29 2.96 -0.73 -0.33 118.68 119.00 1gwh s LEU 206 Ca 0.42 0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.39 1gwh s LEU 206 Cb 0.01 -1.93 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 1gwh s LEU 206 CO 0.24 0.18 -0.07 0.26 -1.32 0.00 0.00 176.35 175.65 1gwh s TRP 207 N 0.31 2.95 -0.07 5.38 0.52 0.59 -0.70 118.94 127.91 1gwh s TRP 207 Ca 0.02 -0.00 0.03 0.00 0.02 0.00 0.00 56.10 56.16 1gwh s TRP 207 Cb -0.13 -1.73 0.01 0.00 -1.15 0.00 0.00 33.47 30.48 1gwh s TRP 207 CO 0.01 0.31 -0.15 0.08 0.02 0.00 0.00 176.95 177.22 1gwh s VAL 208 N -0.73 1.33 0.66 4.03 1.01 -0.55 -0.97 120.40 125.18 1gwh s VAL 208 Ca 0.11 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.52 1gwh s VAL 208 Cb -0.11 -1.19 0.13 0.00 0.00 0.00 0.00 36.38 35.20 1gwh s VAL 208 CO 0.02 0.40 0.91 -0.46 0.00 0.00 0.00 175.10 175.96 1gwh n ASN 209 N 3.79 1.39 0.24 3.32 0.23 -0.60 -1.54 115.26 122.09 1gwh n ASN 209 Ca -0.22 -2.13 0.08 0.00 -0.53 0.00 0.00 54.58 51.78 1gwh n ASN 209 Cb 0.52 -0.57 0.59 0.00 -2.08 0.00 0.00 39.78 38.24 1gwh n ASN 209 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1gwh h ALA 210 N -0.48 1.51 -0.01 -2.53 0.00 -1.86 -1.33 119.26 114.57 1gwh h ALA 210 Ca -0.30 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1gwh h ALA 210 Cb 1.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1gwh h ALA 210 CO 0.34 0.21 -0.05 1.04 0.00 0.00 0.00 179.25 180.79 1gwh n GLN 211 N -4.03 1.16 -0.51 0.00 3.00 -1.26 -4.93 117.38 110.80 1gwh n GLN 211 Ca -0.02 -0.47 0.00 0.00 -0.01 0.00 0.00 57.00 56.50 1gwh n GLN 211 Cb 0.25 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.00 1gwh n GLN 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1gwh n GLY 212 N 1.17 0.75 3.76 1.08 0.00 -0.50 -5.05 105.19 106.40 1gwh n GLY 212 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1gwh n GLY 212 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gwh s GLU 213 N -0.49 4.59 -0.06 1.61 2.02 -1.26 -4.76 118.70 120.35 1gwh s GLU 213 Ca 0.00 1.68 0.03 0.00 0.02 0.00 0.00 54.97 56.70 1gwh s GLU 213 Cb 0.00 -3.07 -0.02 0.00 0.10 0.00 0.00 34.13 31.13 1gwh s GLU 213 CO 0.00 0.20 -0.14 0.15 0.02 0.00 0.00 175.26 175.49 1gwh s LYS 214 N -1.61 2.66 0.03 1.61 1.02 -1.26 -1.56 119.74 120.62 1gwh s LYS 214 Ca 0.46 -0.70 0.05 0.00 0.02 0.00 0.00 55.97 55.81 1gwh s LYS 214 Cb -0.29 -2.42 -0.02 0.00 -0.52 0.00 0.00 37.83 34.59 1gwh s LYS 214 CO 0.36 0.54 -0.15 -1.01 -0.92 0.00 0.00 175.35 174.18 1gwh s HIS 215 N -0.52 1.33 0.02 3.18 3.76 -0.14 -2.94 115.29 119.98 1gwh s HIS 215 Ca 0.07 -0.34 -0.25 0.00 -0.15 0.00 0.00 55.06 54.39 1gwh s HIS 215 Cb -0.12 -0.80 -0.05 0.00 1.11 0.00 0.00 32.58 32.72 1gwh s HIS 215 CO 0.01 0.03 0.77 -1.58 -0.85 0.00 0.00 174.74 173.13 1gwh s TRP 216 N -0.75 3.70 0.02 1.40 0.52 0.02 -0.30 118.94 123.55 1gwh s TRP 216 Ca 0.03 1.45 0.05 0.00 0.02 0.00 0.00 56.10 57.65 1gwh s TRP 216 Cb -0.08 -2.84 -0.02 0.00 -1.15 0.00 0.00 33.47 29.39 1gwh s TRP 216 CO 0.01 0.22 -0.15 0.08 0.02 0.00 0.00 176.95 177.13 1gwh s VAL 217 N 0.16 1.18 -0.07 4.03 1.01 0.55 -0.01 120.40 127.26 1gwh s VAL 217 Ca 0.39 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1gwh s VAL 217 Cb -0.20 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 1gwh s VAL 217 CO 0.22 0.15 -0.10 -0.54 0.00 0.00 0.00 175.10 174.84 1gwh s LYS 218 N -0.83 2.71 -0.14 2.72 -0.14 -0.67 -0.91 119.74 122.48 1gwh s LYS 218 Ca 0.04 -0.61 -0.06 0.00 -1.36 0.00 0.00 55.97 53.97 1gwh s LYS 218 Cb -0.07 -2.52 -0.04 0.00 -1.68 0.00 0.00 37.83 33.52 1gwh s LYS 218 CO 0.01 0.62 0.09 0.71 -0.76 0.00 0.00 175.35 176.01 1gwh s TYR 219 N -0.69 3.37 -0.08 3.18 1.51 -1.26 -0.97 117.35 122.41 1gwh s TYR 219 Ca 0.10 0.29 -0.01 0.00 -1.01 0.00 0.00 57.07 56.45 1gwh s TYR 219 Cb -0.11 -1.98 0.03 0.00 -0.11 0.00 0.00 41.96 39.78 1gwh s TYR 219 CO 0.01 0.44 -0.02 -1.01 -1.11 0.00 0.00 175.55 173.86 1gwh s HIS 220 N -0.37 0.92 -0.39 2.71 3.76 0.12 -1.82 115.29 120.21 1gwh s HIS 220 Ca 0.10 -0.34 -0.08 0.00 -0.15 0.00 0.00 55.06 54.59 1gwh s HIS 220 Cb -0.12 -0.92 0.07 0.00 1.11 0.00 0.00 32.58 32.72 1gwh s HIS 220 CO 0.02 -0.37 0.21 -0.06 -0.85 0.00 0.00 174.74 173.68 1gwh s PHE 221 N 1.82 3.33 -0.31 1.40 0.40 0.12 -0.53 117.98 124.22 1gwh s PHE 221 Ca 0.04 -1.55 -0.14 0.00 -0.60 0.00 0.00 56.93 54.68 1gwh s PHE 221 Cb -0.12 -2.77 -0.03 0.00 0.51 0.00 0.00 43.02 40.60 1gwh s PHE 221 CO -0.06 -0.82 0.32 0.42 0.70 0.00 0.00 175.22 175.78 1gwh s ILE 222 N 1.40 5.21 0.18 0.64 -1.09 -0.27 -1.07 121.20 126.20 1gwh s ILE 222 Ca 0.02 0.21 -0.32 0.00 -2.23 0.00 0.00 60.65 58.34 1gwh s ILE 222 Cb -0.22 -3.71 -0.10 0.00 -1.58 0.00 0.00 42.46 36.85 1gwh s ILE 222 CO 0.02 0.07 1.59 -0.55 -1.23 0.00 0.00 174.94 174.84 1gwh s SER 223 N 1.71 6.55 0.04 3.58 0.15 -1.26 -1.12 113.70 123.34 1gwh s SER 223 Ca 0.11 2.67 0.24 0.00 0.70 0.00 0.00 55.95 59.67 1gwh s SER 223 Cb -0.16 -2.60 0.98 0.00 -1.71 0.00 0.00 66.02 62.53 1gwh s SER 223 CO 0.11 -0.85 1.75 0.00 1.20 0.00 0.00 173.24 175.45 1gwh n GLN 224 N 3.86 0.04 0.00 5.44 6.02 -0.10 -2.77 117.38 129.88 1gwh n GLN 224 Ca 0.14 0.13 0.14 0.00 -0.01 0.00 0.00 57.00 57.40 1gwh n GLN 224 Cb 0.38 -1.55 0.48 0.00 1.02 0.00 0.00 30.24 30.57 1gwh n GLN 224 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1gwh n GLN 225 N -1.62 1.68 0.00 -1.09 3.00 -1.26 -5.02 117.38 113.07 1gwh n GLN 225 Ca 0.05 -1.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.02 1gwh n GLN 225 Cb 0.29 -1.48 0.00 0.00 0.00 0.00 0.00 30.24 29.05 1gwh n GLN 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1gwh n GLY 226 N 1.20 -1.50 3.39 1.08 0.00 -1.11 -4.85 105.19 103.40 1gwh n GLY 226 Ca 0.18 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.29 1gwh n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gwh s VAL 227 N -1.45 4.22 -0.02 1.61 1.01 -1.26 -3.75 120.40 120.76 1gwh s VAL 227 Ca 0.00 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.46 1gwh s VAL 227 Cb 0.00 -3.15 -0.00 0.00 0.00 0.00 0.00 36.38 33.23 1gwh s VAL 227 CO 0.00 0.10 -0.10 -1.00 0.00 0.00 0.00 175.10 174.10 1gwh s HIS 228 N 1.55 0.94 0.23 5.22 3.76 -0.74 -5.00 115.29 121.24 1gwh s HIS 228 Ca 0.04 -0.21 0.05 0.00 -0.15 0.00 0.00 55.06 54.78 1gwh s HIS 228 Cb -0.17 -0.65 -0.05 0.00 1.11 0.00 0.00 32.58 32.82 1gwh s HIS 228 CO 0.04 -0.07 -0.04 -0.80 -0.85 0.00 0.00 174.74 173.02 1gwh s ASN 229 N 0.02 2.07 0.19 1.40 0.01 -1.26 -0.95 114.94 116.43 1gwh s ASN 229 Ca -0.00 -1.17 0.05 0.00 -0.71 0.00 0.00 52.86 51.03 1gwh s ASN 229 Cb -0.07 -0.04 -0.04 0.00 0.41 0.00 0.00 41.25 41.52 1gwh s ASN 229 CO 0.00 -0.43 0.17 -0.76 -1.51 0.00 0.00 177.10 174.58 1gwh s LEU 230 N -3.31 3.87 0.71 0.60 1.43 0.80 -4.67 118.68 118.11 1gwh s LEU 230 Ca 0.26 -0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.12 1gwh s LEU 230 Cb 0.04 -2.46 0.01 0.00 0.03 0.00 0.00 46.19 43.82 1gwh s LEU 230 CO 0.08 0.03 1.07 -0.94 0.23 0.00 0.00 176.35 176.83 1gwh s SER 231 N -3.35 5.36 0.21 2.29 1.04 -1.26 -4.72 113.70 113.28 1gwh s SER 231 Ca 0.32 1.35 -0.09 0.00 0.48 0.00 0.00 55.95 58.01 1gwh s SER 231 Cb -0.09 -2.21 0.27 0.00 0.10 0.00 0.00 66.02 64.09 1gwh s SER 231 CO 0.24 -1.42 1.76 0.78 0.98 0.00 0.00 173.24 175.59 1gwh h ASN 232 N -0.70 0.32 -0.51 7.02 2.35 -1.99 -1.67 115.58 120.41 1gwh h ASN 232 Ca -0.45 0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.31 1gwh h ASN 232 Cb 1.23 0.02 -0.02 0.00 0.05 0.00 0.00 38.32 39.60 1gwh h ASN 232 CO 0.61 0.20 0.12 0.44 -1.65 0.00 0.00 177.43 177.14 1gwh h ASP 233 N 0.49 0.78 -0.44 5.81 3.32 -1.93 -1.46 116.42 122.98 1gwh h ASP 233 Ca 0.31 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1gwh h ASP 233 Cb 0.33 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1gwh h ASP 233 CO -0.27 0.81 0.19 -0.33 -1.72 0.00 0.00 179.24 177.92 1gwh h GLU 234 N 0.71 0.66 -0.56 3.56 5.08 -1.88 -2.03 114.58 120.12 1gwh h GLU 234 Ca 0.16 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 1gwh h GLU 234 Cb 0.34 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1gwh h GLU 234 CO 0.00 0.59 0.06 0.00 -1.00 0.00 0.00 179.01 178.66 1gwh h ALA 235 N 1.03 1.06 -0.50 3.43 0.00 -1.13 -1.29 119.26 121.87 1gwh h ALA 235 Ca 0.15 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1gwh h ALA 235 Cb 0.17 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1gwh h ALA 235 CO -0.01 0.60 0.25 1.15 0.00 0.00 0.00 179.25 181.24 1gwh h THR 236 N 0.85 1.19 -0.40 0.00 2.02 -1.17 -1.19 112.91 114.21 1gwh h THR 236 Ca 0.17 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 66.84 1gwh h THR 236 Cb 0.42 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1gwh h THR 236 CO 0.01 0.20 0.24 0.50 0.37 0.00 0.00 175.52 176.84 1gwh h LYS 237 N 0.66 0.54 -0.48 6.66 3.64 -0.89 -2.49 116.57 124.22 1gwh h LYS 237 Ca 0.17 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.45 1gwh h LYS 237 Cb 0.10 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1gwh h LYS 237 CO -0.02 0.41 0.10 0.82 -2.27 0.00 0.00 179.45 178.48 1gwh h ILE 238 N 0.52 1.21 -0.72 2.00 2.04 -1.17 -1.96 117.51 119.43 1gwh h ILE 238 Ca 0.14 -0.78 0.07 0.00 1.00 0.00 0.00 64.86 65.29 1gwh h ILE 238 Cb 0.01 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 36.79 1gwh h ILE 238 CO -0.03 0.29 0.47 0.00 0.00 0.00 0.00 178.15 178.88 1gwh h ALA 239 N 1.41 1.75 0.03 1.87 0.00 -0.76 0.16 119.26 123.71 1gwh h ALA 239 Ca 0.15 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 1gwh h ALA 239 Cb 0.29 -0.18 0.02 0.00 0.00 0.00 0.00 17.79 17.92 1gwh h ALA 239 CO 0.00 0.13 -0.69 0.78 0.00 0.00 0.00 179.25 179.47 1gwh h GLY 240 N 0.71 0.47 1.82 0.00 0.00 -1.27 -3.30 103.07 101.50 1gwh h GLY 240 Ca 0.32 -0.88 -0.22 0.00 0.00 0.00 0.00 47.33 46.55 1gwh h GLY 240 CO -0.11 0.78 -0.98 0.83 0.00 0.00 0.00 176.54 177.05 1gwh h GLU 241 N -0.09 0.15 -1.13 4.80 5.08 -0.81 -3.43 114.58 119.15 1gwh h GLU 241 Ca -0.09 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 57.99 1gwh h GLU 241 Cb 1.41 0.07 -0.21 0.00 0.50 0.00 0.00 28.75 30.52 1gwh h GLU 241 CO 0.13 1.01 -0.47 1.21 -1.00 0.00 0.00 179.01 179.90 1gwh s ASN 242 N -6.91 -1.19 0.21 1.42 3.84 0.51 -5.01 114.94 107.81 1gwh s ASN 242 Ca -0.02 -0.67 0.19 0.00 0.21 0.00 0.00 52.86 52.57 1gwh s ASN 242 Cb 0.09 1.80 0.88 0.00 -0.55 0.00 0.00 41.25 43.47 1gwh s ASN 242 CO 0.84 -0.21 1.58 0.00 -2.79 0.00 0.00 177.10 176.52 1gwh n ALA 243 N 4.62 1.39 -1.72 1.71 0.00 -1.24 -2.02 120.51 123.25 