#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gkq s LEU 3 N 0.00 2.05 -0.09 2.45 2.96 0.15 -1.35 118.68 124.84 1gkq s LEU 3 Ca 0.00 -0.33 -0.02 0.00 -0.22 0.00 0.00 54.13 53.56 1gkq s LEU 3 Cb 0.00 -0.86 0.04 0.00 0.50 0.00 0.00 46.19 45.87 1gkq s LEU 3 CO 0.00 0.19 0.04 -0.22 -1.32 0.00 0.00 176.35 175.04 1gkq s LEU 4 N -0.49 0.50 -0.27 -0.68 2.96 -0.26 -0.30 118.68 120.14 1gkq s LEU 4 Ca 0.06 -0.22 -0.06 0.00 -0.22 0.00 0.00 54.13 53.70 1gkq s LEU 4 Cb -0.07 -0.34 0.00 0.00 0.50 0.00 0.00 46.19 46.28 1gkq s LEU 4 CO -0.00 -0.25 0.04 -0.63 -1.32 0.00 0.00 176.35 174.19 1gkq s ILE 5 N 2.04 3.80 0.23 6.68 1.01 -0.29 -0.37 121.20 134.30 1gkq s ILE 5 Ca 0.04 -0.63 0.11 0.00 0.00 0.00 0.00 60.65 60.17 1gkq s ILE 5 Cb -0.13 -2.90 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 1gkq s ILE 5 CO -0.06 0.18 -0.21 -1.59 0.00 0.00 0.00 174.94 173.26 1gkq s LYS 6 N 1.49 1.57 -1.88 2.79 -2.85 -0.45 -0.83 119.74 119.59 1gkq s LYS 6 Ca 0.03 -1.63 0.00 0.00 -1.00 0.00 0.00 55.97 53.37 1gkq s LYS 6 Cb -0.16 -1.75 0.00 0.00 -2.06 0.00 0.00 37.83 33.86 1gkq s LYS 6 CO 0.01 0.35 0.00 0.09 0.10 0.00 0.00 175.35 175.90 1gkq n ASN 7 N -0.17 -5.42 -4.92 0.03 3.02 -1.26 -0.16 115.26 106.39 1gkq n ASN 7 Ca -0.09 0.27 -0.26 0.00 -0.03 0.00 0.00 54.58 54.47 1gkq n ASN 7 Cb 0.58 -4.55 -0.03 0.00 -0.61 0.00 0.00 39.78 35.17 1gkq n ASN 7 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1gkq s GLY 8 N -2.51 1.68 -0.47 7.41 0.00 -1.25 -3.02 107.32 109.15 1gkq s GLY 8 Ca 0.00 -1.08 -0.20 0.00 0.00 0.00 0.00 44.72 43.43 1gkq s GLY 8 CO 0.00 -1.09 0.66 1.85 0.00 0.00 0.00 173.10 174.52 1gkq s GLU 9 N -3.25 3.23 -0.03 2.90 2.12 -0.57 -3.35 118.70 119.75 1gkq s GLU 9 Ca 0.34 -0.53 -0.30 0.00 0.36 0.00 0.00 54.97 54.84 1gkq s GLU 9 Cb -0.11 -4.01 -0.03 0.00 0.26 0.00 0.00 34.13 30.25 1gkq s GLU 9 CO 0.27 -1.11 1.03 0.42 -0.54 0.00 0.00 175.26 175.34 1gkq s ILE 10 N 2.85 4.69 -0.12 -3.70 1.01 0.26 -1.06 121.20 125.12 1gkq s ILE 10 Ca 0.21 1.94 -0.01 0.00 0.00 0.00 0.00 60.65 62.79 1gkq s ILE 10 Cb -0.16 -4.24 0.03 0.00 0.01 0.00 0.00 42.46 38.10 1gkq s ILE 10 CO 0.17 0.10 -0.03 -0.63 0.00 0.00 0.00 174.94 174.54 1gkq s ILE 11 N 1.40 0.77 0.30 2.92 1.01 -0.77 -1.35 121.20 125.49 1gkq s ILE 11 Ca 0.52 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.90 1gkq s ILE 11 Cb -0.22 -0.94 -0.00 0.00 0.01 0.00 0.00 42.46 41.32 1gkq s ILE 11 CO 0.25 0.20 0.01 0.35 0.00 0.00 0.00 174.94 175.74 1gkq n THR 12 N 5.01 0.00 0.24 2.92 -2.24 -0.37 -4.40 114.28 115.43 1gkq n THR 12 Ca -0.10 -1.43 0.08 0.00 -2.27 0.00 0.00 64.05 60.33 1gkq n THR 12 Cb 0.49 0.30 0.61 0.00 -2.10 0.00 0.00 70.33 69.63 1gkq n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gkq h ALA 13 N 1.17 1.55 0.00 6.98 0.00 -1.91 -3.25 119.26 123.80 1gkq h ALA 13 Ca -0.25 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.44 1gkq h ALA 13 Cb 0.76 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.34 1gkq h ALA 13 CO 0.41 0.19 -0.71 -0.40 0.00 0.00 0.00 179.25 178.74 1gkq n ASP 14 N -4.07 1.19 -3.52 0.00 5.75 -1.26 -4.77 116.55 109.87 1gkq n ASP 14 Ca -0.02 -2.67 -0.16 0.00 -0.01 0.00 0.00 54.79 51.93 1gkq n ASP 14 Cb 0.23 -0.37 -0.05 0.00 -1.03 0.00 0.00 41.12 39.90 1gkq n ASP 14 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1gkq s SER 15 N -2.31 -0.59 -0.23 -1.12 1.04 -1.23 -5.15 113.70 104.12 1gkq s SER 15 Ca 0.30 0.47 -0.07 0.00 0.48 0.00 0.00 55.95 57.13 1gkq s SER 15 Cb 0.32 0.53 0.11 0.00 0.10 0.00 0.00 66.02 67.08 1gkq s SER 15 CO -0.10 -0.69 0.47 -0.60 0.98 0.00 0.00 173.24 173.31 1gkq s ARG 16 N -1.90 0.40 0.19 4.02 3.52 -1.26 -1.24 118.95 122.69 1gkq s ARG 16 Ca -0.08 1.06 -0.23 0.00 -0.13 0.00 0.00 55.73 56.35 1gkq s ARG 16 Cb -0.01 0.36 0.06 0.00 -1.56 0.00 0.00 34.95 33.81 1gkq s ARG 16 CO 0.03 -0.31 0.94 1.52 -0.81 0.00 0.00 175.30 176.67 1gkq s TYR 17 N 2.68 -0.07 -0.15 5.12 1.13 -0.46 -4.99 117.35 120.61 1gkq s TYR 17 Ca 0.01 -0.31 -0.01 0.00 -1.41 0.00 0.00 57.07 55.35 1gkq s TYR 17 Cb -0.13 0.68 -0.01 0.00 -1.10 0.00 0.00 41.96 41.40 1gkq s TYR 17 CO -0.15 -0.95 -0.12 0.15 -2.51 0.00 0.00 175.55 171.97 1gkq s LYS 18 N -3.01 3.36 0.06 -3.49 1.02 -1.26 0.90 119.74 117.32 1gkq s LYS 18 Ca 0.15 -0.68 -0.27 0.00 0.02 0.00 0.00 55.97 55.19 1gkq s LYS 18 Cb -0.02 -2.70 0.09 0.00 -0.52 0.00 0.00 37.83 34.68 1gkq s LYS 18 CO 0.04 0.10 1.18 0.00 -0.92 0.00 0.00 175.35 175.75 1gkq s ALA 19 N 0.64 -2.06 0.09 5.17 0.00 -1.21 -4.87 121.76 119.51 1gkq s ALA 19 Ca -0.07 0.07 0.03 0.00 0.00 0.00 0.00 51.96 51.99 1gkq s ALA 19 Cb -0.15 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.63 1gkq s ALA 19 CO 0.03 -1.09 0.13 -0.51 0.00 0.00 0.00 175.76 174.32 1gkq s ASP 20 N -3.41 5.78 -0.15 0.00 1.01 0.20 -4.01 116.67 116.08 1gkq s ASP 20 Ca 0.22 0.05 0.01 0.00 0.71 0.00 0.00 52.55 53.55 1gkq s ASP 20 Cb -0.00 -1.62 0.00 0.00 1.01 0.00 0.00 42.92 42.31 1gkq s ASP 20 CO 0.01 0.15 -0.19 -0.63 0.21 0.00 0.00 175.17 174.72 1gkq s ILE 21 N -1.49 2.35 -0.15 0.77 1.01 -0.01 -2.22 121.20 121.46 1gkq s ILE 21 Ca 0.31 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 60.10 1gkq s ILE 21 Cb -0.12 -1.96 0.01 0.00 0.01 0.00 0.00 42.46 40.40 1gkq s ILE 21 CO 0.24 0.53 -0.21 -0.47 0.00 0.00 0.00 174.94 175.04 1gkq s TYR 22 N 0.81 2.70 -0.24 3.97 5.04 -0.35 -1.14 117.35 128.14 1gkq s TYR 22 Ca -0.06 -1.35 0.02 0.00 -2.44 