1gwh n ALA 243 Ca 0.10 0.09 -0.09 0.00 0.00 0.00 0.00 53.44 53.53 1gwh n ALA 243 Cb 0.55 -1.30 0.13 0.00 0.00 0.00 0.00 19.45 18.83 1gwh n ALA 243 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1gwh n ASP 244 N -2.06 3.36 -0.19 0.00 8.00 -1.26 -0.26 116.55 124.14 1gwh n ASP 244 Ca 0.01 -3.82 -0.01 0.00 0.71 0.00 0.00 54.79 51.67 1gwh n ASP 244 Cb 0.13 -0.50 0.09 0.00 -0.02 0.00 0.00 41.12 40.83 1gwh n ASP 244 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1gwh h PHE 245 N 1.49 0.43 -0.33 1.24 3.04 -1.76 -0.66 116.94 120.39 1gwh h PHE 245 Ca 0.21 0.03 -0.15 0.00 3.98 0.00 0.00 57.97 62.04 1gwh h PHE 245 Cb 1.32 -0.10 -0.00 0.00 2.56 0.00 0.00 35.95 39.72 1gwh h PHE 245 CO 0.88 0.14 -0.39 0.45 -2.02 0.00 0.00 178.31 177.37 1gwh h HIS 246 N 0.44 1.03 -0.39 0.41 3.86 -1.88 -0.66 115.15 117.97 1gwh h HIS 246 Ca 0.28 -0.33 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 1gwh h HIS 246 Cb 0.31 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 1gwh h HIS 246 CO -0.15 1.13 0.21 -0.09 0.86 0.00 0.00 177.93 179.89 1gwh h ARG 247 N 0.63 0.54 -0.20 2.45 2.43 -1.84 -1.72 114.38 116.68 1gwh h ARG 247 Ca 0.04 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1gwh h ARG 247 Cb 0.99 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 1gwh h ARG 247 CO 0.09 0.45 0.06 0.37 -1.51 0.00 0.00 179.97 179.43 1gwh h GLN 248 N 0.49 0.31 -0.54 0.20 4.15 -1.08 -2.62 115.11 116.03 1gwh h GLN 248 Ca 0.14 -0.07 0.07 0.00 0.77 0.00 0.00 58.65 59.56 1gwh h GLN 248 Cb 0.07 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 27.66 1gwh h GLN 248 CO -0.02 0.42 0.22 0.22 -1.93 0.00 0.00 178.83 177.73 1gwh h ASP 249 N 0.14 0.25 -0.03 -0.69 1.82 -0.92 0.17 116.42 117.16 1gwh h ASP 249 Ca 0.06 0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.76 1gwh h ASP 249 Cb 0.24 0.03 -0.00 0.00 0.68 0.00 0.00 39.33 40.28 1gwh h ASP 249 CO -0.00 0.17 0.01 0.25 -1.61 0.00 0.00 179.24 178.05 1gwh h LEU 250 N 0.41 0.04 -0.30 2.28 5.85 -1.25 -0.15 115.31 122.19 1gwh h LEU 250 Ca 0.26 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1gwh h LEU 250 Cb 0.26 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1gwh h LEU 250 CO -0.24 0.24 0.15 0.15 -0.34 0.00 0.00 178.44 178.40 1gwh h PHE 251 N -0.16 0.42 -0.59 1.25 3.04 -1.17 -2.53 116.94 117.22 1gwh h PHE 251 Ca 0.01 -0.02 -0.10 0.00 3.98 0.00 0.00 57.97 61.84 1gwh h PHE 251 Cb 0.21 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 38.57 1gwh h PHE 251 CO -0.00 0.37 -0.03 0.93 -2.02 0.00 0.00 178.31 177.55 1gwh h GLU 252 N 0.36 1.06 -0.50 1.11 5.08 -0.89 -1.06 114.58 119.74 1gwh h GLU 252 Ca 0.10 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1gwh h GLU 252 Cb 0.10 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1gwh h GLU 252 CO -0.01 1.05 0.30 0.66 -1.00 0.00 0.00 179.01 180.01 1gwh h SER 253 N 0.95 0.59 -0.41 1.42 4.64 -0.88 -1.60 113.55 118.26 1gwh h SER 253 Ca 0.16 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.31 1gwh h SER 253 Cb 0.60 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1gwh h SER 253 CO 0.04 0.47 -0.20 0.40 -0.87 0.00 0.00 176.83 176.67 1gwh h ILE 254 N 0.66 1.28 -0.61 0.95 2.04 -1.35 0.34 117.51 120.82 1gwh h ILE 254 Ca 0.18 -1.34 0.03 0.00 1.00 0.00 0.00 64.86 64.73 1gwh h ILE 254 Cb -0.01 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1gwh h ILE 254 CO -0.03 0.45 0.40 0.00 0.00 0.00 0.00 178.15 178.97 1gwh h ALA 255 N 0.82 1.68 -0.00 1.87 0.00 -0.97 -1.68 119.26 120.98 1gwh h ALA 255 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1gwh h ALA 255 Cb 0.76 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1gwh h ALA 255 CO 0.06 0.25 -0.02 1.63 0.00 0.00 0.00 179.25 181.17 1gwh n LYS 256 N -4.46 0.62 -0.64 0.00 5.02 -0.62 -4.92 118.16 113.15 1gwh n LYS 256 Ca 0.07 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1gwh n LYS 256 Cb 0.14 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 1gwh n LYS 256 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gwh n GLY 257 N 1.22 0.64 3.43 0.72 0.00 -0.63 -5.02 105.19 105.55 1gwh n GLY 257 Ca 0.16 -0.34 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 1gwh n GLY 257 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gwh s ASP 258 N -2.31 7.05 -0.38 1.61 -1.08 0.09 -5.00 116.67 116.66 1gwh s ASP 258 Ca 0.00 -2.98 -0.25 0.00 -0.52 0.00 0.00 52.55 48.80 1gwh s ASP 258 Cb 0.00 -2.35 0.01 0.00 -1.46 0.00 0.00 42.92 39.12 1gwh s ASP 258 CO 0.00 -0.69 0.89 -1.00 0.52 0.00 0.00 175.17 174.89 1gwh s HIS 259 N 1.10 3.07 0.42 -5.34 3.76 -1.26 -4.27 115.29 112.77 1gwh s HIS 259 Ca 0.38 0.68 -0.24 0.00 -0.15 0.00 0.00 55.06 55.73 1gwh s HIS 259 Cb -0.05 -3.62 -0.08 0.00 1.11 0.00 0.00 32.58 29.94 1gwh s HIS 259 CO -0.03 -0.83 1.13 -1.25 -0.85 0.00 0.00 174.74 172.91 1gwh s PRO 260 N 3.41 3.98 0.09 8.40 0.04 -1.24 -4.77 135.00 144.91 1gwh s PRO 260 Ca 0.36 1.72 0.06 0.00 0.04 0.00 0.00 61.00 63.19 1gwh s PRO 260 Cb -0.12 -2.55 -0.03 0.00 0.04 0.00 0.00 34.50 31.84 1gwh s PRO 260 CO 0.19 -0.35 -0.16 0.15 0.04 0.00 0.00 177.00 176.87 1gwh s LYS 261 N -2.49 0.94 -0.02 4.56 1.02 -1.26 -1.42 119.74 121.08 1gwh s LYS 261 Ca 0.59 -1.07 0.02 0.00 0.02 0.00 0.00 55.97 55.54 1gwh s LYS 261 Cb -0.27 -1.00 0.00 0.00 -0.52 0.00 0.00 37.83 36.04 1gwh s LYS 261 CO 0.34 0.22 -0.07 -1.58 -0.92 0.00 0.00 175.35 173.34 1gwh s TRP 262 N -1.41 0.70 -0.12 3.18 0.51 -0.23 -0.92 118.94 120.65 1gwh s TRP 262 Ca 0.02 -0.15 -0.16 0.00 -2.12 0.00 0.00 56.10 53.69 1gwh s TRP 262 Cb -0.09 -0.50 -0.04 0.00 -0.81 0.00 0.00 33.47 32.03 1gwh s TRP 262 CO 0.03 -0.06 0.41 -0.51 -0.51 0.00 0.00 176.95 176.31 1gwh s ASP 263 N 0.11 6.61 -0.12 2.95 1.01 -0.28 -0.00 116.67 126.94 1gwh s ASP 263 Ca -0.01 0.72 -0.20 0.00 0.71 0.00 0.00 52.55 53.76 1gwh s ASP 263 Cb -0.06 -2.25 -0.04 0.00 1.01 0.00 0.00 42.92 41.59 1gwh s ASP 263 CO -0.00 0.06 0.57 -0.22 0.21 0.00 0.00 175.17 175.79 1gwh s LEU 264 N 0.42 4.25 0.12 1.23 2.96 0.33 -1.11 118.68 126.89 1gwh s LEU 264 Ca 0.22 0.91 0.10 0.00 -0.22 0.00 0.00 54.13 55.15 1gwh s LEU 264 Cb -0.14 -2.84 -0.04 0.00 0.50 0.00 0.00 46.19 43.67 1gwh s LEU 264 CO 0.08 -0.09 -0.25 -0.31 -1.32 0.00 0.00 176.35 174.46 1gwh s TYR 265 N 0.98 2.14 0.23 5.38 2.02 0.31 -0.69 117.35 127.71 1gwh s TYR 265 Ca 0.30 -0.39 0.11 0.00 -0.37 0.00 0.00 57.07 56.71 1gwh s TYR 265 Cb -0.16 -1.15 -0.05 0.00 -0.40 0.00 0.00 41.96 40.20 1gwh s TYR 265 CO 0.12 0.30 -0.15 0.96 -1.57 0.00 0.00 175.55 175.22 1gwh s ILE 266 N -1.13 2.79 -0.07 2.71 -4.36 0.07 -0.71 121.20 120.51 1gwh s ILE 266 Ca 0.12 -2.04 -0.03 0.00 -0.26 0.00 0.00 60.65 58.45 1gwh s ILE 266 Cb -0.10 -2.42 -0.04 0.00 1.25 0.00 0.00 42.46 41.16 1gwh s ILE 266 CO 0.06 -0.25 0.06 -1.10 0.24 0.00 0.00 174.94 173.95 1gwh s GLN 267 N -3.15 3.12 -0.20 0.37 -0.21 -0.15 -0.60 119.66 118.85 1gwh s GLN 267 Ca 0.26 -0.36 0.00 0.00 0.02 0.00 0.00 55.36 55.29 1gwh s GLN 267 Cb -0.07 -2.91 0.05 0.00 1.00 0.00 0.00 33.01 31.07 1gwh s GLN 267 CO 0.15 0.71 -0.06 0.00 -2.12 0.00 0.00 175.29 173.96 1gwh s ALA 268 N -1.01 1.74 -0.20 6.09 0.00 -1.26 -1.67 121.76 125.44 1gwh s ALA 268 Ca 0.17 -1.07 -0.06 0.00 0.00 0.00 0.00 51.96 50.99 1gwh s ALA 268 Cb -0.12 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 1gwh s ALA 268 CO 0.06 -0.92 0.04 0.42 0.00 0.00 0.00 175.76 175.36 1gwh s ILE 269 N 1.51 4.34 0.56 0.00 1.01 0.99 -4.96 121.20 124.66 1gwh s ILE 269 Ca -0.02 -0.18 -0.21 0.00 0.00 0.00 0.00 60.65 60.24 1gwh s ILE 269 Cb -0.17 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.28 1gwh s ILE 269 CO -0.07 0.42 1.26 -2.65 0.00 0.00 0.00 174.94 173.90 1gwh n PRO 270 N 4.10 1.47 -0.19 2.79 -0.02 -1.26 -0.80 135.00 141.09 1gwh n PRO 270 Ca -0.17 0.55 -0.02 0.00 -2.02 0.00 0.00 63.50 61.84 1gwh n PRO 270 Cb 0.52 -2.47 0.04 0.00 -0.02 0.00 0.00 33.50 31.58 1gwh n PRO 270 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1gwh h TYR 271 N 1.17 -0.42 -0.03 6.00 3.20 -1.89 -1.33 116.97 123.66 1gwh h TYR 271 Ca -0.50 0.05 -0.12 0.00 3.14 0.00 0.00 58.73 61.31 1gwh h TYR 271 Cb 1.32 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.85 1gwh h TYR 271 CO 0.43 -0.28 -0.53 0.93 -1.64 0.00 0.00 178.16 177.07 1gwh h GLU 272 N -0.04 0.09 0.00 1.82 4.39 -1.89 -2.61 114.58 116.34 1gwh h GLU 272 Ca 0.27 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.91 1gwh h GLU 272 Cb 0.45 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1gwh h GLU 272 CO -0.61 0.60 0.00 0.93 -1.16 0.00 0.00 179.01 178.78 1gwh h GLU 273 N 0.07 0.00 -0.15 2.33 5.08 -1.60 -2.53 114.58 117.78 1gwh h GLU 273 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1gwh h GLU 273 Cb 0.97 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 1gwh h GLU 273 CO 0.07 0.00 0.07 0.78 -1.00 0.00 0.00 179.01 178.93 1gwh h GLY 274 N 1.94 0.22 1.68 -3.84 0.00 -1.13 -0.98 103.07 100.95 1gwh h GLY 274 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1gwh h GLY 274 CO 0.00 0.08 -0.30 0.50 0.00 0.00 0.00 176.54 176.82 1gwh h LYS 275 N 0.21 0.00 -0.00 4.80 1.57 -1.59 -3.36 116.57 118.19 1gwh h LYS 275 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1gwh h LYS 275 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1gwh h LYS 275 CO -0.01 0.00 -0.15 0.25 -0.57 0.00 0.00 179.45 178.97 1gwh n THR 276 N -2.77 0.00 -1.69 -0.16 -2.24 -1.02 -5.05 114.28 101.36 1gwh n THR 276 Ca 0.03 -0.42 -0.38 0.00 -2.27 0.00 0.00 64.05 61.01 1gwh n THR 276 Cb 0.51 1.01 0.05 0.00 -2.10 0.00 0.00 70.33 69.80 1gwh n THR 276 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gwh n TYR 277 N -0.96 1.66 0.33 4.78 9.36 -0.40 -4.89 117.16 127.05 1gwh n TYR 277 Ca 0.01 0.44 0.15 0.00 3.32 0.00 0.00 57.90 61.82 1gwh n TYR 277 Cb 0.06 -2.26 0.58 0.00 -0.63 0.00 0.00 39.34 37.09 1gwh n TYR 277 CO 0.00 0.00 0.00 0.07 0.22 0.00 0.00 176.86 177.15 1gwh h ARG 278 N 0.92 0.00 -6.38 2.98 0.11 -1.96 -3.40 114.38 106.65 1gwh h ARG 278 Ca -0.50 0.00 -0.68 0.00 0.10 0.00 0.00 59.98 58.91 1gwh h ARG 278 Cb 1.33 0.00 -0.18 0.00 1.11 0.00 0.00 29.97 32.23 1gwh h ARG 278 CO 0.54 0.00 -0.73 -0.06 0.10 0.00 0.00 179.97 179.82 1gwh s PHE 279 N -3.50 2.79 -0.44 4.08 0.08 -1.26 -0.79 117.98 118.94 1gwh s PHE 279 Ca 0.03 -0.11 -0.29 0.00 0.12 0.00 0.00 56.93 56.68 1gwh s PHE 279 Cb 0.09 -1.56 0.02 0.00 -0.57 0.00 0.00 43.02 41.00 1gwh s PHE 279 CO 0.49 0.34 1.27 1.21 -0.10 0.00 0.00 175.22 178.43 1gwh s ASN 280 N -1.46 6.50 0.23 1.36 3.84 -1.26 -4.87 114.94 119.29 1gwh s ASN 280 Ca 0.17 0.67 0.21 0.00 0.21 0.00 0.00 52.86 54.11 1gwh s ASN 280 Cb -0.11 -2.54 0.93 0.00 -0.55 0.00 0.00 41.25 38.98 1gwh s ASN 280 CO 0.07 -1.32 1.64 -2.65 -2.79 0.00 0.00 177.10 172.04 1gwh n PRO 281 N 7.91 0.15 -0.34 0.43 -0.02 -1.26 -1.81 135.00 140.06 1gwh n PRO 281 Ca 0.14 0.46 0.09 0.00 -2.02 0.00 0.00 63.50 62.17 1gwh n PRO 281 Cb 0.48 -1.83 0.27 0.00 -0.02 0.00 0.00 33.50 32.41 1gwh n PRO 281 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1gwh n PHE 282 N -2.12 0.88 -3.70 6.00 3.72 -1.26 -4.24 117.46 116.73 1gwh n PHE 282 Ca 0.01 -0.42 -0.39 0.00 -0.05 0.00 0.00 57.45 56.61 1gwh n PHE 282 Cb 0.17 -0.03 -0.12 0.00 -0.94 0.00 0.00 39.48 38.55 1gwh n PHE 282 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1gwh s ASP 283 N -0.97 5.42 0.00 4.37 3.68 -0.75 -4.31 116.67 124.11 1gwh s ASP 283 Ca 0.41 -1.00 0.11 0.00 2.13 0.00 0.00 52.55 54.20 1gwh s ASP 283 Cb 0.22 -1.92 0.50 0.00 -1.45 0.00 0.00 42.92 40.26 1gwh s ASP 283 CO 0.27 -0.32 1.34 -0.11 0.13 0.00 0.00 175.17 176.48 1gwh n LEU 284 N 4.89 0.00 -0.28 -1.34 7.94 -1.26 -1.84 117.00 125.11 1gwh n LEU 284 Ca -0.13 0.46 0.15 0.00 -1.11 0.00 0.00 56.01 55.38 1gwh n LEU 284 Cb 0.46 -0.46 0.70 0.00 0.53 0.00 0.00 43.42 44.65 1gwh n LEU 284 CO 0.33 -0.28 0.97 0.35 -1.11 0.00 0.00 177.39 177.65 1gwh n THR 285 N -1.46 0.00 -4.77 1.96 -2.24 -1.26 -1.77 114.28 104.74 1gwh n THR 285 Ca 0.03 -0.15 -0.33 0.00 -2.27 0.00 0.00 64.05 61.34 1gwh n THR 285 Cb 0.12 0.08 -0.13 0.00 -2.10 0.00 0.00 70.33 68.31 1gwh n THR 285 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1gwh s LYS 286 N -2.01 2.83 0.38 -0.78 -0.14 -0.76 -4.83 119.74 114.43 1gwh s LYS 286 Ca 0.42 -0.65 -0.02 0.00 -1.36 0.00 0.00 55.97 54.37 1gwh s LYS 286 Cb 0.21 -2.52 -0.04 0.00 -1.68 0.00 0.00 37.83 33.81 1gwh s LYS 286 CO 0.35 0.52 0.62 0.95 -0.76 0.00 0.00 175.35 177.03 1gwh s THR 287 N -0.44 5.04 -0.19 2.17 -4.23 -1.26 -4.88 115.64 111.85 1gwh s THR 287 Ca 0.06 -0.21 -0.05 0.00 -1.18 0.00 0.00 61.69 60.31 1gwh s THR 287 Cb -0.12 -3.85 -0.02 0.00 1.34 0.00 0.00 72.50 69.84 1gwh s THR 287 CO 0.02 -0.62 -0.01 -0.63 -0.54 0.00 0.00 174.62 172.84 1gwh s ILE 288 N -2.42 3.93 0.24 2.99 -1.09 -1.26 -4.98 121.20 118.61 1gwh s ILE 288 Ca 0.43 -0.33 -0.31 0.00 -2.23 0.00 0.00 60.65 58.21 1gwh s ILE 288 Cb -0.10 -2.76 -0.11 0.00 -1.58 0.00 0.00 42.46 37.91 1gwh s ILE 288 CO 0.38 0.45 1.63 -0.55 -1.23 0.00 0.00 174.94 175.62 1gwh s SER 289 N 0.81 6.42 0.47 3.58 0.15 -1.26 -4.89 113.70 118.97 1gwh s SER 289 Ca 0.00 2.86 0.30 0.00 0.70 0.00 0.00 55.95 59.82 1gwh s SER 289 Cb -0.14 -2.62 1.17 0.00 -1.71 0.00 0.00 66.02 62.72 1gwh s SER 289 CO 0.02 -0.91 1.88 1.56 1.20 0.00 0.00 173.24 176.99 1gwh h GLN 290 N 5.85 0.00 -0.37 5.44 4.20 -1.98 -1.16 115.11 127.09 1gwh h GLN 290 Ca -0.45 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.20 1gwh h GLN 290 Cb 1.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.98 1gwh h GLN 290 CO 0.87 0.00 -0.03 0.87 -0.67 0.00 0.00 178.83 179.87 1gwh h LYS 291 N 0.00 0.67 -0.09 1.46 1.57 -1.99 -3.05 116.57 115.13 1gwh h LYS 291 Ca 0.00 -0.23 -0.19 0.00 -1.87 0.00 0.00 60.65 58.36 1gwh h LYS 291 Cb 0.54 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.81 1gwh h LYS 291 CO 0.00 0.79 -0.69 -0.44 -0.57 0.00 0.00 179.45 178.54 1gwh h ASP 292 N 0.48 0.76 -2.86 0.86 3.32 -1.87 -3.42 116.42 113.70 1gwh h ASP 292 Ca 0.10 -0.67 -0.57 0.00 0.02 0.00 0.00 57.03 55.91 1gwh h ASP 292 Cb 0.51 -0.23 -0.40 0.00 0.22 0.00 0.00 39.33 39.44 1gwh h ASP 292 CO 0.02 1.31 -0.80 -0.31 -1.72 0.00 0.00 179.24 177.75 1gwh s TYR 293 N -3.59 0.90 0.65 4.55 2.02 -0.47 -5.09 117.35 116.34 1gwh s TYR 293 Ca -0.12 -1.51 -0.15 0.00 -0.37 0.00 0.00 57.07 54.93 1gwh s TYR 293 Cb 0.06 -1.16 -0.01 0.00 -0.40 0.00 0.00 41.96 40.46 1gwh s TYR 293 CO 0.87 -0.83 1.11 -1.25 -1.57 0.00 0.00 175.55 173.87 1gwh s PRO 294 N 1.39 2.86 0.24 -1.71 0.04 -1.15 -4.22 135.00 132.45 1gwh s PRO 294 Ca 0.14 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.27 1gwh s PRO 294 Cb -0.20 -1.96 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 1gwh s PRO 294 CO -0.15 -1.20 1.30 1.03 0.04 0.00 0.00 177.00 178.01 1gwh s ARG 295 N -4.06 4.40 -0.15 4.56 0.52 -1.26 -4.55 118.95 118.40 1gwh s ARG 295 Ca 0.67 2.09 0.02 0.00 -0.52 0.00 0.00 55.73 57.99 1gwh s ARG 295 Cb -0.20 -3.16 0.01 0.00 0.52 0.00 0.00 34.95 32.12 1gwh s ARG 295 CO 0.41 -0.20 -0.22 0.42 0.02 0.00 0.00 175.30 175.73 1gwh s ILE 296 N -0.33 2.07 0.37 1.52 1.01 0.23 -4.92 121.20 121.15 1gwh s ILE 296 Ca 0.54 -0.97 -0.26 0.00 0.00 0.00 0.00 60.65 59.96 1gwh s ILE 296 Cb -0.37 -1.83 -0.09 0.00 0.01 0.00 0.00 42.46 40.18 1gwh s ILE 296 CO 0.42 0.55 1.14 -0.75 0.00 0.00 0.00 174.94 176.30 1gwh s LYS 297 N 0.89 4.20 -0.06 2.79 2.20 -1.26 -0.75 119.74 127.76 1gwh s LYS 297 Ca -0.05 1.79 -0.03 0.00 -0.36 0.00 0.00 55.97 57.32 1gwh s LYS 297 Cb -0.15 -2.77 -0.03 0.00 -1.51 0.00 0.00 37.83 33.38 1gwh s LYS 297 CO -0.04 -0.18 -0.08 0.28 -0.36 0.00 0.00 175.35 174.97 1gwh n VAL 298 N 0.29 0.41 -3.24 4.02 0.31 0.13 -4.72 118.33 115.53 1gwh n VAL 298 Ca 0.03 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1gwh n VAL 298 Cb 0.46 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 1gwh n VAL 298 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1gwh n GLY 299 N 2.64 -0.93 3.03 2.92 0.00 -1.21 -1.64 105.19 110.00 1gwh n GLY 299 Ca -0.12 -0.81 -0.21 0.00 0.00 0.00 0.00 46.02 44.88 1gwh n GLY 299 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gwh s THR 300 N -3.00 0.89 -0.18 2.61 2.01 -0.43 -0.51 115.64 117.02 1gwh s THR 300 Ca 0.00 -0.42 -0.07 0.00 0.31 0.00 0.00 61.69 61.51 1gwh s THR 300 Cb 0.00 -0.79 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 1gwh s THR 300 CO 0.00 0.27 0.05 -0.22 -0.69 0.00 0.00 174.62 174.03 1gwh s LEU 301 N 0.14 3.71 -0.06 4.42 2.96 1.00 -1.48 118.68 129.37 1gwh s LEU 301 Ca -0.03 0.03 0.05 0.00 -0.22 0.00 0.00 54.13 53.96 1gwh s LEU 301 Cb -0.09 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.66 1gwh s LEU 301 CO 0.01 0.16 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.10 1gwh s THR 302 N 0.48 1.66 -0.21 3.68 2.01 -0.08 -1.07 115.64 122.11 1gwh s THR 302 Ca 0.02 -0.84 -0.09 0.00 0.31 0.00 0.00 61.69 61.10 1gwh s THR 302 Cb -0.13 -1.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 1gwh s THR 302 CO 0.01 0.47 0.11 -0.76 -0.69 0.00 0.00 174.62 173.76 1gwh s LEU 303 N 0.07 3.96 0.00 4.42 1.43 -0.51 -0.92 118.68 127.13 1gwh s LEU 303 Ca -0.07 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 1gwh s LEU 303 Cb -0.13 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.05 1gwh s LEU 303 CO 0.04 0.12 0.27 -0.46 0.23 0.00 0.00 176.35 176.55 1gwh n ASN 304 N 3.91 0.00 -3.68 2.29 0.23 -0.32 -3.74 115.26 113.95 1gwh n ASN 304 Ca -0.16 -1.00 -0.11 0.00 -0.53 0.00 0.00 54.58 52.78 1gwh n ASN 304 Cb 0.52 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.10 1gwh n ASN 304 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1gwh s ARG 305 N 0.00 0.25 0.64 -3.83 3.52 -0.84 -5.00 118.95 113.68 1gwh s ARG 305 Ca 0.00 0.82 -0.14 0.00 -0.13 0.00 0.00 55.73 56.27 1gwh s ARG 305 Cb 0.00 0.07 -0.02 0.00 -1.56 0.00 0.00 34.95 33.45 1gwh s ARG 305 CO 0.00 -0.24 1.07 -0.80 -0.81 0.00 0.00 175.30 174.52 1gwh s ASN 306 N 2.15 5.50 0.63 -2.12 0.01 -1.26 -0.31 114.94 119.53 1gwh s ASN 306 Ca -0.03 1.82 -0.18 0.00 -0.71 0.00 0.00 52.86 53.76 1gwh s ASN 306 Cb -0.11 -2.53 -0.02 0.00 0.41 0.00 0.00 41.25 39.00 1gwh s ASN 306 CO -0.11 -1.36 1.19 -2.84 -1.51 0.00 0.00 177.10 172.48 1gwh s PRO 307 N -4.30 2.79 0.18 -0.60 0.02 -1.26 -4.83 135.00 127.01 1gwh s PRO 307 Ca 0.63 1.75 0.21 0.00 0.02 0.00 0.00 61.00 63.61 1gwh s PRO 307 Cb -0.17 -1.92 -0.02 0.00 0.02 0.00 0.00 34.50 32.42 1gwh s PRO 307 CO 0.42 -1.33 1.01 0.93 -0.33 0.00 0.00 177.00 177.71 1gwh h GLU 308 N 0.55 0.00 -2.56 5.54 5.08 -2.00 -3.44 114.58 117.74 1gwh h GLU 308 Ca -0.49 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.55 1gwh h GLU 308 Cb 1.29 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 30.18 1gwh h GLU 308 CO 0.54 0.06 -0.63 1.21 -1.00 0.00 0.00 179.01 179.19 1gwh s ASN 309 N -5.47 1.36 0.13 1.42 3.84 -1.26 -5.05 114.94 109.91 1gwh s ASN 309 Ca -0.01 -0.20 -0.19 0.00 0.21 0.00 0.00 52.86 52.67 1gwh s ASN 309 Cb 0.09 0.37 -0.05 0.00 -0.55 0.00 0.00 41.25 41.11 1gwh s ASN 309 CO 0.79 -0.32 1.77 -0.74 -2.79 0.00 0.00 177.10 175.81 1gwh h HIS 310 N 8.32 0.23 -0.26 0.43 -0.00 -1.97 -1.01 115.15 120.88 1gwh h HIS 310 Ca -0.17 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.19 1gwh h HIS 310 Cb 1.15 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 28.48 1gwh h HIS 310 CO 0.15 0.14 0.07 0.35 -0.00 0.00 0.00 177.93 178.64 1gwh h PHE 311 N 0.26 0.43 -0.10 5.26 3.04 -1.96 0.73 116.94 124.59 1gwh h PHE 311 Ca 0.09 -0.05 -0.16 0.00 3.98 0.00 0.00 57.97 61.82 1gwh h PHE 311 Cb 0.00 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.38 1gwh h PHE 311 CO -0.08 0.48 -0.64 0.00 -2.02 0.00 0.00 178.31 176.05 1gwh h ALA 312 N 0.90 0.71 0.00 2.41 0.00 -1.94 -0.74 119.26 120.60 1gwh h ALA 312 Ca 0.08 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 54.30 1gwh h ALA 312 Cb 0.26 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1gwh h ALA 312 CO -0.00 0.73 -2.03 1.04 0.00 0.00 0.00 179.25 178.99 1gwh n GLN 313 N -3.88 0.77 -0.01 0.00 6.02 -0.39 -4.37 117.38 115.51 1gwh n GLN 313 Ca -0.03 -0.11 -0.05 0.00 -0.01 0.00 0.00 57.00 56.79 1gwh n GLN 313 Cb 0.65 -1.46 -0.02 0.00 1.02 0.00 0.00 30.24 30.43 1gwh n GLN 313 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1gwh n ILE 314 N -2.37 0.87 -0.04 5.09 2.08 0.14 -4.28 119.36 120.85 1gwh n ILE 314 Ca -0.14 0.13 -0.02 0.00 0.56 0.00 0.00 62.75 63.28 1gwh n ILE 314 Cb 0.74 -1.70 0.23 0.00 -0.75 0.00 0.00 39.64 38.16 1gwh n ILE 314 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 1gwh h GLU 315 N -0.26 0.63 -0.01 0.38 4.57 -1.07 -2.45 114.58 116.36 1gwh h GLU 315 Ca -0.09 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 1gwh h GLU 315 Cb 0.70 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1gwh h GLU 315 CO -0.05 0.66 -0.13 0.43 -1.18 0.00 0.00 179.01 178.74 1gwh n SER 316 N -4.24 1.40 -4.76 1.04 7.64 -0.30 -4.88 113.62 109.52 1gwh n SER 316 Ca 0.02 -1.26 -0.38 0.00 1.01 0.00 0.00 58.87 58.25 1gwh n SER 316 Cb 0.28 