0.00 0.00 57.07 53.24 1gkq s TYR 22 Cb -0.15 -1.84 0.05 0.00 0.35 0.00 0.00 41.96 40.36 1gkq s TYR 22 CO -0.01 -0.63 -0.12 0.00 -1.34 0.00 0.00 175.55 173.45 1gkq s ALA 23 N 0.90 2.45 0.05 3.97 0.00 0.60 -0.05 121.76 129.68 1gkq s ALA 23 Ca -0.05 -1.60 -0.20 0.00 0.00 0.00 0.00 51.96 50.11 1gkq s ALA 23 Cb -0.15 -1.48 -0.12 0.00 0.00 0.00 0.00 23.12 21.36 1gkq s ALA 23 CO -0.03 -1.02 1.40 1.49 0.00 0.00 0.00 175.76 177.60 1gkq h GLU 24 N 7.83 0.38 0.00 0.00 4.81 -1.83 0.43 114.58 126.20 1gkq h GLU 24 Ca -0.24 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 1gkq h GLU 24 Cb 1.06 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1gkq h GLU 24 CO 0.49 0.69 0.00 0.41 -0.73 0.00 0.00 179.01 179.88 1gkq n GLY 25 N 0.03 2.07 0.12 1.92 0.00 -1.26 -3.24 105.19 104.83 1gkq n GLY 25 Ca -0.05 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1gkq n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gkq h GLU 26 N 0.00 0.00 -6.14 1.61 5.08 -1.91 -3.38 114.58 109.84 1gkq h GLU 26 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 1gkq h GLU 26 Cb 0.00 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.15 1gkq h GLU 26 CO 0.00 0.02 -0.64 0.95 -1.00 0.00 0.00 179.01 178.34 1gkq s THR 27 N -3.32 3.04 -0.07 1.13 -4.23 -1.26 -0.04 115.64 110.89 1gkq s THR 27 Ca 0.00 -1.98 -0.30 0.00 -1.18 0.00 0.00 61.69 58.23 1gkq s THR 27 Cb 0.09 -2.76 -0.04 0.00 1.34 0.00 0.00 72.50 71.13 1gkq s THR 27 CO 0.78 -0.31 1.41 -0.63 -0.54 0.00 0.00 174.62 175.32 1gkq s ILE 28 N -2.42 3.90 -0.15 2.99 1.01 -0.06 -3.90 121.20 122.57 1gkq s ILE 28 Ca 0.33 1.17 -0.21 0.00 0.00 0.00 0.00 60.65 61.94 1gkq s ILE 28 Cb -0.04 -3.76 -0.24 0.00 0.01 0.00 0.00 42.46 38.44 1gkq s ILE 28 CO 0.19 -0.06 0.46 0.74 0.00 0.00 0.00 174.94 176.28 1gkq h THR 29 N 5.27 1.14 -3.02 2.92 2.02 -0.81 -1.22 112.91 119.21 1gkq h THR 29 Ca -0.34 -2.30 -0.04 0.00 0.77 0.00 0.00 66.41 64.49 1gkq h THR 29 Cb 1.15 2.66 -0.14 0.00 -1.74 0.00 0.00 68.15 70.09 1gkq h THR 29 CO 0.94 0.54 0.09 0.00 0.37 0.00 0.00 175.52 177.45 1gkq s ARG 30 N -2.38 1.15 -0.03 6.66 1.70 -0.88 -4.82 118.95 120.36 1gkq s ARG 30 Ca -0.23 -0.45 0.02 0.00 -0.47 0.00 0.00 55.73 54.60 1gkq s ARG 30 Cb 0.03 0.52 0.00 0.00 -0.57 0.00 0.00 34.95 34.94 1gkq s ARG 30 CO 0.68 -0.46 -0.08 0.42 -1.08 0.00 0.00 175.30 174.77 1gkq s ILE 31 N -3.35 0.73 -0.12 4.99 1.01 -1.26 -1.21 121.20 121.99 1gkq s ILE 31 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.32 1gkq s ILE 31 Cb -0.00 -0.66 0.00 0.00 0.01 0.00 0.00 42.46 41.81 1gkq s ILE 31 CO -0.09 0.23 0.00 0.61 0.00 0.00 0.00 174.94 175.69 1gkq n GLY 32 N 3.33 -1.13 3.87 6.18 0.00 -0.94 -4.98 105.19 111.52 1gkq n GLY 32 Ca -0.18 -1.01 -0.36 0.00 0.00 0.00 0.00 46.02 44.46 1gkq n GLY 32 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gkq s GLN 33 N -1.94 3.65 -1.08 1.61 -0.21 -1.26 0.58 119.66 121.00 1gkq s GLN 33 Ca 0.00 0.06 -0.17 0.00 0.02 0.00 0.00 55.36 55.27 1gkq s GLN 33 Cb 0.00 -3.13 -0.01 0.00 1.00 0.00 0.00 33.01 30.86 1gkq s GLN 33 CO 0.00 0.68 0.79 0.09 -2.12 0.00 0.00 175.29 174.73 1gkq n ASN 34 N 1.49 -5.61 -4.81 5.90 3.02 -1.26 -4.94 115.26 109.05 1gkq n ASN 34 Ca -0.14 -0.92 -0.35 0.00 -0.03 0.00 0.00 54.58 53.14 1gkq n ASN 34 Cb 0.53 -3.54 -0.06 0.00 -0.61 0.00 0.00 39.78 36.10 1gkq n ASN 34 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1gkq s LEU 35 N -6.09 4.24 -0.33 3.41 1.43 -1.26 -5.04 118.68 115.04 1gkq s LEU 35 Ca 0.41 1.59 -0.11 0.00 -1.03 0.00 0.00 54.13 54.98 1gkq s LEU 35 Cb -0.14 -3.95 -0.00 0.00 0.03 0.00 0.00 46.19 42.13 1gkq s LEU 35 CO 0.85 -0.10 0.19 -1.61 0.23 0.00 0.00 176.35 175.91 1gkq s GLU 36 N -2.33 3.28 -0.07 1.70 2.02 -1.26 -5.07 118.70 116.97 1gkq s GLU 36 Ca 0.50 -0.77 -0.15 0.00 0.02 0.00 0.00 54.97 54.57 1gkq s GLU 36 Cb -0.15 -3.66 -0.05 0.00 0.10 0.00 0.00 34.13 30.36 1gkq s GLU 36 CO 0.20 -0.48 0.39 0.00 0.02 0.00 0.00 175.26 175.39 1gkq s ALA 37 N 1.63 3.63 0.91 5.21 0.00 -1.26 -5.05 121.76 126.83 1gkq s ALA 37 Ca 0.05 -0.28 -0.13 0.00 0.00 0.00 0.00 51.96 51.59 1gkq s ALA 37 Cb -0.18 -2.43 0.02 0.00 0.00 0.00 0.00 23.12 20.53 1gkq s ALA 37 CO 0.07 0.29 0.41 -0.35 0.00 0.00 0.00 175.76 176.18 1gkq n PRO 38 N 2.65 -0.17 -1.93 0.00 -0.04 -1.26 -4.83 135.00 129.42 1gkq n PRO 38 Ca -0.12 -0.01 -0.39 0.00 -0.04 0.00 0.00 63.50 62.94 1gkq n PRO 38 Cb 0.52 -1.84 0.01 0.00 -0.04 0.00 0.00 33.50 32.16 1gkq n PRO 38 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1gkq s PRO 39 N -3.45 3.61 0.00 0.54 0.04 -1.26 -2.56 135.00 131.93 1gkq s PRO 39 Ca 0.58 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.83 1gkq s PRO 39 Cb -0.23 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.77 1gkq s PRO 39 CO 0.66 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 177.31 1gkq n GLY 40 N 0.63 2.77 3.76 0.56 0.00 -1.26 -5.05 105.19 106.60 1gkq n GLY 40 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1gkq n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gkq s THR 41 N -2.77 2.11 -0.23 2.61 2.01 -1.06 -4.80 115.64 113.51 1gkq s THR 41 Ca 0.00 0.10 -0.27 0.00 0.31 0.00 0.00 61.69 61.83 1gkq s THR 41 Cb 0.00 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.45 1gkq s THR 41 CO 0.00 0.02 0.95 -0.70 -0.69 0.00 0.00 174.62 174.20 1gkq s GLU 42 N -1.32 4.24 -0.21 4.92 2.12 -0.46 -4.93 118.70 123.06 1gkq s GLU 42 Ca 0.57 1.20 -0.07 0.00 0.36 