0.08 0.01 0.00 -1.01 0.00 0.00 64.21 63.57 1gwh n SER 316 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gwh s ALA 317 N -2.24 3.03 -0.33 -0.43 0.00 -0.93 -4.92 121.76 115.94 1gwh s ALA 317 Ca 0.31 1.17 -0.01 0.00 0.00 0.00 0.00 51.96 53.43 1gwh s ALA 317 Cb 0.20 -3.48 0.11 0.00 0.00 0.00 0.00 23.12 19.95 1gwh s ALA 317 CO 0.42 -0.95 0.15 0.00 0.00 0.00 0.00 175.76 175.38 1gwh s ALA 318 N -1.37 1.21 0.21 0.00 0.00 -1.26 -5.01 121.76 115.54 1gwh s ALA 318 Ca 0.64 -1.66 -0.13 0.00 0.00 0.00 0.00 51.96 50.81 1gwh s ALA 318 Cb -0.36 -1.58 -0.07 0.00 0.00 0.00 0.00 23.12 21.10 1gwh s ALA 318 CO 0.44 -1.81 0.58 -0.06 0.00 0.00 0.00 175.76 174.91 1gwh s PHE 319 N 1.48 3.50 -0.16 0.00 0.08 -1.26 -5.02 117.98 116.60 1gwh s PHE 319 Ca 0.12 1.01 -0.10 0.00 0.12 0.00 0.00 56.93 58.09 1gwh s PHE 319 Cb -0.19 -2.35 0.06 0.00 -0.57 0.00 0.00 43.02 39.96 1gwh s PHE 319 CO -0.20 0.32 0.40 0.45 -0.10 0.00 0.00 175.22 176.09 1gwh s SER 320 N -2.05 -0.49 0.55 1.36 0.15 -1.26 -4.81 113.70 107.15 1gwh s SER 320 Ca 0.44 0.86 0.37 0.00 0.70 0.00 0.00 55.95 58.32 1gwh s SER 320 Cb -0.13 0.76 1.97 0.00 -1.71 0.00 0.00 66.02 66.92 1gwh s SER 320 CO 0.20 -0.18 2.13 -0.65 1.20 0.00 0.00 173.24 175.93 1gwh h PRO 321 N 6.89 0.00 0.00 5.44 0.11 -1.82 -0.76 132.00 141.86 1gwh h PRO 321 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1gwh h PRO 321 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1gwh h PRO 321 CO 0.29 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.74 1gwh h SER 322 N 0.00 0.00 -0.53 -2.05 4.64 -1.82 -3.35 113.55 110.44 1gwh h SER 322 Ca 0.00 0.00 -0.72 0.00 -0.47 0.00 0.00 61.79 60.60 1gwh h SER 322 Cb 0.03 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.06 1gwh h SER 322 CO 0.00 0.00 2.87 0.59 -0.87 0.00 0.00 176.83 179.42 1gwh n ASN 323 N -2.36 5.59 -4.93 4.97 3.02 -0.29 -4.92 115.26 116.35 1gwh n ASN 323 Ca 0.01 -2.90 -0.26 0.00 -0.03 0.00 0.00 54.58 51.39 1gwh n ASN 323 Cb 0.16 -1.55 0.06 0.00 -0.61 0.00 0.00 39.78 37.84 1gwh n ASN 323 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1gwh s THR 324 N 1.70 2.58 0.13 3.41 -4.23 -1.26 -1.60 115.64 116.37 1gwh s THR 324 Ca 0.50 -0.23 0.04 0.00 -1.18 0.00 0.00 61.69 60.81 1gwh s THR 324 Cb 0.14 -3.09 -0.04 0.00 1.34 0.00 0.00 72.50 70.84 1gwh s THR 324 CO -0.06 -0.10 -0.09 0.68 -0.54 0.00 0.00 174.62 174.51 1gwh s VAL 325 N -3.17 1.01 0.18 2.29 -7.23 -1.26 -4.84 120.40 107.38 1gwh s VAL 325 Ca 0.59 -1.98 -0.33 0.00 -1.81 0.00 0.00 61.98 58.45 1gwh s VAL 325 Cb -0.11 -1.75 -0.15 0.00 0.56 0.00 0.00 36.38 34.94 1gwh s VAL 325 CO 0.44 -0.76 1.27 -2.65 -0.31 0.00 0.00 175.10 173.09 1gwh n PRO 326 N -0.07 1.46 0.00 4.82 -0.02 -1.26 -1.44 135.00 138.49 1gwh n PRO 326 Ca -0.11 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1gwh n PRO 326 Cb 0.60 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1gwh n PRO 326 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gwh n GLY 327 N 2.17 1.27 2.82 -1.23 0.00 -1.26 -3.52 105.19 105.43 1gwh n GLY 327 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 1gwh n GLY 327 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gwh s ILE 328 N -2.30 0.27 0.39 -0.61 1.01 -0.52 -1.48 121.20 117.96 1gwh s ILE 328 Ca 0.00 0.07 0.05 0.00 0.00 0.00 0.00 60.65 60.76 1gwh s ILE 328 Cb 0.00 -0.37 -0.02 0.00 0.01 0.00 0.00 42.46 42.07 1gwh s ILE 328 CO 0.00 0.18 0.17 -0.83 0.00 0.00 0.00 174.94 174.46 1gwh s GLY 329 N 1.23 2.57 0.00 6.18 0.00 0.12 -4.04 107.32 113.38 1gwh s GLY 329 Ca -0.07 -1.39 0.00 0.00 0.00 0.00 0.00 44.72 43.26 1gwh s GLY 329 CO -0.02 -1.75 0.00 1.04 0.00 0.00 0.00 173.10 172.37 1gwh n LEU 330 N -0.86 0.00 -4.06 0.66 4.77 -1.26 -1.77 117.00 114.48 1gwh n LEU 330 Ca -0.03 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.84 1gwh n LEU 330 Cb 0.64 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.67 1gwh n LEU 330 CO 0.34 -0.27 0.08 -0.94 -1.33 0.00 0.00 177.39 175.27 1gwh s SER 331 N -1.00 0.21 0.00 -1.43 1.04 -1.26 -3.22 113.70 108.04 1gwh s SER 331 Ca 0.00 -1.17 0.00 0.00 0.48 0.00 0.00 55.95 55.26 1gwh s SER 331 Cb 0.00 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1gwh s SER 331 CO 0.00 -1.12 0.28 -2.65 0.98 0.00 0.00 173.24 170.73 1gwh n PRO 332 N -0.40 0.30 -2.15 4.02 -0.02 -1.26 -4.63 135.00 130.85 1gwh n PRO 332 Ca -0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.05 1gwh n PRO 332 Cb 0.63 -1.02 -0.02 0.00 -0.02 0.00 0.00 33.50 33.06 1gwh n PRO 332 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1gwh s ASP 333 N -1.54 6.29 0.31 2.55 -1.08 -1.26 -4.89 116.67 117.06 1gwh s ASP 333 Ca 0.00 1.38 0.03 0.00 -0.52 0.00 0.00 52.55 53.44 1gwh s ASP 333 Cb 0.00 -2.53 0.61 0.00 -1.46 0.00 0.00 42.92 39.54 1gwh s ASP 333 CO 0.00 -1.37 1.88 0.03 0.52 0.00 0.00 175.17 176.23 1gwh h ARG 334 N 11.08 0.90 -0.78 4.34 3.08 -1.80 -1.10 114.38 130.10 1gwh h ARG 334 Ca -0.32 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.66 1gwh h ARG 334 Cb 1.14 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.95 1gwh h ARG 334 CO 1.02 0.60 0.44 0.52 -1.07 0.00 0.00 179.97 181.48 1gwh h MET 335 N 0.93 1.08 -0.54 0.04 2.86 -1.90 -1.84 114.93 115.57 1gwh h MET 335 Ca 0.43 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.87 1gwh h MET 335 Cb 0.41 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1gwh h MET 335 CO -0.20 0.79 0.03 1.25 1.06 0.00 0.00 176.91 179.84 1gwh h LEU 336 N 1.08 0.91 -1.12 1.22 5.85 -1.59 -2.17 115.31 119.50 1gwh h LEU 336 Ca 0.28 -0.29 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1gwh h LEU 336 Cb 0.01 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 1gwh h LEU 336 CO -0.05 0.98 0.18 -0.07 -0.34 0.00 0.00 178.44 179.15 1gwh h LEU 337 N 0.82 0.74 -0.66 2.25 3.38 -1.16 -1.86 115.31 118.82 1gwh h LEU 337 Ca 0.16 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1gwh h LEU 337 Cb 0.50 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1gwh h LEU 337 CO 0.02 0.69 0.07 1.23 0.09 0.00 0.00 178.44 180.55 1gwh h GLY 338 N 0.94 1.20 2.00 0.83 0.00 -1.14 -2.70 103.07 104.19 1gwh h GLY 338 Ca 0.18 -0.83 -0.03 0.00 0.00 0.00 0.00 47.33 46.66 1gwh h GLY 338 CO -0.01 0.76 -0.14 3.21 0.00 0.00 0.00 176.54 180.36 1gwh h ARG 339 N 1.03 0.00 -0.05 4.80 3.08 -0.92 -2.30 114.38 120.02 1gwh h ARG 339 Ca 0.19 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.22 1gwh h ARG 339 Cb 0.49 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1gwh h ARG 339 CO 0.02 0.14 -0.10 0.00 -1.07 0.00 0.00 179.97 178.96 1gwh h ALA 340 N 1.86 1.74 0.12 0.04 0.00 -1.00 -2.91 119.26 119.11 1gwh h ALA 340 Ca -0.00 -0.12 -0.29 0.00 0.00 0.00 0.00 54.91 54.50 1gwh h ALA 340 Cb 0.28 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1gwh h ALA 340 CO 0.02 0.19 -1.48 0.35 0.00 0.00 0.00 179.25 178.33 1gwh h PHE 341 N 0.07 0.48 -0.11 0.00 3.57 -1.55 -3.42 116.94 115.98 1gwh h PHE 341 Ca 0.01 -0.35 -0.14 0.00 3.53 0.00 0.00 57.97 61.03 1gwh h PHE 341 Cb 0.23 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1gwh h PHE 341 CO 0.00 1.58 -0.53 0.00 -2.23 0.00 0.00 178.31 177.13 1gwh h ALA 342 N -0.02 0.90 0.08 2.41 0.00 -1.22 -3.08 119.26 118.32 1gwh h ALA 342 Ca -0.31 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.10 1gwh h ALA 342 Cb 1.81 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1gwh h ALA 342 CO 0.07 0.68 -0.04 1.88 0.00 0.00 0.00 179.25 181.85 1gwh h TYR 343 N 0.24 -0.09 -0.81 0.00 -1.99 -1.84 -2.01 116.97 110.46 1gwh h TYR 343 Ca 0.01 -0.00 0.08 0.00 2.00 0.00 0.00 58.73 60.82 1gwh h TYR 343 Cb 1.01 0.03 -0.07 0.00 2.00 0.00 0.00 36.73 39.70 1gwh h TYR 343 CO 0.02 0.45 0.47 1.25 -0.00 0.00 0.00 178.16 180.35 1gwh h HIS 344 N -0.73 0.86 -0.13 4.88 2.76 -1.86 -0.91 115.15 120.03 1gwh h HIS 344 Ca -0.01 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1gwh h HIS 344 Cb 0.58 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.27 1gwh h HIS 344 CO 0.12 0.38 0.08 0.22 -1.30 0.00 0.00 177.93 177.43 1gwh h ASP 345 N 0.82 0.15 -0.43 3.26 3.58 -1.52 -2.30 116.42 119.98 1gwh h ASP 345 Ca 0.38 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.81 1gwh h ASP 345 Cb 0.30 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.29 1gwh h ASP 345 CO -0.22 0.11 0.22 0.00 -2.88 0.00 0.00 179.24 176.46 1gwh h ALA 346 N 1.04 1.51 0.00 -0.78 0.00 -0.71 -2.80 119.26 117.52 1gwh h ALA 346 Ca 0.05 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1gwh h ALA 346 Cb -0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1gwh h ALA 346 CO -0.01 0.39 -0.52 1.96 0.00 0.00 0.00 179.25 181.07 1gwh h GLN 347 N 0.65 0.00 -0.60 0.00 4.20 -0.82 0.12 115.11 118.67 1gwh h GLN 347 Ca 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 1gwh h GLN 347 Cb 0.08 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 1gwh h GLN 347 CO -0.02 0.52 0.32 -0.07 -0.67 0.00 0.00 178.83 178.91 1gwh h LEU 348 N 0.00 0.73 0.07 1.46 3.38 -1.14 -0.81 115.31 119.00 1gwh h LEU 348 Ca -0.01 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1gwh h LEU 348 Cb 1.11 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 41.68 1gwh h LEU 348 CO 0.07 0.59 -0.50 0.22 0.09 0.00 0.00 178.44 178.91 1gwh h TYR 349 N 0.83 0.27 -0.31 1.13 3.20 -1.51 -2.93 116.97 117.64 1gwh h TYR 349 Ca 0.21 -0.20 -0.05 0.00 3.14 0.00 0.00 58.73 61.84 1gwh h TYR 349 Cb 0.03 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 1gwh h TYR 349 CO 0.01 1.19 0.02 -0.09 -1.64 0.00 0.00 178.16 177.65 1gwh h ARG 350 N -0.68 0.54 0.00 1.82 2.43 -0.92 -3.40 114.38 114.16 1gwh h ARG 350 Ca -0.10 -0.16 -0.14 0.00 -0.81 0.00 0.00 59.98 58.77 1gwh h ARG 350 Cb 1.34 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.82 1gwh h ARG 350 CO 0.06 0.66 -1.35 0.28 -1.51 0.00 0.00 179.97 178.11 1gwh n VAL 351 N -4.58 0.76 0.00 0.20 0.31 -0.36 -4.38 118.33 110.28 1gwh n VAL 351 Ca -0.02 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 1gwh n VAL 351 Cb 0.24 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 1gwh n VAL 351 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1gwh n GLY 352 N 2.40 2.92 0.35 2.92 0.00 -0.86 -4.92 105.19 107.99 1gwh n GLY 352 Ca -0.18 -1.35 0.05 0.00 0.00 0.00 0.00 46.02 44.54 1gwh n GLY 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gwh h ALA 353 N 0.00 1.66 -0.96 4.61 0.00 -1.86 -2.04 119.26 120.67 1gwh h ALA 353 Ca 0.00 -0.03 -0.53 0.00 0.00 0.00 0.00 54.91 54.35 1gwh h ALA 353 Cb 0.00 -0.21 -0.30 0.00 0.00 0.00 0.00 17.79 17.28 1gwh h ALA 353 CO 0.00 0.25 0.68 0.72 0.00 0.00 0.00 179.25 180.91 1gwh n HIS 354 N -4.47 3.00 -0.26 0.00 8.25 -1.26 -4.61 115.22 115.88 1gwh n HIS 354 Ca 0.09 -2.05 0.20 0.00 -0.26 0.00 0.00 57.72 55.70 1gwh n HIS 354 Cb 0.17 -1.03 0.52 0.00 1.12 0.00 0.00 29.99 30.76 1gwh n HIS 354 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1gwh h VAL 355 N 0.97 0.65 -0.04 1.59 3.04 -1.70 -0.00 116.25 120.76 1gwh h VAL 355 Ca 0.61 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 66.17 1gwh h VAL 355 Cb 2.39 0.22 0.00 0.00 -2.01 0.00 0.00 31.29 31.89 1gwh h VAL 355 CO 1.17 0.07 0.00 0.59 -1.01 0.00 0.00 177.57 178.39 1gwh n ASN 356 N -4.52 0.48 -0.03 3.17 3.02 -1.26 -2.46 115.26 113.66 1gwh n ASN 356 Ca 0.20 -1.45 0.11 0.00 -0.03 0.00 0.00 54.58 53.41 1gwh n ASN 356 Cb 0.74 -0.03 0.10 0.00 -0.61 0.00 0.00 39.78 39.98 1gwh n ASN 356 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gwh n GLN 357 N -0.49 0.08 -2.24 3.52 6.02 -0.01 -3.74 117.38 120.51 1gwh n GLN 357 Ca 0.16 -0.06 -0.40 0.00 -0.01 0.00 0.00 57.00 56.69 1gwh n GLN 357 Cb 0.15 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.88 1gwh n GLN 357 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1gwh s LEU 358 N -2.96 4.40 0.27 1.08 1.43 -1.03 -4.78 118.68 117.10 1gwh s LEU 358 Ca 0.11 2.52 -0.00 0.00 -1.03 0.00 0.00 54.13 55.72 1gwh s LEU 358 Cb 0.17 -3.73 0.61 0.00 0.03 0.00 0.00 46.19 43.27 1gwh s LEU 358 CO 0.76 -0.48 1.69 -0.65 0.23 0.00 0.00 176.35 177.90 1gwh h PRO 359 N 3.31 0.32 0.00 1.29 0.11 -1.92 0.79 132.00 135.91 1gwh h PRO 359 Ca -0.48 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1gwh h PRO 359 Cb 1.23 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1gwh h PRO 359 CO 0.65 0.21 -0.12 -0.24 -0.21 0.00 0.00 178.00 178.29 1gwh h VAL 360 N 0.33 0.77 -0.01 3.15 3.04 -1.91 -2.82 116.25 118.81 1gwh h VAL 360 Ca 0.50 -0.49 0.00 0.00 -1.01 0.00 0.00 66.70 65.70 1gwh h VAL 360 Cb 0.91 1.29 0.00 0.00 -2.01 0.00 0.00 31.29 31.48 1gwh h VAL 360 CO -0.53 0.12 -0.66 0.59 -1.01 0.00 0.00 177.57 176.08 1gwh n ASN 361 N -3.93 1.55 -4.77 3.17 3.02 0.19 -4.96 115.26 109.53 1gwh n ASN 361 Ca -0.02 -1.26 -0.39 0.00 -0.03 0.00 0.00 54.58 52.89 1gwh n ASN 361 Cb 0.22 0.65 -0.04 0.00 -0.61 0.00 0.00 39.78 40.00 1gwh n ASN 361 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1gwh s ARG 362 N -2.69 4.34 0.82 3.52 0.52 -0.68 -4.82 118.95 119.96 1gwh s ARG 362 Ca 0.15 1.72 -0.12 0.00 -0.52 0.00 0.00 55.73 56.96 1gwh s ARG 362 Cb 0.17 -2.85 0.09 0.00 0.52 0.00 0.00 34.95 32.88 1gwh s ARG 362 CO 0.69 -0.04 1.14 -1.25 0.02 0.00 0.00 175.30 175.86 1gwh s PRO 363 N -2.00 1.85 0.11 3.54 0.04 -1.26 -4.98 135.00 132.29 1gwh s PRO 363 Ca 0.52 0.30 0.04 0.00 0.04 0.00 0.00 61.00 61.90 1gwh s PRO 363 Cb -0.28 -1.92 -0.21 0.00 0.04 0.00 0.00 34.50 32.12 1gwh s PRO 363 CO 0.36 -1.71 1.25 0.87 0.04 0.00 0.00 177.00 177.81 1gwh h LYS 364 N -1.14 0.09 -7.22 4.56 1.57 -1.89 -3.46 116.57 109.06 1gwh h LYS 364 Ca -0.47 -0.14 -0.45 0.00 -1.87 0.00 0.00 60.65 57.71 1gwh h LYS 364 Cb 1.31 0.05 0.07 0.00 0.08 0.00 0.00 32.23 33.75 1gwh h LYS 364 CO 0.63 1.05 0.18 0.54 -0.57 0.00 0.00 179.45 181.29 1gwh s ASN 365 N -6.85 4.86 0.08 0.86 4.22 -1.26 -5.02 114.94 111.82 1gwh s ASN 365 Ca -0.01 0.36 -0.31 0.00 -2.14 0.00 0.00 52.86 50.76 1gwh s ASN 365 Cb 0.09 -1.03 -0.06 0.00 1.28 0.00 0.00 41.25 41.53 1gwh s ASN 365 CO 0.84 -1.54 1.26 0.00 -2.04 0.00 0.00 177.10 175.62 1gwh s ALA 366 N -3.17 3.45 -0.11 3.54 0.00 -1.26 -5.01 121.76 119.20 1gwh s ALA 366 Ca 0.60 0.93 -0.17 0.00 0.00 0.00 0.00 51.96 53.32 1gwh s ALA 366 Cb -0.10 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 1gwh s ALA 366 CO 0.44 -0.50 0.44 0.08 0.00 0.00 0.00 175.76 176.22 1gwh s VAL 367 N 1.10 5.19 -0.43 0.00 1.01 -1.26 -5.02 120.40 121.00 1gwh s VAL 367 Ca 0.61 0.87 0.02 0.00 0.00 0.00 0.00 61.98 63.48 1gwh s VAL 367 Cb -0.32 -3.77 0.15 0.00 0.00 0.00 0.00 36.38 32.44 1gwh s VAL 367 CO 0.29 0.36 0.28 -2.28 0.00 0.00 0.00 175.10 173.75 1gwh s HIS 368 N 0.43 1.48 -0.02 5.22 5.04 -1.26 -5.12 115.29 121.06 1gwh s HIS 368 Ca 0.24 -2.21 0.06 0.00 -1.54 0.00 0.00 55.06 51.61 1gwh s HIS 368 Cb -0.15 -1.39 -0.01 0.00 0.04 0.00 0.00 32.58 31.06 1gwh s HIS 368 CO 0.09 -0.79 -0.20 1.21 -2.34 0.00 0.00 174.74 172.71 1gwh s ASN 369 N 0.36 2.37 -1.31 9.88 3.84 -1.26 -5.05 114.94 123.77 1gwh s ASN 369 Ca 0.22 -0.37 -0.12 0.00 0.21 0.00 0.00 52.86 52.81 1gwh s ASN 369 Cb -0.15 -0.28 0.13 0.00 -0.55 0.00 0.00 41.25 40.40 1gwh s ASN 369 CO -0.06 0.24 1.86 -1.22 -2.79 0.00 0.00 177.10 175.14 1gwh n TYR 370 N 2.61 3.55 -3.77 0.43 4.02 -1.26 -4.84 117.16 117.89 1gwh n TYR 370 Ca -0.15 -2.93 -0.13 0.00 -0.01 0.00 0.00 57.90 54.68 1gwh n TYR 370 Cb 0.53 -2.17 -0.13 0.00 -0.02 0.00 0.00 39.34 37.55 1gwh n TYR 370 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1gwh s ALA 371 N 1.46 -0.39 0.04 -0.72 0.00 -1.26 -5.15 121.76 115.75 1gwh s ALA 371 Ca 0.43 0.66 -0.03 0.00 0.00 0.00 0.00 51.96 53.02 1gwh s ALA 371 Cb 0.08 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 1gwh s ALA 371 CO -0.01 -0.13 0.02 -0.06 0.00 0.00 0.00 175.76 175.58 1gwh s PHE 372 N 0.74 0.34 0.00 0.00 0.40 -1.26 -5.00 117.98 113.20 1gwh s PHE 372 Ca -0.05 -0.74 0.00 0.00 -0.60 0.00 0.00 56.93 55.54 1gwh s PHE 372 Cb -0.07 -0.25 0.00 0.00 0.51 0.00 0.00 43.02 43.21 1gwh s PHE 372 CO -0.04 -0.34 0.00 0.39 0.70 0.00 0.00 175.22 175.93 1gwh n GLU 373 N 0.66 0.00 0.00 0.44 1.02 -1.26 -5.07 120.64 116.44 1gwh n GLU 373 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 1gwh n GLU 373 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.01 1gwh n GLU 373 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gwh n GLY 374 N 0.00 0.01 3.76 0.62 0.00 -1.26 -4.79 105.19 103.53 1gwh n GLY 374 Ca 0.00 -1.73 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 1gwh n GLY 374 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gwh s GLN 375 N -2.62 3.45 -1.38 1.61 -0.21 -1.26 -3.70 119.66 115.56 1gwh s GLN 375 Ca 0.00 2.14 -0.06 0.00 0.02 0.00 0.00 55.36 57.46 1gwh s GLN 375 Cb 0.00 -2.40 0.03 0.00 1.00 0.00 0.00 33.01 31.64 1gwh s GLN 375 CO 0.00 -0.91 0.87 -1.33 -2.12 0.00 0.00 175.29 171.80 1gwh n MET 376 N -0.66 -5.59 -2.69 2.91 2.81 -1.26 -4.51 117.12 108.14 1gwh n MET 376 Ca 0.08 0.65 -0.42 0.00 -1.81 0.00 0.00 57.70 56.21 1gwh n MET 376 Cb 0.45 -5.42 -0.03 0.00 -0.71 0.00 0.00 33.22 27.51 1gwh n MET 376 CO 0.00 0.00 0.00 -0.46 1.51 0.00 0.00 175.97 177.02 1gwh s TRP 377 N -3.48 2.47 -0.06 2.03 -0.00 -1.24 -4.80 118.94 113.85 1gwh s TRP 377 Ca 0.29 -0.31 -0.22 0.00 -0.00 0.00 0.00 56.10 55.87 1gwh s TRP 377 Cb -0.14 -4.48 -0.31 0.00 -0.00 0.00 0.00 33.47 28.54 1gwh s TRP 377 CO 0.80 -1.88 0.85 1.88 -0.00 0.00 0.00 176.95 178.60 1gwh h TYR 378 N 9.81 0.50 -3.59 5.86 -1.99 -1.95 -3.41 116.97 122.20 1gwh h TYR 378 Ca -0.27 -0.37 -0.71 0.00 2.00 0.00 0.00 58.73 59.38 1gwh h TYR 378 Cb 1.06 -0.02 -0.33 0.00 2.00 0.00 0.00 36.73 39.43 1gwh h TYR 378 CO 1.06 1.32 -0.28 -0.51 -0.00 0.00 0.00 178.16 179.75 1gwh s ASP 379 N -6.94 5.53 0.71 3.88 1.01 -1.26 -5.07 116.67 114.52 1gwh s ASP 379 Ca -0.15 -2.80 -0.09 0.00 0.71 0.00 0.00 52.55 50.22 1gwh s ASP 379 Cb 0.01 -1.92 0.04 0.00 1.01 0.00 0.00 42.92 42.06 1gwh s ASP 379 CO 0.82 -0.41 1.06 -1.38 0.21 0.00 0.00 175.17 175.47 1gwh s HIS 380 N 0.01 3.13 -0.70 4.23 -3.43 -1.26 -4.99 115.29 112.28 1gwh s HIS 380 Ca 0.17 0.76 0.16 0.00 -0.80 0.00 0.00 55.06 55.36 1gwh s HIS 380 Cb -0.18 -3.14 0.76 0.00 -1.43 0.00 0.00 32.58 28.59 1gwh s HIS 380 CO -0.04 -1.31 1.68 0.25 -2.00 0.00 0.00 174.74 173.32 1gwh n THR 381 N -2.99 2.28 -1.06 -5.38 -2.24 -1.26 -5.05 114.28 98.58 1gwh n THR 381 Ca 0.07 -1.32 0.00 0.00 -2.27 0.00 0.00 64.05 60.53 1gwh n THR 381 Cb 0.59 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1gwh n THR 381 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gwh n GLY 382 N 0.85 2.96 1.80 3.38 0.00 -1.26 -2.27 105.19 110.66 1gwh n GLY 382 Ca 0.27 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 46.19 1gwh n GLY 382 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gwh n ASP 383 N 2.39 5.29 -4.67 1.61 5.75 -1.26 -4.99 116.55 120.68 1gwh n ASP 383 Ca 0.00 -2.89 -0.41 0.00 -0.01 0.00 0.00 54.79 51.48 1gwh n ASP 383 Cb 0.00 -0.68 0.01 0.00 -1.03 0.00 0.00 41.12 39.42 1gwh n ASP 383 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gwh n ARG 384 N 0.50 1.74 -1.74 0.11 1.74 -0.96 -4.91 116.66 113.14 1gwh n ARG 384 Ca 0.27 0.62 -0.41 0.00 -0.77 0.00 0.00 57.85 57.56 1gwh n ARG 384 Cb 1.15 -2.25 0.01 0.00 -1.02 0.00 0.00 32.46 30.34 1gwh n ARG 384 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1gwh n SER 385 N 0.36 3.14 -1.28 0.55 7.64 -1.26 -4.92 113.62 117.84 1gwh n SER 385 Ca 0.07 1.15 0.11 0.00 1.01 0.00 0.00 58.87 61.22 1gwh n SER 385 Cb 0.39 -1.56 0.31 0.00 -1.01 0.00 0.00 64.21 62.33 1gwh n SER 385 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1gwh n THR 386 N -0.01 0.99 -3.87 0.44 -2.24 -1.26 -4.97 114.28 103.35 1gwh n THR 386 Ca 0.05 -1.00 -0.09 0.00 -2.27 0.00 0.00 64.05 60.74 1gwh n THR 386 Cb 0.40 0.51 -0.07 0.00 -2.10 0.00 0.00 70.33 69.06 1gwh n THR 386 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1gwh s TYR 387 N -1.01 0.19 0.02 4.78 1.13 -1.26 -5.06 117.35 116.15 1gwh s TYR 387 Ca 0.46 -0.61 -0.02 0.00 -1.41 0.00 0.00 57.07 55.49 1gwh s TYR 387 Cb 0.24 -0.05 -0.02 0.00 -1.10 0.00 0.00 41.96 41.04 1gwh s TYR 387 CO 0.32 -0.58 0.02 0.14 -2.51 0.00 0.00 175.55 172.93 1gwh s VAL 388 N -3.88 0.12 0.86 -3.49 -7.23 -1.26 -4.09 120.40 101.43 1gwh s VAL 388 Ca 0.07 -0.97 -0.11 0.00 -1.81 0.00 0.00 61.98 59.17 1gwh s VAL 388 Cb 0.04 -0.49 0.12 0.00 0.56 0.00 0.00 36.38 36.61 1gwh s VAL 388 CO -0.09 -0.53 1.15 -2.84 -0.31 0.00 0.00 175.10 172.48 1gwh s PRO 389 N -1.81 1.38 0.19 4.82 0.02 -1.26 -5.17 135.00 133.16 1gwh s PRO 389 Ca -0.12 1.53 0.04 0.00 0.02 0.00 0.00 61.00 62.46 1gwh s PRO 389 Cb -0.07 -1.77 -0.05 0.00 0.02 0.00 0.00 34.50 32.63 1gwh s PRO 389 CO -0.02 -2.36 -0.05 0.54 -0.33 0.00 0.00 177.00 174.78 1gwh s ASN 390 N -2.68 1.76 -0.31 2.53 2.20 -1.26 -5.04 114.94 112.14 1gwh s ASN 390 Ca 0.67 -1.12 0.10 0.00 -0.94 0.00 0.00 52.86 51.58 1gwh s ASN 390 Cb -0.23 0.01 0.73 0.00 -2.00 0.00 0.00 41.25 39.76 1gwh s ASN 390 CO 0.56 -0.43 1.77 -1.20 -2.94 0.00 0.00 177.10 174.86 1gwh n SER 391 N -0.30 4.73 -0.46 3.54 7.64 -1.26 -4.50 113.62 123.02 1gwh n SER 391 Ca -0.08 -3.23 0.05 0.00 1.01 0.00 0.00 58.87 56.63 1gwh n SER 391 Cb 0.62 -0.73 0.08 0.00 -1.01 0.00 0.00 64.21 63.17 1gwh n SER 391 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1gwh n ASN 392 N -0.19 2.19 0.00 6.43 3.02 -1.26 -4.99 115.26 120.47 1gwh n ASN 392 Ca 0.39 -1.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.31 1gwh n ASN 392 Cb 1.34 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 40.43 1gwh n ASN 392 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gwh n GLY 393 N 0.50 0.48 3.51 7.41 0.00 -1.26 -5.02 105.19 110.82 1gwh n GLY 393 Ca 0.07 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 1gwh n GLY 393 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gwh s ASP 394 N -2.58 6.12 0.79 1.61 1.01 -1.26 -5.06 116.67 117.30 1gwh s ASP 394 Ca 0.00 -0.51 -0.11 0.00 0.71 0.00 0.00 52.55 52.65 1gwh s ASP 394 Cb 0.00 -2.17 0.07 0.00 1.01 0.00 0.00 42.92 41.83 1gwh s ASP 394 CO 0.00 -0.35 1.09 -0.94 0.21 0.00 0.00 175.17 175.18 1gwh s SER 395 N 1.73 4.34 0.26 0.27 1.04 -1.26 -4.77 113.70 115.31 1gwh s SER 395 Ca 0.08 1.83 -0.06 0.00 0.48 0.00 0.00 55.95 58.28 1gwh s SER 395 Cb -0.17 -2.50 -0.02 0.00 0.10 0.00 0.00 66.02 63.43 1gwh s SER 395 CO 0.11 -2.14 0.35 -1.66 0.98 0.00 0.00 173.24 170.88 1gwh s TRP 396 N -2.89 0.86 -0.04 5.02 -2.14 -1.26 -5.06 118.94 113.42 1gwh s TRP 396 Ca 0.62 -1.12 -0.02 0.00 2.66 0.00 0.00 56.10 58.24 1gwh s TRP 396 Cb -0.18 -0.17 -0.04 0.00 -3.10 0.00 0.00 33.47 29.99 1gwh s TRP 396 CO 0.56 -0.90 0.06 -1.12 -2.66 0.00 0.00 176.95 172.89 1gwh s SER 397 N -3.13 5.61 -0.40 -2.66 0.01 -1.26 -5.02 113.70 106.85 1gwh s SER 397 Ca 0.31 0.18 0.10 0.00 1.31 0.00 0.00 55.95 57.84 1gwh s SER 397 Cb 0.02 -1.63 0.38 0.00 0.21 0.00 0.00 66.02 65.01 1gwh s SER 397 CO 0.13 0.32 1.25 -0.67 0.41 0.00 0.00 173.24 174.69 1gwh n ASP 398 N 1.59 -1.52 -4.71 2.44 2.03 -1.26 -5.11 116.55 110.00 1gwh n ASP 398 Ca -0.16 -2.73 -0.42 0.00 0.52 0.00 0.00 54.79 52.00 1gwh n ASP 398 Cb 0.53 0.96 -0.03 0.00 -0.72 0.00 0.00 41.12 41.86 1gwh n ASP 398 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1gwh s GLU 399 N -0.25 4.51 0.18 -0.67 0.41 -1.26 -5.04 118.70 116.58 1gwh s GLU 399 Ca 0.23 1.59 0.09 0.00 -0.41 0.00 0.00 54.97 56.48 1gwh s GLU 399 Cb 0.39 -3.40 -0.04 0.00 -1.78 0.00 0.00 34.13 29.30 1gwh s GLU 399 CO -0.07 -0.12 -0.12 0.95 -0.49 0.00 0.00 175.26 175.41 1gwh s THR 400 N 0.91 3.03 0.00 3.63 -4.23 -1.26 -5.06 115.64 112.66 1gwh s THR 400 Ca 0.55 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1gwh s THR 400 Cb -0.25 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.10 1gwh s THR 400 CO 0.29 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.88 1gwh n GLY 401 N 0.12 -3.35 3.66 3.99 0.00 -1.26 -5.00 105.19 103.36 1gwh n GLY 401 Ca -0.11 -2.13 -0.44 0.00 0.00 0.00 0.00 46.02 43.34 1gwh n GLY 401 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1gwh n PRO 402 N -0.07 1.90 -2.60 1.61 -0.02 -1.26 -4.96 135.00 129.60 1gwh n PRO 402 Ca 0.00 0.67 -0.30 0.00 -2.02 0.00 0.00 63.50 61.85 1gwh n PRO 402 Cb 0.00 -2.25 -0.02 0.00 -0.02 0.00 0.00 33.50 31.20 1gwh n PRO 402 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1gwh s VAL 403 N -0.49 4.73 -0.03 -1.45 -7.23 -1.26 -4.97 120.40 109.70 1gwh s VAL 403 Ca 0.64 0.75 0.29 0.00 -1.81 0.00 0.00 61.98 61.84 1gwh s VAL 403 Cb -0.65 -3.76 0.34 0.00 0.56 0.00 0.00 36.38 32.87 1gwh s VAL 403 CO 0.55 -0.68 1.85 -2.24 -0.31 0.00 0.00 175.10 174.27 1gwh h ASP 404 N 0.86 0.00 -0.81 4.85 2.03 -2.00 -3.14 116.42 118.21 1gwh h ASP 404 Ca -0.47 0.00 -0.56 0.00 -0.73 0.00 0.00 57.03 55.27 1gwh h ASP 404 Cb 1.19 0.00 -0.34 0.00 -0.83 0.00 0.00 39.33 39.35 1gwh h ASP 404 CO 0.63 0.05 -0.05 -0.90 -1.03 0.00 0.00 179.24 177.94 1gwh n ASP 405 N -3.15 5.77 -3.65 4.15 5.75 -1.26 -4.94 116.55 119.22 1gwh n ASP 405 Ca 0.01 -3.77 -0.16 0.00 -0.01 0.00 0.00 54.79 50.87 1gwh n ASP 405 Cb 0.39 -0.63 -0.00 0.00 -1.03 0.00 0.00 41.12 39.85 1gwh n ASP 405 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gwh n GLY 406 N -0.84 2.97 3.82 6.12 0.00 -1.19 -4.67 105.19 111.41 1gwh n GLY 406 Ca 0.51 -2.25 -0.08 0.00 0.00 0.00 0.00 46.02 44.20 1gwh n GLY 406 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1gwh s TRP 407 N -1.64 0.12 0.11 1.61 -2.14 -1.26 -5.06 118.94 110.68 1gwh s TRP 407 Ca 0.16 -0.75 0.03 0.00 2.66 0.00 0.00 56.10 58.20 1gwh s TRP 407 Cb -0.01 0.81 -0.04 0.00 -3.10 0.00 0.00 33.47 31.13 1gwh s TRP 407 CO 0.10 -1.44 0.16 -1.21 -2.66 0.00 0.00 176.95 171.91 1gwh s GLU 408 N -2.20 3.11 0.04 3.25 8.01 -1.26 -5.12 118.70 124.54 1gwh s GLU 408 Ca 0.17 -0.66 -0.11 0.00 0.01 0.00 0.00 54.97 54.37 1gwh s GLU 408 Cb -0.05 -2.82 0.01 0.00 -4.31 0.00 0.00 34.13 26.97 1gwh s GLU 408 CO 0.10 0.55 0.25 0.00 0.01 0.00 0.00 175.26 176.16 1gwh s ALA 409 N -1.57 -0.51 -0.22 5.21 0.00 -1.26 -5.14 121.76 118.26 1gwh s ALA 409 Ca 0.32 -0.14 -0.18 0.00 0.00 0.00 0.00 51.96 51.96 1gwh s ALA 409 Cb -0.12 0.29 0.06 0.00 0.00 0.00 0.00 23.12 23.36 1gwh s ALA 409 CO 0.25 -0.38 0.58 0.16 0.00 0.00 0.00 175.76 176.37 1gwh s ASP 410 N -2.05 -0.66 0.00 0.00 -4.77 -1.26 -5.17 116.67 102.77 1gwh s ASP 410 Ca -0.05 1.20 0.00 0.00 -3.30 0.00 0.00 52.55 50.39 1gwh s ASP 410 Cb -0.01 1.17 0.00 0.00 -1.09 0.00 0.00 42.92 42.99 1gwh s ASP 410 CO -0.03 -0.21 0.00 0.61 0.70 0.00 0.00 175.17 176.24 1gwh n GLY 411 N 3.26 -2.16 3.94 2.12 0.00 -1.26 -5.12 105.19 105.97 1gwh n GLY 411 Ca -0.16 -1.34 -0.27 0.00 0.00 0.00 0.00 46.02 44.25 1gwh n GLY 411 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1gwh s THR 412 N -2.30 5.28 0.08 2.61 -1.32 -1.26 -5.05 115.64 113.68 1gwh s THR 412 Ca 0.00 -0.54 -0.31 0.00 -1.21 0.00 0.00 61.69 59.63 1gwh s THR 412 Cb 0.00 -3.73 -0.09 0.00 -1.51 0.00 0.00 72.50 67.17 1gwh s THR 412 CO 0.00 -0.11 1.70 -0.76 -2.21 0.00 0.00 174.62 173.24 1gwh s LEU 413 N -3.24 4.37 0.09 9.08 1.43 -1.26 -4.96 118.68 124.20 1gwh s LEU 413 Ca 0.36 2.55 -0.10 0.00 -1.03 0.00 0.00 54.13 55.91 1gwh s LEU 413 Cb -0.11 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.55 1gwh s LEU 413 CO 0.29 -0.92 0.22 0.28 0.23 0.00 0.00 176.35 176.44 1gwh s THR 414 N 2.77 0.13 -0.31 5.49 -1.32 -1.26 -5.11 115.64 116.03 1gwh s THR 414 Ca 0.76 -1.07 0.02 0.00 -1.21 0.00 0.00 61.69 60.20 1gwh s THR 414 Cb -0.41 -1.27 0.09 0.00 -1.51 0.00 0.00 72.50 69.40 1gwh s THR 414 CO 0.33 -0.59 0.03 -0.13 -2.21 0.00 0.00 174.62 172.06 1gwh s ARG 415 N -3.69 1.40 0.22 7.08 0.52 -1.26 -5.11 118.95 118.11 1gwh s ARG 415 Ca 0.03 -1.54 -0.20 0.00 -0.52 0.00 0.00 55.73 53.51 1gwh s ARG 415 Cb 0.04 -2.83 0.04 0.00 0.52 0.00 0.00 34.95 32.71 1gwh s ARG 415 CO -0.10 -0.87 0.61 -1.83 0.02 0.00 0.00 175.30 173.13 1gwh s GLU 416 N 1.14 1.49 0.60 3.54 -1.05 -1.26 -5.16 118.70 118.01 1gwh s GLU 416 Ca 0.07 -0.80 -0.18 0.00 -0.15 0.00 0.00 54.97 53.90 1gwh s GLU 416 Cb -0.19 0.57 -0.03 0.00 -0.44 0.00 0.00 34.13 34.04 1gwh s GLU 416 CO -0.11 -0.66 1.19 0.00 0.95 0.00 0.00 175.26 176.63 1gwh s ALA 417 N -3.86 2.53 0.50 -0.84 0.00 -1.26 -4.98 121.76 113.85 1gwh s ALA 417 Ca 0.08 0.94 -0.23 0.00 0.00 0.00 0.00 51.96 52.75 1gwh s ALA 417 Cb -0.03 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 1gwh s ALA 417 CO -0.02 -1.17 1.39 1.04 0.00 0.00 0.00 175.76 177.00 1gwh n GLN 418 N -1.69 1.95 -2.02 0.00 3.00 -1.26 -4.95 117.38 112.42 1gwh n GLN 418 Ca 0.13 0.71 -0.39 0.00 -0.01 0.00 0.00 57.00 57.43 1gwh n GLN 418 Cb 0.50 -2.60 -0.00 0.00 0.00 0.00 0.00 30.24 28.14 1gwh n GLN 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1gwh s ALA 419 N -1.24 3.24 0.06 -1.58 0.00 -1.26 -4.98 121.76 116.00 1gwh s ALA 419 Ca 0.67 1.26 -0.29 0.00 0.00 0.00 0.00 51.96 53.60 1gwh s ALA 419 Cb -0.43 -3.50 -0.05 0.00 0.00 0.00 0.00 23.12 19.14 1gwh s ALA 419 CO 0.53 -0.89 0.93 -0.51 0.00 0.00 0.00 175.76 175.82 1gwh s LEU 420 N -2.52 4.45 0.97 0.00 1.43 -1.26 -5.02 118.68 116.73 1gwh s LEU 420 Ca 0.58 1.69 -0.14 0.00 -1.03 0.00 0.00 54.13 55.22 1gwh s LEU 420 Cb -0.39 -3.52 0.18 0.00 0.03 0.00 0.00 46.19 42.49 1gwh s LEU 420 CO 0.49 -0.12 1.18 -0.13 0.23 0.00 0.00 176.35 178.01 1gwh s ARG 421 N 0.33 0.62 0.26 1.70 1.81 -1.26 -4.94 118.95 117.47 1gwh s ARG 421 Ca 0.47 0.04 -0.01 0.00 -1.72 0.00 0.00 55.73 54.51 1gwh s ARG 421 Cb -0.22 -1.80 0.57 0.00 -0.45 0.00 0.00 34.95 33.05 1gwh s ARG 421 CO 0.28 -2.50 1.70 0.00 -0.68 0.00 0.00 175.30 174.10 1gwh h ALA 422 N -1.71 1.18 -0.27 2.13 0.00 -1.83 -2.55 119.26 116.21 1gwh h ALA 422 Ca -0.48 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1gwh h ALA 422 Cb 1.30 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1gwh h ALA 422 CO 0.51 -0.29 0.00 -0.25 0.00 0.00 0.00 179.25 179.22 1gwh n ASP 423 N -5.06 3.05 -4.74 0.00 8.00 0.03 -4.99 116.55 112.84 1gwh n ASP 423 Ca 0.17 -2.31 -0.41 0.00 0.71 0.00 0.00 54.79 52.95 1gwh n ASP 423 Cb 0.52 -0.30 -0.03 0.00 -0.02 0.00 0.00 41.12 41.29 1gwh n ASP 423 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1gwh s ASP 424 N -1.32 7.00 0.22 -2.24 -0.00 -0.96 -4.91 116.67 114.45 1gwh s ASP 424 Ca 0.26 2.30 -0.09 0.00 -0.00 0.00 0.00 52.55 55.02 1gwh s ASP 424 Cb 0.17 -2.61 0.03 0.00 -0.00 0.00 0.00 42.92 40.52 1gwh s ASP 424 CO 0.12 -0.45 0.47 -0.90 -0.00 0.00 0.00 175.17 174.40 1gwh n ASP 425 N 2.66 -1.29 0.12 0.27 3.85 -1.26 -4.83 116.55 116.08 1gwh n ASP 425 Ca 0.05 -1.88 0.10 0.00 -0.71 0.00 0.00 54.79 52.36 1gwh n ASP 425 Cb 0.44 2.15 0.03 0.00 -1.35 0.00 0.00 41.12 42.39 1gwh n ASP 425 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 1gwh h ASP 426 N 1.14 0.00 0.00 -1.12 3.32 -1.95 -3.41 116.42 114.39 1gwh h ASP 426 Ca -0.19 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.86 1gwh h ASP 426 Cb 0.71 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 1gwh h ASP 426 CO 0.24 0.06 -1.12 0.49 -1.72 0.00 0.00 179.24 177.19 1gwh n PHE 427 N -2.80 0.00 -0.15 4.55 3.01 -1.26 -4.15 117.46 116.66 1gwh n PHE 427 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.38 1gwh n PHE 427 Cb 0.57 -0.