0.00 0.00 54.97 57.03 1gkq s GLU 42 Cb -0.47 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.25 1gkq s GLU 42 CO 0.55 -0.56 0.07 0.08 -0.54 0.00 0.00 175.26 174.86 1gkq s VAL 43 N 2.98 4.60 -0.17 3.70 1.01 -1.26 -1.10 120.40 130.16 1gkq s VAL 43 Ca 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.27 1gkq s VAL 43 Cb -0.15 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.11 1gkq s VAL 43 CO 0.07 0.41 -0.08 -0.63 0.00 0.00 0.00 175.10 174.87 1gkq s ILE 44 N 0.89 3.34 -0.34 2.22 -1.09 0.50 -5.00 121.20 121.73 1gkq s ILE 44 Ca 0.04 -0.53 -0.17 0.00 -2.23 0.00 0.00 60.65 57.75 1gkq s ILE 44 Cb -0.14 -2.47 -0.01 0.00 -1.58 0.00 0.00 42.46 38.27 1gkq s ILE 44 CO 0.03 0.48 0.48 -0.62 -1.23 0.00 0.00 174.94 174.08 1gkq s ASP 45 N 0.81 6.30 -0.27 3.58 2.15 -1.26 -1.34 116.67 126.65 1gkq s ASP 45 Ca -0.03 0.01 0.13 0.00 0.43 0.00 0.00 52.55 53.09 1gkq s ASP 45 Cb -0.15 -2.25 0.75 0.00 -0.30 0.00 0.00 42.92 40.97 1gkq s ASP 45 CO 0.01 -0.42 1.73 0.00 -0.17 0.00 0.00 175.17 176.32 1gkq n ALA 46 N 5.65 4.07 -1.66 3.66 0.00 0.77 -4.95 120.51 128.04 1gkq n ALA 46 Ca -0.06 -2.18 -0.48 0.00 0.00 0.00 0.00 53.44 50.73 1gkq n ALA 46 Cb 0.49 -1.11 -0.05 0.00 0.00 0.00 0.00 19.45 18.78 1gkq n ALA 46 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1gkq n THR 47 N 0.13 0.14 -1.13 0.00 -1.04 -1.17 -1.09 114.28 110.12 1gkq n THR 47 Ca 0.32 -0.03 -0.04 0.00 -2.04 0.00 0.00 64.05 62.26 1gkq n THR 47 Cb 1.24 -1.51 -0.02 0.00 -1.82 0.00 0.00 70.33 68.22 1gkq n THR 47 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1gkq n GLY 48 N 3.55 0.70 3.29 3.41 0.00 -1.26 -5.01 105.19 109.88 1gkq n GLY 48 Ca 0.19 -0.48 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 1gkq n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gkq s LYS 49 N -1.90 1.20 0.16 1.61 1.02 -0.25 -4.72 119.74 116.86 1gkq s LYS 49 Ca 0.00 -1.55 -0.05 0.00 0.02 0.00 0.00 55.97 54.40 1gkq s LYS 49 Cb 0.00 -0.70 -0.05 0.00 -0.52 0.00 0.00 37.83 36.55 1gkq s LYS 49 CO 0.00 0.03 0.39 0.71 -0.92 0.00 0.00 175.35 175.57 1gkq s TYR 50 N -3.30 3.47 -0.28 3.18 2.02 -0.35 -1.51 117.35 120.58 1gkq s TYR 50 Ca 0.21 0.55 0.03 0.00 -0.37 0.00 0.00 57.07 57.49 1gkq s TYR 50 Cb 0.03 -2.00 0.08 0.00 -0.40 0.00 0.00 41.96 39.66 1gkq s TYR 50 CO 0.04 0.41 -0.03 0.08 -1.57 0.00 0.00 175.55 174.48 1gkq s VAL 51 N -1.71 1.97 0.33 0.71 1.01 -0.22 0.31 120.40 122.80 1gkq s VAL 51 Ca 0.41 -1.77 0.07 0.00 0.00 0.00 0.00 61.98 60.69 1gkq s VAL 51 Cb -0.12 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 1gkq s VAL 51 CO 0.25 -0.28 0.37 -0.36 0.00 0.00 0.00 175.10 175.08 1gkq s PHE 52 N 1.13 3.02 0.60 5.22 0.08 -0.23 -1.84 117.98 125.96 1gkq s PHE 52 Ca -0.00 -0.25 -0.14 0.00 0.12 0.00 0.00 56.93 56.65 1gkq s PHE 52 Cb -0.19 -1.86 -0.04 0.00 -0.57 0.00 0.00 43.02 40.36 1gkq s PHE 52 CO -0.08 0.12 1.04 -2.14 -0.10 0.00 0.00 175.22 174.06 1gkq s PRO 53 N -4.07 3.41 0.29 0.24 0.02 -1.26 -1.64 135.00 131.99 1gkq s PRO 53 Ca 0.42 1.05 -0.30 0.00 0.02 0.00 0.00 61.00 62.19 1gkq s PRO 53 Cb -0.08 -2.05 -0.12 0.00 0.02 0.00 0.00 34.50 32.27 1gkq s PRO 53 CO 0.29 -0.72 1.56 0.41 -0.33 0.00 0.00 177.00 178.20 1gkq n GLY 54 N -1.50 1.24 3.82 0.52 0.00 -0.40 -4.57 105.19 104.29 1gkq n GLY 54 Ca 0.08 0.46 -0.33 0.00 0.00 0.00 0.00 46.02 46.23 1gkq n GLY 54 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gkq s PHE 55 N -0.05 3.20 -0.11 1.61 0.08 -0.98 -4.56 117.98 117.17 1gkq s PHE 55 Ca 0.64 1.55 0.02 0.00 0.12 0.00 0.00 56.93 59.26 1gkq s PHE 55 Cb -0.52 -2.92 0.01 0.00 -0.57 0.00 0.00 43.02 39.02 1gkq s PHE 55 CO 0.49 -0.55 -0.18 0.42 -0.10 0.00 0.00 175.22 175.30 1gkq s ILE 56 N -2.28 1.67 -0.39 0.64 1.01 -0.64 -1.08 121.20 120.12 1gkq s ILE 56 Ca 0.63 -0.76 -0.12 0.00 0.00 0.00 0.00 60.65 60.41 1gkq s ILE 56 Cb -0.13 -1.50 0.04 0.00 0.01 0.00 0.00 42.46 40.88 1gkq s ILE 56 CO 0.24 0.47 0.24 -0.62 0.00 0.00 0.00 174.94 175.27 1gkq s ASP 57 N 0.82 5.81 0.00 3.58 -1.08 -0.74 -4.49 116.67 120.56 1gkq s ASP 57 Ca -0.09 -1.09 0.15 0.00 -0.52 0.00 0.00 52.55 51.00 1gkq s ASP 57 Cb -0.16 -2.05 0.86 0.00 -1.46 0.00 0.00 42.92 40.12 1gkq s ASP 57 CO 0.00 -0.44 1.56 -0.81 0.52 0.00 0.00 175.17 176.01 1gkq n PRO 58 N 5.02 1.05 -3.32 4.34 -0.04 -1.26 -0.86 135.00 139.93 1gkq n PRO 58 Ca -0.11 -0.07 -0.12 0.00 -0.04 0.00 0.00 63.50 63.15 1gkq n PRO 58 Cb 0.45 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.61 1gkq n PRO 58 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1gkq s HIS 59 N -1.98 -0.66 0.15 0.54 5.04 -1.23 -4.63 115.29 112.51 1gkq s HIS 59 Ca 0.23 -0.50 0.02 0.00 -1.54 0.00 0.00 55.06 53.27 1gkq s HIS 59 Cb 0.11 -0.23 -0.05 0.00 0.04 0.00 0.00 32.58 32.45 1gkq s HIS 59 CO 0.17 -1.02 -0.03 0.14 -2.34 0.00 0.00 174.74 171.67 1gkq s VAL 60 N 1.61 0.79 -0.20 0.89 -7.23 -0.91 -0.18 120.40 115.17 1gkq s VAL 60 Ca 0.16 -1.99 -0.00 0.00 -1.81 0.00 0.00 61.98 58.34 1gkq s VAL 60 Cb -0.13 -1.98 0.05 0.00 0.56 0.00 0.00 36.38 34.89 1gkq s VAL 60 CO -0.06 -0.61 -0.03 -1.00 -0.31 0.00 0.00 175.10 173.08 1gkq s HIS 61 N -3.58 1.86 0.00 2.82 3.76 -0.18 -1.90 115.29 118.07 1gkq s HIS 61 Ca 0.20 -1.34 0.00 0.00 -0.15 0.00 0.00 55.06 53.78 1gkq s HIS 61 Cb 0.05 -1.37 0.00 0.00 1.11 0.00 0.00 32.58 32.37 1gkq s HIS 61 CO 0.02 -0.69 0.00 -0.89 -0.85 0.00 0.00 174.74 172.33 1gkq n ILE 62 N 4.82 0.00 -3.05 0.60 2.08 -1.26 -4.56 119.36 117.99 1gkq n ILE 62 Ca -0.11 0.38 -0.41 0.00 0.56 0.00 0.00 62.75 63.17 1gkq n ILE 62 Cb 0.46 -1.37 -0.06 0.00 -0.75 0.00 0.00 39.64 37.92 1gkq n ILE 62 CO 0.00 0.00 0.00 -0.47 0.56 0.00 0.00 176.55 176.64 1gkq s TYR 63 N -0.84 3.24 -0.27 1.39 5.04 -1.26 -4.46 117.35 120.19 1gkq s TYR 63 Ca 0.00 0.76 -0.01 0.00 -2.44 0.00 0.00 57.07 55.39 1gkq s TYR 63 Cb 0.00 -3.01 0.15 0.00 0.35 0.00 0.00 41.96 39.45 1gkq s TYR 63 CO 0.00 -0.45 0.43 -1.17 -1.34 0.00 0.00 175.55 173.02 1gkq s LEU 64 N 2.69 -0.82 -0.51 6.97 2.96 -1.26 -4.81 118.68 123.89 1gkq s LEU 64 Ca 0.28 0.15 -0.25 0.00 -0.22 0.00 0.00 54.13 54.10 1gkq s LEU 64 Cb -0.15 1.30 0.03 0.00 0.50 0.00 0.00 46.19 47.87 1gkq s LEU 64 CO 0.10 -0.31 0.93 -2.84 -1.32 0.00 0.00 176.35 172.92 1gkq s PRO 65 N 2.60 3.42 -0.10 0.98 0.02 -1.26 -1.74 135.00 138.92 1gkq s PRO 65 Ca 0.13 -0.06 -0.13 0.00 0.02 0.00 0.00 61.00 60.96 1gkq s PRO 65 Cb -0.14 -3.99 0.03 0.00 0.02 0.00 0.00 34.50 30.42 1gkq s PRO 65 CO -0.21 -1.36 0.34 0.12 -0.33 0.00 0.00 177.00 175.57 1gkq s PHE 66 N 3.86 -0.33 -1.28 6.54 5.36 0.76 -4.94 117.98 127.94 1gkq s PHE 66 Ca 0.33 0.76 -0.18 0.00 -0.96 0.00 0.00 56.93 56.89 1gkq s PHE 66 Cb -0.11 0.13 0.01 0.00 -0.34 0.00 0.00 43.02 42.70 1gkq s PHE 66 CO 0.23 -0.25 0.56 -1.33 -1.46 0.00 0.00 175.22 172.97 1gkq n MET 67 N 2.42 -1.34 -0.98 10.12 2.81 -1.26 -1.50 117.12 127.39 1gkq n MET 67 Ca -0.15 0.27 0.00 0.00 -1.81 0.00 0.00 57.70 56.00 1gkq n MET 67 Cb 0.57 -3.63 0.00 0.00 -0.71 0.00 0.00 33.22 29.46 1gkq n MET 67 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1gkq n ALA 68 N -4.58 0.00 -3.00 3.04 0.00 -1.26 -4.78 120.51 109.93 1gkq n ALA 68 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1gkq n ALA 68 Cb 0.62 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.22 1gkq n ALA 68 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1gkq n THR 69 N -2.39 0.00 -4.66 0.00 5.66 -0.56 -5.18 114.28 107.14 1gkq n THR 69 Ca 0.00 0.00 -0.23 0.00 -3.05 0.00 0.00 64.05 60.77 1gkq n THR 69 Cb 0.27 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 68.90 1gkq n THR 69 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1gkq s PHE 70 N -4.49 1.35 0.50 1.09 0.40 -1.26 -0.17 117.98 115.40 1gkq s PHE 70 Ca 0.00 -0.27 -0.23 0.00 -0.60 0.00 0.00 56.93 55.83 1gkq s PHE 70 Cb 0.00 -0.86 -0.06 0.00 0.51 0.00 0.00 43.02 42.61 1gkq s PHE 70 CO 0.00 -0.01 1.34 0.00 0.70 0.00 0.00 175.22 177.25 1gkq s ALA 71 N -0.42 2.99 0.24 5.36 0.00 -0.71 -4.95 121.76 124.25 1gkq s ALA 71 Ca 0.05 1.29 0.02 0.00 0.00 0.00 0.00 51.96 53.33 1gkq s ALA 71 Cb -0.06 -3.54 0.26 0.00 0.00 0.00 0.00 23.12 19.78 1gkq s ALA 71 CO -0.00 -1.17 1.59 0.87 0.00 0.00 0.00 175.76 177.05 1gkq h LYS 72 N 1.88 0.37 -7.24 0.00 1.79 -1.38 -3.44 116.57 108.55 1gkq h LYS 72 Ca -0.50 -0.22 -0.49 0.00 -2.18 0.00 0.00 60.65 57.26 1gkq h LYS 72 Cb 1.28 0.02 0.06 0.00 -1.58 0.00 0.00 32.23 32.00 1gkq h LYS 72 CO 0.59 0.79 0.38 -0.51 -1.08 0.00 0.00 179.45 179.62 1gkq s ASP 73 N -6.89 5.97 0.38 0.86 1.01 -1.26 -4.80 116.67 111.95 1gkq s ASP 73 Ca -0.05 1.68 0.08 0.00 0.71 0.00 0.00 52.55 54.96 1gkq s ASP 73 Cb 0.12 -2.51 -0.06 0.00 1.01 0.00 0.00 42.92 41.48 1gkq s ASP 73 CO 0.81 -1.04 0.09 0.42 0.21 0.00 0.00 175.17 175.65 1gkq s THR 74 N -2.67 2.38 0.54 -1.27 -4.23 -1.26 -4.50 115.64 104.62 1gkq s THR 74 Ca 0.61 -1.86 0.41 0.00 -1.18 0.00 0.00 61.69 59.67 1gkq s THR 74 Cb -0.14 -2.93 0.43 0.00 1.34 0.00 0.00 72.50 71.20 1gkq s THR 74 CO 0.40 -0.08 2.28 0.45 -0.54 0.00 0.00 174.62 177.14 1gkq h HIS 75 N 1.63 0.00 0.06 3.99 3.86 -1.85 0.41 115.15 123.26 1gkq h HIS 75 Ca -0.43 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.78 1gkq h HIS 75 Cb 1.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.72 1gkq h HIS 75 CO 0.68 0.01 -0.03 1.49 0.86 0.00 0.00 177.93 180.93 1gkq h GLU 76 N 0.00 -0.08 -0.14 2.45 4.81 -1.89 -2.47 114.58 117.26 1gkq h GLU 76 Ca -0.00 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.12 1gkq h GLU 76 Cb 0.11 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1gkq h GLU 76 CO 0.00 0.35 -0.43 1.79 -0.73 0.00 0.00 179.01 180.00 1gkq h THR 77 N -0.97 1.31 -0.08 0.32 1.35 -1.80 -2.64 112.91 110.41 1gkq h THR 77 Ca -0.01 -1.58 -0.03 0.00 -0.55 0.00 0.00 66.41 64.25 1gkq h THR 77 Cb 0.47 1.67 -0.00 0.00 -1.73 0.00 0.00 68.15 68.57 1gkq h THR 77 CO 0.01 0.48 -0.05 1.23 -0.25 0.00 0.00 175.52 176.94 1gkq h GLY 78 N 1.20 0.20 1.80 5.82 0.00 -0.31 -1.85 103.07 109.92 1gkq h GLY 78 Ca 0.02 -0.18 -0.07 0.00 0.00 0.00 0.00 47.33 47.10 1gkq h GLY 78 CO 0.07 0.17 -0.24 1.48 0.00 0.00 0.00 176.54 178.01 1gkq h SER 79 N -0.20 0.23 -0.13 0.19 4.64 -1.47 -1.32 113.55 115.49 1gkq h SER 79 Ca 0.02 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.24 1gkq h SER 79 Cb 0.52 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1gkq h SER 79 CO 0.01 0.49 -0.02 0.50 -0.87 0.00 0.00 176.83 176.94 1gkq h LYS 80 N 0.22 0.25 -0.95 4.77 3.64 -1.43 -1.56 116.57 121.50 1gkq h LYS 80 Ca 0.04 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1gkq h LYS 80 Cb 0.55 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.31 1gkq h LYS 80 CO 0.04 0.52 0.58 0.00 -2.27 0.00 0.00 179.45 178.31 1gkq h ALA 81 N 0.72 1.21 0.07 5.00 0.00 -1.14 -1.36 119.26 123.77 1gkq h ALA 81 Ca 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1gkq h ALA 81 Cb 0.42 