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.98 1gwh n PHE 427 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1gwh h GLY 428 N 0.45 0.67 1.39 1.37 0.00 -1.89 -1.76 103.07 103.30 1gwh h GLY 428 Ca -0.01 -0.33 -0.14 0.00 0.00 0.00 0.00 47.33 46.85 1gwh h GLY 428 CO 0.00 0.32 -0.42 1.46 0.00 0.00 0.00 176.54 177.89 1gwh h GLN 429 N 0.56 0.66 -0.89 4.80 4.20 -1.88 -2.18 115.11 120.38 1gwh h GLN 429 Ca 0.15 -0.35 0.01 0.00 0.06 0.00 0.00 58.65 58.51 1gwh h GLN 429 Cb 0.12 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 1gwh h GLN 429 CO -0.02 0.96 0.59 0.00 -0.67 0.00 0.00 178.83 179.69 1gwh h ALA 430 N 0.99 1.36 -0.63 3.87 0.00 -1.82 -2.04 119.26 121.00 1gwh h ALA 430 Ca 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1gwh h ALA 430 Cb 0.95 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1gwh h ALA 430 CO 0.09 0.59 0.39 0.78 0.00 0.00 0.00 179.25 181.10 1gwh h GLY 431 N 1.21 0.90 1.16 0.00 0.00 -0.95 -1.68 103.07 103.70 1gwh h GLY 431 Ca 0.33 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.18 1gwh h GLY 431 CO -0.07 0.35 -0.10 -0.84 0.00 0.00 0.00 176.54 175.88 1gwh h THR 432 N 0.85 1.27 0.07 4.70 2.02 -0.85 0.93 112.91 121.89 1gwh h THR 432 Ca 0.23 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 66.17 1gwh h THR 432 Cb -0.05 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1gwh h THR 432 CO -0.04 0.44 -0.09 0.25 0.37 0.00 0.00 175.52 176.44 1gwh h LEU 433 N 0.88 -0.25 -0.46 2.58 5.85 -1.07 0.47 115.31 123.32 1gwh h LEU 433 Ca 0.14 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.80 1gwh h LEU 433 Cb 0.65 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1gwh h LEU 433 CO 0.05 -0.14 -0.05 0.58 -0.34 0.00 0.00 178.44 178.54 1gwh h VAL 434 N -0.19 1.27 0.20 1.05 2.07 -0.91 -1.59 116.25 118.15 1gwh h VAL 434 Ca 0.01 -1.14 -0.30 0.00 0.82 0.00 0.00 66.70 66.10 1gwh h VAL 434 Cb 0.20 1.08 0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1gwh h VAL 434 CO -0.04 0.39 -1.38 0.03 0.02 0.00 0.00 177.57 176.59 1gwh h ARG 435 N 0.69 0.43 0.00 1.57 3.08 -0.74 -3.38 114.38 116.02 1gwh h ARG 435 Ca 0.12 -0.73 -0.21 0.00 0.07 0.00 0.00 59.98 59.24 1gwh h ARG 435 Cb 0.57 0.27 -0.04 0.00 0.08 0.00 0.00 29.97 30.85 1gwh h ARG 435 CO 0.03 1.35 -1.79 0.39 -1.07 0.00 0.00 179.97 178.88 1gwh n GLU 436 N -3.81 1.74 -0.12 0.04 -0.58 0.14 -4.77 120.64 113.28 1gwh n GLU 436 Ca -0.19 0.01 -0.24 0.00 -0.42 0.00 0.00 57.16 56.33 1gwh n GLU 436 Cb 1.01 -1.29 -0.11 0.00 -0.57 0.00 0.00 31.44 30.48 1gwh n GLU 436 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1gwh n VAL 437 N -2.54 1.53 -1.74 2.62 0.31 -1.03 -4.92 118.33 112.56 1gwh n VAL 437 Ca -0.20 -0.15 -0.39 0.00 -0.01 0.00 0.00 64.34 63.60 1gwh n VAL 437 Cb 0.85 -2.00 0.04 0.00 -0.91 0.00 0.00 33.84 31.82 1gwh n VAL 437 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1gwh n PHE 438 N -4.37 2.29 -1.94 3.52 3.72 -0.63 -5.03 117.46 115.03 1gwh n PHE 438 Ca -0.39 0.43 -0.29 0.00 -0.05 0.00 0.00 57.45 57.15 1gwh n PHE 438 Cb 0.74 -2.36 0.11 0.00 -0.94 0.00 0.00 39.48 37.03 1gwh n PHE 438 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1gwh s SER 439 N -0.89 4.16 0.20 4.37 1.04 -1.26 -4.88 113.70 116.44 1gwh s SER 439 Ca 0.71 0.61 -0.11 0.00 0.48 0.00 0.00 55.95 57.65 1gwh s SER 439 Cb -0.42 -1.00 0.19 0.00 0.10 0.00 0.00 66.02 64.89 1gwh s SER 439 CO 0.50 -2.10 1.81 0.44 0.98 0.00 0.00 173.24 174.86 1gwh h ASP 440 N -1.18 0.54 -0.70 7.02 3.32 -1.97 -0.62 116.42 122.83 1gwh h ASP 440 Ca -0.45 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.54 1gwh h ASP 440 Cb 1.30 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.74 1gwh h ASP 440 CO 0.58 0.36 0.16 -0.61 -1.72 0.00 0.00 179.24 178.01 1gwh h GLN 441 N 0.67 1.14 -0.52 3.56 5.75 -1.99 -1.20 115.11 122.51 1gwh h GLN 441 Ca 0.27 -0.28 -0.07 0.00 -0.15 0.00 0.00 58.65 58.41 1gwh h GLN 441 Cb 0.12 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 1gwh h GLN 441 CO -0.15 1.01 0.04 0.93 -2.65 0.00 0.00 178.83 178.01 1gwh h GLU 442 N 1.07 0.85 -0.56 1.69 5.08 -1.82 -1.35 114.58 119.55 1gwh h GLU 442 Ca 0.22 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1gwh h GLU 442 Cb 0.39 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1gwh h GLU 442 CO 0.01 0.83 0.12 0.00 -1.00 0.00 0.00 179.01 178.96 1gwh h ARG 443 N 0.80 0.90 -0.43 2.33 3.08 -0.77 0.15 114.38 120.43 1gwh h ARG 443 Ca 0.16 -0.23 0.02 0.00 0.07 0.00 0.00 59.98 60.00 1gwh h ARG 443 Cb 0.43 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 1gwh h ARG 443 CO 0.02 0.85 0.25 -0.44 -1.07 0.00 0.00 179.97 179.58 1gwh h ASP 444 N 0.80 0.41 -0.56 7.04 3.32 -0.92 -1.33 116.42 125.18 1gwh h ASP 444 Ca 0.17 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 1gwh h ASP 444 Cb 0.37 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 1gwh h ASP 444 CO 0.01 0.29 0.07 0.44 -1.72 0.00 0.00 179.24 178.33 1gwh h ASP 445 N 0.51 0.94 -0.51 6.45 3.32 -1.11 -2.68 116.42 123.35 1gwh h ASP 445 Ca 0.17 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 1gwh h ASP 445 Cb 0.02 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1gwh h ASP 445 CO -0.08 0.96 0.21 0.15 -1.72 0.00 0.00 179.24 178.76 1gwh h PHE 446 N 0.92 0.77 -0.47 4.55 3.04 -0.61 -0.27 116.94 124.87 1gwh h PHE 446 Ca 0.18 -0.05 0.02 0.00 3.98 0.00 0.00 57.97 62.09 1gwh h PHE 446 Cb 0.44 -0.23 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 1gwh h PHE 446 CO 0.03 0.63 0.29 0.28 -2.02 0.00 0.00 178.31 177.52 1gwh h VAL 447 N 0.68 1.07 -0.55 1.41 2.07 -1.04 -0.80 116.25 119.09 1gwh h VAL 447 Ca 0.17 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 1gwh h VAL 447 Cb 0.18 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1gwh h VAL 447 CO -0.02 0.11 0.05 -0.33 0.02 0.00 0.00 177.57 177.40 1gwh h GLU 448 N 0.59 0.91 0.32 1.57 4.39 -1.12 -0.51 114.58 120.73 1gwh h GLU 448 Ca 0.18 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1gwh h GLU 448 Cb -0.01 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.53 1gwh h GLU 448 CO -0.07 0.87 -0.16 1.15 -1.16 0.00 0.00 179.01 179.65 1gwh h THR 449 N 0.85 0.70 -0.52 1.13 2.02 -0.83 -0.73 112.91 115.54 1gwh h THR 449 Ca 0.17 -0.23 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 1gwh h THR 449 Cb 0.43 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 1gwh h THR 449 CO 0.02 0.05 0.14 0.58 0.37 0.00 0.00 175.52 176.68 1gwh h VAL 450 N -0.56 1.24 -0.73 3.16 2.07 -1.06 0.39 116.25 120.75 1gwh h VAL 450 Ca -0.04 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.63 1gwh h VAL 450 Cb 0.41 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1gwh h VAL 450 CO 0.07 0.30 0.35 0.00 0.02 0.00 0.00 177.57 178.31 1gwh h ALA 451 N 1.01 0.94 -0.63 1.67 0.00 -1.15 -1.81 119.26 119.28 1gwh h ALA 451 Ca 0.16 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1gwh h ALA 451 Cb 0.30 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1gwh h ALA 451 CO -0.00 0.50 0.42 0.78 0.00 0.00 0.00 179.25 180.94 1gwh h GLY 452 N 1.02 0.88 2.00 0.00 0.00 -1.03 -2.05 103.07 103.89 1gwh h GLY 452 Ca 0.25 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 1gwh h GLY 452 CO -0.03 0.32 -0.04 0.00 0.00 0.00 0.00 176.54 176.79 1gwh h ALA 453 N 1.23 1.09 -0.01 3.60 0.00 -0.26 -2.47 119.26 122.44 1gwh h ALA 453 Ca 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1gwh h ALA 453 Cb -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1gwh h ALA 453 CO -0.05 0.05 -0.37 1.28 0.00 0.00 0.00 179.25 180.16 1gwh n LEU 454 N -3.26 1.59 -4.69 0.00 4.77 -0.74 -4.87 117.00 109.79 1gwh n LEU 454 Ca -0.01 -0.54 -0.42 0.00 -0.03 0.00 0.00 56.01 55.01 1gwh n LEU 454 Cb 0.21 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1gwh n LEU 454 CO 0.26 0.30 1.24 -0.75 -1.33 0.00 0.00 177.39 177.11 1gwh s LYS 455 N -2.48 4.23 0.00 3.23 2.20 -0.90 -1.89 119.74 124.14 1gwh s LYS 455 Ca 0.21 2.21 0.00 0.00 -0.36 0.00 0.00 55.97 58.04 1gwh s LYS 455 Cb 0.19 -3.53 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 1gwh s LYS 455 CO 0.54 -0.66 0.00 0.41 -0.36 0.00 0.00 175.35 175.29 1gwh n GLY 456 N 3.84 1.45 3.77 5.54 0.00 -1.26 -4.12 105.19 114.40 1gwh n GLY 456 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1gwh n GLY 456 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gwh s VAL 457 N -3.25 2.81 0.23 1.61 1.01 -0.79 -3.16 120.40 118.87 1gwh s VAL 457 Ca 0.00 0.81 -0.31 0.00 0.00 0.00 0.00 61.98 62.47 1gwh s VAL 457 Cb 0.00 -3.51 -0.14 0.00 0.00 0.00 0.00 36.38 32.74 1gwh s VAL 457 CO 0.00 0.18 1.37 -1.14 0.00 0.00 0.00 175.10 175.51 1gwh n ARG 458 N 0.74 1.89 -0.34 2.72 0.63 -1.26 -4.64 116.66 116.39 1gwh n ARG 458 Ca 0.00 0.67 0.04 0.00 -0.92 0.00 0.00 57.85 57.64 1gwh n ARG 458 Cb 0.42 -2.30 0.19 0.00 0.45 0.00 0.00 32.46 31.22 1gwh n ARG 458 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 1gwh h GLN 459 N 4.08 0.99 -0.87 -0.14 4.15 -1.98 0.13 115.11 121.48 1gwh h GLN 459 Ca -0.45 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 58.92 1gwh h GLN 459 Cb 1.29 -0.22 -0.04 0.00 0.21 0.00 0.00 27.48 28.71 1gwh h GLN 459 CO 0.75 0.66 0.56 0.38 -1.93 0.00 0.00 178.83 179.25 1gwh h ASP 460 N 1.02 1.00 -0.18 -0.69 2.03 -2.00 -0.34 116.42 117.26 1gwh h ASP 460 Ca 0.44 -0.03 -0.19 0.00 -0.73 0.00 0.00 57.03 56.52 1gwh h ASP 460 Cb 0.30 -0.25 0.00 0.00 -0.83 0.00 0.00 39.33 38.55 1gwh h ASP 460 CO -0.21 0.73 -0.58 0.58 -1.03 0.00 0.00 179.24 178.73 1gwh h VAL 461 N 1.18 1.29 -0.78 4.15 2.07 -1.39 -2.52 116.25 120.24 1gwh h VAL 461 Ca 0.32 -1.79 0.05 0.00 0.82 0.00 0.00 66.70 66.10 1gwh h VAL 461 Cb -0.12 1.