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1gkq h ALA 81 CO 0.01 0.67 -0.05 0.00 0.00 0.00 0.00 179.25 179.88 1gkq h ALA 82 N 1.32 -0.11 -0.55 0.00 0.00 -1.08 -2.43 119.26 116.41 1gkq h ALA 82 Ca 0.34 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.26 1gkq h ALA 82 Cb -0.06 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1gkq h ALA 82 CO -0.06 -0.57 0.34 -0.07 0.00 0.00 0.00 179.25 178.88 1gkq h LEU 83 N -0.12 0.55 -1.81 0.00 3.38 -0.90 -0.29 115.31 116.12 1gkq h LEU 83 Ca -0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1gkq h LEU 83 Cb 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1gkq h LEU 83 CO -0.01 0.39 0.31 0.24 0.09 0.00 0.00 178.44 179.47 1gkq h MET 84 N 0.67 0.21 -0.01 1.13 2.86 -1.07 -0.25 114.93 118.46 1gkq h MET 84 Ca 0.22 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1gkq h MET 84 Cb 0.00 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.62 1gkq h MET 84 CO -0.09 0.14 -0.16 0.41 1.06 0.00 0.00 176.91 178.27 1gkq n GLY 85 N -1.56 -0.76 0.00 8.32 0.00 -0.47 -4.62 105.19 106.10 1gkq n GLY 85 Ca 0.07 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1gkq n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gkq n GLY 86 N 1.29 0.47 3.60 -0.02 0.00 -0.11 -4.51 105.19 105.92 1gkq n GLY 86 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1gkq n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gkq s THR 87 N -2.00 4.98 -0.91 2.61 2.01 -0.24 -2.33 115.64 119.77 1gkq s THR 87 Ca 0.00 0.83 0.20 0.00 0.31 0.00 0.00 61.69 63.03 1gkq s THR 87 Cb 0.00 -3.94 -0.22 0.00 0.01 0.00 0.00 72.50 68.34 1gkq s THR 87 CO 0.00 -0.07 0.84 0.35 -0.69 0.00 0.00 174.62 175.04 1gkq n THR 88 N 5.32 0.00 -3.78 -0.82 -2.24 -0.25 -2.84 114.28 109.67 1gkq n THR 88 Ca -0.02 -0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.58 1gkq n THR 88 Cb 0.49 0.95 -0.13 0.00 -2.10 0.00 0.00 70.33 69.54 1gkq n THR 88 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1gkq s THR 89 N -2.93 -0.02 0.05 4.28 2.01 -1.16 -3.38 115.64 114.49 1gkq s THR 89 Ca 0.07 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.17 1gkq s THR 89 Cb 0.15 -0.27 -0.03 0.00 0.01 0.00 0.00 72.50 72.37 1gkq s THR 89 CO 0.83 0.03 -0.10 -0.72 -0.69 0.00 0.00 174.62 173.97 1gkq s TYR 90 N 0.58 0.86 -0.23 4.92 1.13 -1.19 -1.79 117.35 121.63 1gkq s TYR 90 Ca -0.04 -0.48 -0.03 0.00 -1.41 0.00 0.00 57.07 55.11 1gkq s TYR 90 Cb -0.06 -0.50 0.01 0.00 -1.10 0.00 0.00 41.96 40.31 1gkq s TYR 90 CO -0.03 -0.04 -0.07 0.42 -2.51 0.00 0.00 175.55 173.33 1gkq s ILE 91 N -1.33 3.03 0.05 -3.49 1.01 -0.04 -2.56 121.20 117.87 1gkq s ILE 91 Ca -0.07 -0.74 -0.08 0.00 0.00 0.00 0.00 60.65 59.75 1gkq s ILE 91 Cb -0.10 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.89 1gkq s ILE 91 CO 0.01 0.35 0.34 -0.70 0.00 0.00 0.00 174.94 174.95 1gkq s GLU 92 N 1.40 3.68 -0.42 2.79 2.12 -0.37 -2.14 118.70 125.75 1gkq s GLU 92 Ca 0.04 0.06 -0.27 0.00 0.36 0.00 0.00 54.97 55.16 1gkq s GLU 92 Cb -0.15 -3.03 0.02 0.00 0.26 0.00 0.00 34.13 31.23 1gkq s GLU 92 CO -0.05 0.60 1.01 -1.64 -0.54 0.00 0.00 175.26 174.64 1gkq s MET 93 N -1.85 3.75 -0.49 4.30 -1.94 -0.80 -1.28 119.30 120.99 1gkq s MET 93 Ca 0.31 0.52 -0.28 0.00 -1.71 0.00 0.00 55.69 54.52 1gkq s MET 93 Cb -0.14 -3.86 0.03 0.00 2.01 0.00 0.00 34.83 32.87 1gkq s MET 93 CO 0.17 -1.15 1.08 0.00 -0.01 0.00 0.00 175.02 175.11 1gkq s PRO 96 N -3.00 4.16 0.84 0.00 0.04 -1.26 -4.90 135.00 130.88 1gkq s PRO 96 Ca 0.42 1.67 -0.14 0.00 0.04 0.00 0.00 61.00 62.98 1gkq s PRO 96 Cb 0.18 -2.66 0.20 0.00 0.04 0.00 0.00 34.50 32.26 1gkq s PRO 96 CO -0.04 -0.18 1.13 -1.13 0.04 0.00 0.00 177.00 176.81 1gkq n SER 97 N 0.10 -0.01 0.20 6.66 3.41 -1.26 -4.59 113.62 118.14 1gkq n SER 97 Ca 0.04 -1.39 0.07 0.00 -0.26 0.00 0.00 58.87 57.33 1gkq n SER 97 Cb 0.48 -0.87 0.58 0.00 -0.26 0.00 0.00 64.21 64.14 1gkq n SER 97 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1gkq h ARG 98 N 0.00 0.11 -0.01 4.33 2.43 -1.32 -2.12 114.38 117.80 1gkq h ARG 98 Ca -0.37 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1gkq h ARG 98 Cb 1.01 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1gkq h ARG 98 CO 0.26 0.09 -0.07 0.09 -1.51 0.00 0.00 179.97 178.83 1gkq n ASN 99 N -4.50 0.75 -4.96 -3.80 3.02 -1.26 -4.89 115.26 99.61 1gkq n ASN 99 Ca -0.02 -0.97 -0.22 0.00 -0.03 0.00 0.00 54.58 53.35 1gkq n ASN 99 Cb 0.10 -0.01 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 1gkq n ASN 99 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1gkq s ASP 100 N -2.25 6.32 -0.15 6.41 1.01 -0.80 -5.07 116.67 122.15 1gkq s ASP 100 Ca 0.35 0.10 -0.26 0.00 0.71 0.00 0.00 52.55 53.44 1gkq s ASP 100 Cb 0.21 -1.87 -0.02 0.00 1.01 0.00 0.00 42.92 42.25 1gkq s ASP 100 CO 0.42 -0.05 0.86 -0.62 0.21 0.00 0.00 175.17 175.99 1gkq s ASP 101 N -3.83 7.03 0.13 0.27 2.15 -1.26 -4.83 116.67 116.33 1gkq s ASP 101 Ca 0.34 1.26 -0.19 0.00 0.43 0.00 0.00 52.55 54.39 1gkq s ASP 101 Cb -0.09 -2.48 -0.01 0.00 -0.30 0.00 0.00 42.92 40.04 1gkq s ASP 101 CO 0.29 -0.39 1.71 0.00 -0.17 0.00 0.00 175.17 176.61 1gkq h ALA 102 N 7.24 0.18 -0.89 3.66 0.00 -1.96 0.11 119.26 127.60 1gkq h ALA 102 Ca -0.30 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1gkq h ALA 102 Cb 1.14 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 1gkq h ALA 102 CO 0.84 -0.44 0.54 1.25 0.00 0.00 0.00 179.25 181.43 1gkq h LEU 103 