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 1gwh h VAL 461 CO -0.07 0.57 0.48 1.56 0.02 0.00 0.00 177.57 180.14 1gwh h GLN 462 N 0.59 0.88 -0.60 1.57 4.20 -0.72 -0.59 115.11 120.44 1gwh h GLN 462 Ca 0.00 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 1gwh h GLN 462 Cb 1.18 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.73 1gwh h GLN 462 CO 0.12 0.58 0.30 0.00 -0.67 0.00 0.00 178.83 179.16 1gwh h ALA 463 N 1.36 0.78 -0.44 3.87 0.00 -0.95 -0.21 119.26 123.67 1gwh h ALA 463 Ca 0.33 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1gwh h ALA 463 Cb 0.10 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1gwh h ALA 463 CO -0.14 0.33 0.03 0.00 0.00 0.00 0.00 179.25 179.47 1gwh h ARG 464 N 0.82 0.69 -0.60 0.00 3.08 -0.99 -2.59 114.38 114.79 1gwh h ARG 464 Ca 0.21 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 1gwh h ARG 464 Cb 0.11 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 1gwh h ARG 464 CO -0.03 0.69 0.23 0.00 -1.07 0.00 0.00 179.97 179.79 1gwh h ALA 465 N 1.38 1.28 -0.78 0.04 0.00 -0.28 -1.35 119.26 119.54 1gwh h ALA 465 Ca 0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1gwh h ALA 465 Cb 0.36 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1gwh h ALA 465 CO 0.01 0.53 0.37 0.74 0.00 0.00 0.00 179.25 180.90 1gwh h PHE 466 N 0.87 1.13 -0.49 0.00 0.04 -0.68 -0.74 116.94 117.07 1gwh h PHE 466 Ca 0.20 -0.06 -0.06 0.00 2.80 0.00 0.00 57.97 60.85 1gwh h PHE 466 Cb 0.18 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 1gwh h PHE 466 CO 0.01 0.83 0.06 1.49 -0.60 0.00 0.00 178.31 180.10 1gwh h GLU 467 N 1.11 0.82 -0.19 1.51 4.81 -1.27 -1.05 114.58 120.32 1gwh h GLU 467 Ca 0.27 -0.23 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1gwh h GLU 467 Cb 0.12 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 1gwh h GLU 467 CO -0.03 0.83 0.04 -0.92 -0.73 0.00 0.00 179.01 178.20 1gwh h TYR 468 N 0.69 0.06 -0.25 0.92 5.03 -0.95 -1.68 116.97 120.80 1gwh h TYR 468 Ca 0.15 0.01 -0.14 0.00 2.58 0.00 0.00 58.73 61.32 1gwh h TYR 468 Cb 0.42 -0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.69 1gwh h TYR 468 CO 0.03 0.02 -0.43 -1.49 -1.32 0.00 0.00 178.16 174.97 1gwh h TRP 469 N 0.11 0.76 0.00 -3.82 4.06 -0.99 -2.44 115.95 113.63 1gwh h TRP 469 Ca 0.08 -0.23 -0.02 0.00 2.06 0.00 0.00 58.89 60.78 1gwh h TRP 469 Cb 0.08 -0.16 -0.00 0.00 -1.00 0.00 0.00 29.16 28.08 1gwh h TRP 469 CO -0.14 0.96 -0.09 0.87 -3.56 0.00 0.00 178.44 176.48 1gwh h LYS 470 N 0.51 0.00 -0.10 0.49 1.57 -0.97 -1.16 116.57 116.90 1gwh h LYS 470 Ca 0.04 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1gwh h LYS 470 Cb 0.96 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 1gwh h LYS 470 CO 0.09 0.09 -0.44 -0.91 -0.57 0.00 0.00 179.45 177.70 1gwh h ASN 471 N 0.00 0.25 0.25 0.86 2.35 -0.84 -2.96 115.58 115.49 1gwh h ASN 471 Ca -0.00 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 1gwh h ASN 471 Cb 0.16 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1gwh h ASN 471 CO 0.01 0.67 -0.12 0.58 -1.65 0.00 0.00 177.43 176.92 1gwh h VAL 472 N 0.20 0.80 -2.02 2.81 2.07 -1.10 -3.46 116.25 115.54 1gwh h VAL 472 Ca 0.01 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 66.90 1gwh h VAL 472 Cb 0.86 1.17 -0.21 0.00 -1.52 0.00 0.00 31.29 31.59 1gwh h VAL 472 CO 0.07 0.14 -0.08 -0.62 0.02 0.00 0.00 177.57 177.10 1gwh s ASP 473 N -5.19 -1.04 0.27 0.57 2.15 -0.50 -4.09 116.67 108.85 1gwh s ASP 473 Ca -0.14 1.53 -0.04 0.00 0.43 0.00 0.00 52.55 54.33 1gwh s ASP 473 Cb 0.02 1.89 0.33 0.00 -0.30 0.00 0.00 42.92 44.86 1gwh s ASP 473 CO 0.56 -0.23 1.93 0.00 -0.17 0.00 0.00 175.17 177.26 1gwh h ALA 474 N 7.58 1.34 -0.03 3.66 0.00 -1.76 -0.30 119.26 129.74 1gwh h ALA 474 Ca -0.23 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1gwh h ALA 474 Cb 1.15 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1gwh h ALA 474 CO 0.13 0.60 -0.16 1.15 0.00 0.00 0.00 179.25 180.96 1gwh h THR 475 N 1.28 1.49 -0.78 0.00 2.02 -1.93 -1.75 112.91 113.23 1gwh h THR 475 Ca 0.36 -1.67 -0.04 0.00 0.77 0.00 0.00 66.41 65.84 1gwh h THR 475 Cb -0.09 2.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.77 1gwh h THR 475 CO -0.09 0.46 0.34 -0.29 0.37 0.00 0.00 175.52 176.31 1gwh h ILE 476 N -0.42 1.25 -0.75 3.11 6.09 -1.88 -1.67 117.51 123.23 1gwh h ILE 476 Ca -0.01 -0.75 -0.04 0.00 -1.37 0.00 0.00 64.86 62.69 1gwh h ILE 476 Cb 0.83 0.28 -0.03 0.00 0.47 0.00 0.00 36.82 38.37 1gwh h ILE 476 CO 0.03 0.31 0.32 1.23 -3.07 0.00 0.00 178.15 176.97 1gwh h GLY 477 N 1.15 1.20 1.06 8.18 0.00 -1.03 -0.42 103.07 113.21 1gwh h GLY 477 Ca 0.27 -0.64 -0.09 0.00 0.00 0.00 0.00 47.33 46.87 1gwh h GLY 477 CO -0.03 0.60 -0.00 -1.61 0.00 0.00 0.00 176.54 175.50 1gwh h GLN 478 N 1.08 1.00 -0.71 4.80 5.75 -1.04 -1.57 115.11 124.42 1gwh h GLN 478 Ca 0.25 -0.32 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 1gwh h GLN 478 Cb 0.19 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.61 1gwh h GLN 478 CO -0.02 1.00 0.40 0.00 -2.65 0.00 0.00 178.83 177.56 1gwh h ARG 479 N 0.89 0.98 -0.16 1.69 3.08 -1.03 -0.81 114.38 119.02 1gwh h ARG 479 Ca 0.16 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1gwh h ARG 479 Cb 0.55 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1gwh h ARG 479 CO 0.03 0.72 0.06 0.82 -1.07 0.00 0.00 179.97 180.53 1gwh h ILE 480 N 0.98 1.16 -0.44 2.04 2.04 -0.96 -2.18 117.51 120.15 1gwh h ILE 480 Ca 0.25 -0.49 0.07 0.00 1.00 0.00 0.00 64.86 65.69 1gwh h ILE 480 Cb 0.01 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 1gwh h ILE 480 CO -0.04 0.15 0.11 -0.08 0.00 0.00 0.00 178.15 178.29 1gwh h GLU 481 N 0.09 0.25 -0.56 2.37 4.81 -1.04 0.05 114.58 120.54 1gwh h GLU 481 Ca 0.05 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1gwh h GLU 481 Cb 0.18 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1gwh h GLU 481 CO -0.00 0.16 0.29 -0.44 -0.73 0.00 0.00 179.01 178.29 1gwh h ASP 482 N 0.25 0.72 -0.45 1.04 3.32 -1.09 -0.25 116.42 119.96 1gwh h ASP 482 Ca 0.21 -0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.01 1gwh h ASP 482 Cb 0.25 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1gwh h ASP 482 CO -0.26 0.62 -0.29 -0.08 -1.72 0.00 0.00 179.24 177.52 1gwh h GLU 483 N 0.76 0.98 -0.69 3.56 4.81 -0.91 -2.65 114.58 120.44 1gwh h GLU 483 Ca 0.20 -0.46 -0.05 0.00 -0.13 0.00 0.00 59.36 58.92 1gwh h GLU 483 Cb 0.08 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1gwh h GLU 483 CO -0.03 1.13 0.23 0.28 -0.73 0.00 0.00 179.01 179.90 1gwh h VAL 484 N 0.83 1.25 0.00 0.32 2.07 -0.61 -1.41 116.25 118.71 1gwh h VAL 484 Ca 0.09 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 1gwh h VAL 484 Cb 0.87 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1gwh h VAL 484 CO 0.08 0.33 -0.10 0.11 0.02 0.00 0.00 177.57 178.02 1gwh h LYS 485 N 1.01 0.00 -0.05 1.57 1.57 -0.96 -1.42 116.57 118.29 1gwh h LYS 485 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1gwh h LYS 485 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1gwh h LYS 485 CO -0.01 0.10 0.00 0.54 -0.57 0.00 0.00 179.45 179.51 1gwh n ARG 486 N -3.46 1.74 -3.56 3.15 1.74 -0.95 -4.97 116.66 110.35 1gwh n ARG 486 Ca -0.01 -1.09 -0.23 0.00 -0.77 0.00 0.00 57.85 55.75 1gwh n ARG 486 Cb 0.25 -1.46 0.08 0.00 -1.02 0.00 0.00 32.46 30.30 1gwh n ARG 486 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1gwh n HIS 487 N 0.32 -2.77 -3.77 -1.55 -0.00 -0.54 -5.01 115.22 101.89 1gwh n HIS 487 Ca 0.18 0.99 -0.22 0.00 -0.00 0.00 0.00 57.72 58.68 1gwh n HIS 487 Cb 0.37 -4.98 -0.04 0.00 -0.00 0.00 0.00 29.99 25.34 1gwh n HIS 487 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1gwh s GLU 488 N -6.19 2.50 0.00 1.57 2.02 -0.59 -5.03 118.70 112.98 1gwh s GLU 488 Ca 0.52 -1.54 0.00 0.00 0.02 0.00 0.00 54.97 53.97 1gwh s GLU 488 Cb -0.23 -2.31 0.00 0.00 0.10 0.00 0.00 34.13 31.69 1gwh s GLU 488 CO 0.72 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 176.32 1gwh n GLY 489 N -1.41 3.65 3.81 -1.39 0.00 -1.26 -4.14 105.19 104.44 1gwh n GLY 489 Ca 0.01 -1.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.00 1gwh n GLY 489 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gwh s ASP 490 N 0.00 5.92 0.22 1.61 1.01 -0.38 -4.65 116.67 120.40 1gwh s ASP 490 Ca 0.00 1.80 -0.30 0.00 0.71 0.00 0.00 52.55 54.76 1gwh s ASP 490 Cb 0.00 -2.53 -0.08 0.00 1.01 0.00 0.00 42.92 41.31 1gwh s ASP 490 CO 0.00 -1.07 1.10 -0.83 0.21 0.00 0.00 175.17 174.57 1gwh s GLY 491 N -2.76 2.94 -0.24 0.21 0.00 -1.26 -4.16 107.32 102.04 1gwh s GLY 491 Ca 0.63 0.84 -0.08 0.00 0.00 0.00 0.00 44.72 46.12 1gwh s GLY 491 CO 0.35 1.58 0.09 -0.42 0.00 0.00 0.00 173.10 174.70 1gwh s ILE 492 N -0.65 4.54 0.06 0.90 -1.09 -1.26 -4.66 121.20 119.04 1gwh s ILE 492 Ca 0.47 -0.10 -0.30 0.00 -2.23 0.00 0.00 60.65 58.49 1gwh s ILE 492 Cb -0.30 -3.12 -0.09 0.00 -1.58 0.00 0.00 42.46 37.37 1gwh s ILE 492 CO 0.37 0.34 1.88 -2.16 -1.23 0.00 0.00 174.94 174.15 1gwh s PRO 493 N 1.47 4.15 0.00 2.79 0.04 -1.26 -2.71 135.00 139.47 1gwh s PRO 493 Ca 0.06 2.56 0.00 0.00 0.04 0.00 0.00 61.00 63.66 1gwh s PRO 493 Cb -0.15 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.46 1gwh s PRO 493 CO 0.05 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.60 1gwh n GLY 494 N 4.39 0.41 3.48 0.56 0.00 -1.26 -2.20 105.19 110.57 1gwh n GLY 494 Ca 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 1gwh n GLY 494 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gwh s VAL 495 N -2.00 0.01 0.36 1.61 0.11 -1.10 -4.92 120.40 114.46 1gwh s VAL 495 Ca 0.00 -0.06 -0.09 0.00 -2.93 0.00 0.00 61.98 58.90 1gwh s VAL 495 Cb 0.00 -0.97 0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1gwh s VAL 495 CO 0.00 -0.03 0.64 -1.84 -3.33 0.00 0.00 175.10 170.54 1gwh n GLU 496 N 0.75 0.92 -4.27 1.54 0.28 -1.26 -4.36 120.64 114.24 1gwh n GLU 496 Ca -0.19 -2.29 -0.15 0.00 -0.16 0.00 0.00 57.16 54.38 1gwh n GLU 496 Cb 0.58 2.58 -0.10 0.00 1.43 0.00 0.00 31.44 35.93 1gwh n GLU 496 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1gwh s ALA 497 N -2.26 1.49 0.00 -1.84 0.00 -1.26 -1.68 121.76 116.21 1gwh s ALA 497 Ca 0.19 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 50.43 1gwh s ALA 497 Cb -0.03 0.85 0.00 0.00 0.00 0.00 0.00 23.12 23.94 1gwh s ALA 497 CO 0.14 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1gwh n GLY 498 N -0.34 -0.10 0.00 0.00 0.00 -1.19 -4.73 105.19 98.83 1gwh n GLY 498 Ca -0.03 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1gwh n GLY 498 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gwh n GLY 499 N 0.02 -0.13 0.09 -0.02 0.00 -1.26 -4.39 105.19 99.49 1gwh n GLY 499 Ca 0.00 -1.79 0.10 0.00 0.00 0.00 0.00 46.02 44.34 1gwh n GLY 499 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1gwh n GLU 500 N -0.03 0.13 -0.19 1.61 4.71 -1.26 -2.45 120.64 123.16 1gwh n GLU 500 Ca 0.00 0.35 0.11 0.00 -0.01 0.00 0.00 57.16 57.62 1gwh n GLU 500 Cb 0.00 -1.75 0.21 0.00 -1.01 0.00 0.00 31.44 28.89 1gwh n GLU 500 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1gwh n ALA 501 N -1.69 2.40 -2.43 0.62 0.00 -1.26 -4.97 120.51 113.19 1gwh n ALA 501 Ca 0.03 -1.01 -0.22 0.00 0.00 0.00 0.00 53.44 52.23 1gwh n ALA 501 Cb 0.22 -0.83 -0.09 0.00 0.00 0.00 0.00 19.45 18.76 1gwh n ALA 501 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1gwh s ARG 502 N -1.40 1.76 0.00 0.00 0.52 -1.03 -4.63 118.95 114.18 1gwh s ARG 502 Ca 0.37 -2.04 0.16 0.00 -0.52 0.00 0.00 55.73 53.71 1gwh s ARG 502 Cb 0.22 -0.39 0.98 0.00 0.52 0.00 0.00 34.95 36.28 1gwh s ARG 502 CO 0.30 -0.45 1.39 -0.89 0.02 0.00 0.00 175.30 175.67