N 0.04 1.07 -0.55 0.00 5.85 -1.93 0.12 115.31 119.92 1gkq h LEU 103 Ca 0.11 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 1gkq h LEU 103 Cb 0.15 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1gkq h LEU 103 CO -0.21 0.83 0.12 -0.33 -0.34 0.00 0.00 178.44 178.52 1gkq h GLU 104 N 1.23 0.88 -0.23 1.25 5.08 -1.89 -1.79 114.58 119.11 1gkq h GLU 104 Ca 0.32 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1gkq h GLU 104 Cb -0.05 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1gkq h GLU 104 CO -0.06 0.84 0.11 0.78 -1.00 0.00 0.00 179.01 179.68 1gkq h GLY 105 N 0.78 0.30 0.66 -3.84 0.00 -0.26 0.10 103.07 100.80 1gkq h GLY 105 Ca 0.17 -0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.46 1gkq h GLY 105 CO 0.00 0.07 0.05 -1.82 0.00 0.00 0.00 176.54 174.84 1gkq h TYR 106 N 0.24 0.09 -0.08 5.60 3.20 -0.83 -1.87 116.97 123.31 1gkq h TYR 106 Ca 0.09 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 1gkq h TYR 106 Cb 0.02 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1gkq h TYR 106 CO -0.09 0.02 -0.16 1.96 -1.64 0.00 0.00 178.16 178.24 1gkq h GLN 107 N 0.16 0.13 0.14 1.82 4.20 -0.93 0.09 115.11 120.71 1gkq h GLN 107 Ca 0.13 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1gkq h GLN 107 Cb 0.14 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1gkq h GLN 107 CO -0.18 0.29 -0.07 1.25 -0.67 0.00 0.00 178.83 179.46 1gkq h LEU 108 N 0.12 -0.16 -0.55 1.46 5.85 -0.33 -1.03 115.31 120.67 1gkq h LEU 108 Ca 0.02 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.50 1gkq h LEU 108 Cb 0.36 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1gkq h LEU 108 CO 0.02 0.18 0.36 -0.50 -0.34 0.00 0.00 178.44 178.16 1gkq h TRP 109 N -0.52 0.68 -0.73 1.25 6.55 -1.17 -1.68 115.95 120.33 1gkq h TRP 109 Ca -0.02 0.02 0.02 0.00 0.95 0.00 0.00 58.89 59.86 1gkq h TRP 109 Cb 0.41 -0.23 -0.04 0.00 -0.86 0.00 0.00 29.16 28.44 1gkq h TRP 109 CO 0.03 0.42 0.48 -0.22 -1.05 0.00 0.00 178.44 178.09 1gkq h LYS 110 N 0.73 0.93 0.00 0.49 3.64 -0.93 -2.69 116.57 118.74 1gkq h LYS 110 Ca 0.21 -0.06 -0.13 0.00 -1.27 0.00 0.00 60.65 59.40 1gkq h LYS 110 Cb -0.06 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.53 1gkq h LYS 110 CO -0.06 0.61 -0.64 0.66 -2.27 0.00 0.00 179.45 177.76 1gkq h SER 111 N 0.96 0.00 0.57 4.20 4.64 -0.92 -2.83 113.55 120.16 1gkq h SER 111 Ca 0.28 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.55 1gkq h SER 111 Cb -0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 1gkq h SER 111 CO -0.08 0.64 -0.24 0.11 -0.87 0.00 0.00 176.83 176.39 1gkq h LYS 112 N 0.00 0.00 0.08 4.77 1.57 -1.03 -3.16 116.57 118.80 1gkq h LYS 112 Ca -0.01 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.46 1gkq h LYS 112 Cb 1.36 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.64 1gkq h LYS 112 CO 0.08 0.24 -1.67 0.00 -0.57 0.00 0.00 179.45 177.53 1gkq h ALA 113 N 1.76 0.48 -1.99 3.86 0.00 -1.41 -3.43 119.26 118.53 1gkq h ALA 113 Ca -0.00 -1.28 -0.63 0.00 0.00 0.00 0.00 54.91 52.99 1gkq h ALA 113 Cb 0.59 0.43 0.04 0.00 0.00 0.00 0.00 17.79 18.86 1gkq h ALA 113 CO 0.03 1.33 0.77 0.39 0.00 0.00 0.00 179.25 181.78 1gkq n GLU 114 N -3.32 1.78 -0.90 0.00 1.02 -1.08 -1.15 120.64 116.99 1gkq n GLU 114 Ca -0.19 0.65 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 1gkq n GLU 114 Cb 1.04 -2.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1gkq n GLU 114 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gkq n GLY 115 N 3.45 0.17 0.09 0.62 0.00 -1.26 -4.79 105.19 103.47 1gkq n GLY 115 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.23 1gkq n GLY 115 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gkq n ASN 116 N -0.52 0.95 -4.64 1.61 3.02 -0.30 -3.25 115.26 112.12 1gkq n ASN 116 Ca 0.00 -0.97 -0.35 0.00 -0.03 0.00 0.00 54.58 53.23 1gkq n ASN 116 Cb 0.26 0.28 -0.10 0.00 -0.61 0.00 0.00 39.78 39.61 1gkq n ASN 116 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1gkq s SER 117 N -0.53 5.30 0.45 6.41 0.15 -1.18 -2.76 113.70 121.53 1gkq s SER 117 Ca 0.03 0.09 0.24 0.00 0.70 0.00 0.00 55.95 57.01 1gkq s SER 117 Cb 0.02 -1.70 0.50 0.00 -1.71 0.00 0.00 66.02 63.14 1gkq s SER 117 CO 0.06 0.28 1.66 1.88 1.20 0.00 0.00 173.24 178.33 1gkq h TYR 118 N 5.87 0.00 -3.50 3.44 0.05 -1.83 0.17 116.97 121.17 1gkq h TYR 118 Ca -0.43 0.00 -0.37 0.00 0.05 0.00 0.00 58.73 57.98 1gkq h TYR 118 Cb 1.19 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 38.78 1gkq h TYR 118 CO 0.60 0.03 -0.63 0.00 -1.05 0.00 0.00 178.16 177.11 1gkq s ASP 120 N -3.32 4.44 0.36 0.00 1.01 -1.22 -4.17 116.67 113.77 1gkq s ASP 120 Ca 0.33 1.93 -0.17 0.00 0.71 0.00 0.00 52.55 55.34 1gkq s ASP 120 Cb 0.07 -2.54 0.05 0.00 1.01 0.00 0.00 42.92 41.51 1gkq s ASP 120 CO 0.11 -2.08 0.77 -0.72 0.21 0.00 0.00 175.17 173.46 1gkq s TYR 121 N -2.72 0.04 0.28 4.23 1.13 -0.70 -3.14 117.35 116.47 1gkq s TYR 121 Ca 0.64 -0.65 -0.19 0.00 -1.41 0.00 0.00 57.07 55.45 1gkq s TYR 121 Cb -0.19 0.81 0.07 0.00 -1.10 0.00 0.00 41.96 41.54 1gkq s TYR 121 CO 0.53 -1.48 0.93 -0.08 -2.51 0.00 0.00 175.55 172.94 1gkq s THR 122 N -2.74 0.00 0.24 -3.49 -1.32 -1.06 -0.00 115.64 107.26 1gkq s THR 122 Ca 0.14 -0.77 0.05 0.00 -1.21 0.00 0.00 61.69 59.90 1gkq s THR 122 Cb -0.05 -2.92 -0.05 0.00 -1.51 0.00 0.00 72.50 67.96 1gkq s THR 122 CO 0.10 0.00 -0.06 -0.36 -2.21 0.00 0.00 174.62 172.09 1gkq s PHE 123 N -2.18 1.70 -0.16 9.09 0.08 -1.26 -1.24 117.98 124.01 1gkq s PHE 123 Ca 0.19 -0.76 -0.01 0.00 0.12 0.00 0.00 56.93 56.47 1gkq s PHE 123 Cb -0.04 -0.94 -0.01 0.00 -0.57 0.00 0.00 43.02 41.46 1gkq s PHE 123 CO 0.08 0.16 -0.11 -1.01 -0.10 0.00 0.00 175.22 174.24 1gkq s HIS 124 N -3.18 2.86 -0.36 0.36 3.76 -0.41 -4.62 115.29 113.70 1gkq s HIS 124 Ca 0.27 -0.79 -0.21 0.00 -0.15 0.00 0.00 55.06 54.18 1gkq s HIS 124 Cb 0.04 -1.93 0.01 0.00 1.11 0.00 0.00 32.58 31.81 1gkq s HIS 124 CO 0.09 -0.34 0.67 1.41 -0.85 0.00 0.00 174.74 175.71 1gkq s MET 125 N 0.73 3.68 0.23 1.40 1.75 -0.09 -0.88 119.30 126.12 1gkq s MET 125 Ca -0.05 0.09 -0.30 0.00 -1.25 0.00 0.00 55.69 54.19 1gkq s MET 125 Cb -0.15 -3.82 -0.09 0.00 2.84 0.00 0.00 34.83 33.62 1gkq s MET 125 CO 0.02 -0.78 1.11 0.00 -0.65 0.00 0.00 175.02 174.72 1gkq s ALA 126 N 2.81 3.40 -0.48 4.11 0.00 -0.61 -4.25 121.76 126.73 1gkq s ALA 126 Ca 0.26 0.88 0.01 0.00 0.00 0.00 0.00 51.96 53.11 1gkq s ALA 126 Cb -0.14 -3.35 0.13 0.00 0.00 0.00 0.00 23.12 19.76 1gkq s ALA 126 CO 0.15 -0.20 0.24 0.08 0.00 0.00 0.00 175.76 176.03 1gkq s VAL 127 N -0.70 2.89 -0.82 0.00 1.01 -1.26 -4.76 120.40 116.76 1gkq s VAL 127 Ca 0.47 -2.79 0.13 0.00 0.00 0.00 0.00 61.98 59.80 1gkq s VAL 127 Cb -0.31 -3.00 0.64 0.00 0.00 0.00 0.00 36.38 33.71 1gkq s VAL 127 CO 0.38 -0.75 1.51 -1.54 0.00 0.00 0.00 175.10 174.70 1gkq n SER 128 N 3.73 4.47 -3.65 3.32 3.41 -1.26 -4.67 113.62 118.97 1gkq n SER 128 Ca 0.04 -2.56 -0.02 0.00 -0.26 0.00 0.00 58.87 56.07 1gkq n SER 128 Cb 0.37 -0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 63.71 1gkq n SER 128 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1gkq s LYS 129 N -2.11 0.01 -0.04 4.33 -2.85 -1.26 -4.35 119.74 113.46 1gkq s LYS 129 Ca 0.44 -0.00 -0.01 0.00 -1.00 0.00 0.00 55.97 55.40 1gkq s LYS 129 Cb 0.31 0.00 0.03 0.00 -2.06 0.00 0.00 37.83 36.11 1gkq s LYS 129 CO 0.17 -0.00 0.07 0.12 0.10 0.00 0.00 175.35 175.81 1gkq s PHE 130 N -1.91 -0.03 0.26 1.78 2.19 -1.26 -4.99 117.98 114.02 1gkq s PHE 130 Ca 0.12 0.26 -0.21 0.00 0.33 0.00 0.00 56.93 57.42 1gkq s PHE 130 Cb -0.01 -0.22 0.04 0.00 -1.31 0.00 0.00 43.02 41.52 1gkq s PHE 130 CO -0.03 -0.13 0.80 0.16 1.83 0.00 0.00 175.22 177.86 1gkq s ASP 131 N 1.24 -0.19 0.21 6.13 1.47 -1.26 -4.98 116.67 119.28 1gkq s ASP 131 Ca -0.07 -0.64 -0.12 0.00 1.18 0.00 0.00 52.55 52.89 1gkq s ASP 131 Cb -0.12 0.68 0.26 0.00 -0.34 0.00 0.00 42.92 43.39 1gkq s ASP 131 CO -0.04 -1.28 1.66 -0.33 0.68 0.00 0.00 175.17 175.86 1gkq h GLU 132 N 2.00 0.09 -0.28 2.11 3.07 -2.00 -0.08 114.58 119.50 1gkq h GLU 132 Ca -0.23 -0.01 0.05 0.00 -0.50 0.00 0.00 59.36 58.68 1gkq h GLU 132 Cb 1.24 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 29.09 1gkq h GLU 132 CO 0.27 0.06 0.00 -0.22 -1.40 0.00 0.00 179.01 177.72 1gkq h LYS 133 N 0.09 0.08 -0.60 2.33 3.64 -2.01 -2.63 116.57 117.48 1gkq h LYS 133 Ca 0.30 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.62 1gkq h LYS 133 Cb 0.48 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1gkq h LYS 133 CO -0.52 0.06 0.15 1.15 -2.27 0.00 0.00 179.45 178.02 1gkq h THR 134 N 0.09 1.25 -0.57 1.00 2.02 -1.65 -2.74 112.91 112.31 1gkq h THR 134 Ca 0.13 -0.89 0.07 0.00 0.77 0.00 0.00 66.41 66.49 1gkq h THR 134 Cb 0.17 0.68 -0.06 0.00 -1.74 0.00 0.00 68.15 67.20 1gkq h THR 134 CO -0.22 0.34 0.25 -0.08 0.37 0.00 0.00 175.52 176.17 1gkq h GLU 135 N 0.87 0.45 -0.94 6.66 4.81 -0.78 0.10 114.58 125.75 1gkq h GLU 135 Ca 0.19 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 1gkq h GLU 135 Cb 0.34 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.57 1gkq h GLU 135 CO 0.00 0.29 0.57 0.78 -0.73 0.00 0.00 179.01 179.92 1gkq h GLY 136 N 0.46 1.37 1.53 1.92 0.00 -1.30 -1.91 103.07 105.14 1gkq h GLY 136 Ca 0.27 -0.57 -0.15 0.00 0.00 0.00 0.00 47.33 46.88 1gkq h GLY 136 CO -0.24 0.55 -0.53 1.46 0.00 0.00 0.00 176.54 177.78 1gkq h GLN 137 N 1.30 0.49 -0.59 4.80 4.20 -1.04 -2.90 115.11 121.38 1gkq h GLN 137 Ca 0.34 -0.30 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1gkq h GLN 137 Cb -0.06 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1gkq h GLN 137 CO -0.06 0.90 0.09 -0.07 -0.67 0.00 0.00 178.83 179.02 1gkq h LEU 138 N 0.38 0.90 -1.23 1.46 3.38 -0.37 -0.38 115.31 119.45 1gkq h LEU 138 Ca 0.01 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1gkq h LEU 138 Cb 1.06 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1gkq h LEU 138 CO 0.10 0.91 0.15 0.03 0.09 0.00 0.00 178.44 179.71 1gkq h ARG 139 N 0.89 0.68 -0.20 1.13 3.08 -1.27 -0.08 114.38 118.61 1gkq h ARG 139 Ca 0.18 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 60.00 1gkq h ARG 139 Cb 0.40 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1gkq h ARG 139 CO 0.01 0.59 -0.36 1.49 -1.07 0.00 0.00 179.97 180.63 1gkq h GLU 140 N 0.67 0.60 -0.67 0.04 4.81 -1.18 -1.92 114.58 116.93 1gkq h GLU 140 Ca 0.16 -0.38 -0.06 0.00 -0.13 0.00 0.00 59.36 58.95 1gkq h GLU 140 Cb 0.20 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1gkq h GLU 140 CO -0.01 0.99 0.18 0.82 -0.73 0.00 0.00 179.01 180.26 1gkq h ILE 141 N 0.28 1.26 -0.40 2.32 2.04 -0.71 -1.98 117.51 120.32 1gkq h ILE 141 Ca 0.01 -0.92 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 1gkq h ILE 141 Cb 0.95 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 1gkq h ILE 141 CO 0.08 0.35 0.16 0.58 0.00 0.00 0.00 178.15 179.32 1gkq h VAL 142 N 0.99 1.20 0.00 1.67 2.07 -1.02 -1.79 116.25 119.37 1gkq h VAL 142 Ca 0.21 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 1gkq h VAL 142 Cb 0.34 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1gkq h VAL 142 CO -0.00 0.22 -0.00 0.00 0.02 0.00 0.00 177.57 177.81 1gkq h ALA 143 N 1.00 1.06 -0.12 1.67 0.00 -1.01 0.74 119.26 122.60 1gkq h ALA 143 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1gkq h ALA 143 Cb 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1gkq h ALA 143 CO -0.01 0.00 0.00 -3.47 0.00 0.00 0.00 179.25 175.77 1gkq n ASP 144 N -3.17 1.00 0.00 0.00 2.03 -0.68 -4.89 116.55 110.85 1gkq n ASP 144 Ca -0.03 -1.67 0.00 0.00 0.52 0.00 0.00 54.79 53.61 1gkq n ASP 144 Cb 0.09 -0.08 0.00 0.00 -0.72 0.00 0.00 41.12 40.41 1gkq n ASP 144 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1gkq n GLY 145 N 0.96 0.65 3.50 0.27 0.00 0.25 -4.87 105.19 105.94 1gkq n GLY 145 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1gkq n GLY 145 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gkq s ILE 146 N -2.00 4.80 -0.80 -0.61 -1.09 -1.16 0.05 121.20 120.39 1gkq s ILE 146 Ca 0.00 -0.00 0.17 0.00 -2.23 0.00 0.00 60.65 58.59 1gkq s ILE 146 Cb 0.00 -4.25 0.74 0.00 -1.58 0.00 0.00 42.46 37.36 1gkq s ILE 146 CO 0.00 -0.68 1.65 -1.54 -1.23 0.00 0.00 174.94 173.14 1gkq n SER 147 N 6.34 4.99 -3.90 3.58 3.41 -1.26 -4.04 113.62 122.74 1gkq n SER 147 Ca -0.02 -2.62 -0.13 0.00 -0.26 0.00 0.00 58.87 55.84 1gkq n SER 147 Cb 0.47 -0.60 -0.14 0.00 -0.26 0.00 0.00 64.21 63.68 1gkq n SER 147 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1gkq s SER 148 N -0.94 0.16 0.00 4.04 1.04 -1.26 -2.47 113.70 114.27 1gkq s SER 148 Ca 0.51 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.90 1gkq s SER 148 Cb 0.35 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1gkq s SER 148 CO 0.21 0.00 0.00 0.49 0.98 0.00 0.00 173.24 174.92 1gkq n PHE 149 N 2.99 0.00 -3.58 5.02 3.72 -0.58 -0.91 117.46 124.12 1gkq n PHE 149 Ca -0.13 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.20 1gkq n PHE 149 Cb 0.59 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.10 1gkq n PHE 149 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 1gkq s ILE 151 N 2.90 0.00 -0.09 4.37 -4.36 -0.67 -1.41 121.20 121.93 1gkq s ILE 151 Ca 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 60.65 60.43 1gkq s ILE 151 Cb 0.00 -1.00 -0.01 0.00 1.25 0.00 0.00 42.46 42.70 1gkq s ILE 151 CO 0.00 0.00 -0.21 -0.36 0.24 0.00 0.00 174.94 174.61 1gkq s PHE 152 N -1.87 2.60 -0.88 1.37 0.40 -1.26 -1.73 117.98 116.60 1gkq s PHE 152 Ca 0.05 -0.81 0.01 0.00 -0.60 0.00 0.00 56.93 55.57 1gkq s PHE 152 Cb -0.01 -1.71 0.31 0.00 0.51 0.00 0.00 43.02 42.13 1gkq s PHE 152 CO -0.04 -0.28 1.41 1.28 0.70 0.00 0.00 175.22 178.29 1gkq n LEU 153 N 3.30 6.04 0.00 -0.37 4.77 0.40 -2.64 117.00 128.49 1gkq n LEU 153 Ca -0.18 -5.44 0.00 0.00 -0.03 0.00 0.00 56.01 50.36 1gkq n LEU 153 Cb 0.53 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1gkq n LEU 153 CO 0.28 2.06 0.00 -1.54 -1.33 0.00 0.00 177.39 176.85 1gkq n SER 154 N 0.28 0.00 -3.10 -1.43 3.41 -1.26 -1.92 113.62 109.60 1gkq n SER 154 Ca 0.37 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.87 1gkq n SER 154 Cb 0.32 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.32 1gkq n SER 154 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1gkq n TYR 155 N -0.20 -2.45 -1.62 7.33 4.01 -1.26 -1.86 117.16 121.11 1gkq n TYR 155 Ca 0.00 0.88 -0.47 0.00 -0.16 0.00 0.00 57.90 58.15 1gkq n TYR 155 Cb 0.00 -4.01 -0.03 0.00 -0.31 0.00 0.00 39.34 34.99 1gkq n TYR 155 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1gkq n LYS 156 N -2.74 1.53 -0.34 -0.72 4.81 -1.26 -1.67 118.16 117.76 1gkq n LYS 156 Ca -0.05 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 1gkq n LYS 156 Cb 0.58 -2.09 0.00 0.00 0.02 0.00 0.00 35.03 33.54 1gkq n LYS 156 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1gkq n ASN 157 N 1.98 0.00 -0.04 3.14 3.02 -1.26 -4.69 115.26 117.42 1gkq n ASN 157 Ca 0.13 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.59 1gkq n ASN 157 Cb 0.28 -1.10 -0.03 0.00 -0.61 0.00 0.00 39.78 38.32 1gkq n ASN 157 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1gkq n PHE 158 N -2.00 0.00 0.00 3.10 -0.00 -0.90 -4.67 117.46 112.99 1gkq n PHE 158 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1gkq n PHE 158 Cb 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 39.48 39.17 1gkq n PHE 158 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1gkq n PHE 159 N -3.49 0.00 -1.86 -5.13 0.99 -0.67 -1.12 117.46 106.18 1gkq n PHE 159 Ca -0.16 0.00 -0.41 0.00 -0.00 0.00 0.00 57.45 56.88 1gkq n PHE 159 Cb 0.56 0.00 -0.01 0.00 -1.00 0.00 0.00 39.48 39.03 1gkq n PHE 159 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1gkq s GLY 160 N -2.87 2.72 0.14 1.37 0.00 -0.78 -4.33 107.32 103.57 1gkq s GLY 160 Ca 0.00 1.51 0.07 0.00 0.00 0.00 0.00 44.72 46.30 1gkq s GLY 160 CO 0.00 2.28 -0.04 -1.34 0.00 0.00 0.00 173.10 173.99 1gkq s VAL 161 N -0.78 3.59 0.78 1.40 -7.23 -1.08 -4.56 120.40 112.52 1gkq s VAL 161 Ca 0.55 -1.33 -0.04 0.00 -1.81 0.00 0.00 61.98 59.35 1gkq s VAL 161 Cb -0.45 -2.75 0.15 0.00 0.56 0.00 0.00 36.38 33.89 1gkq s VAL 161 CO 0.57 -0.00 1.08 1.51 -0.31 0.00 0.00 175.10 177.94 1gkq s ASP 162 N -2.59 4.03 0.34 4.85 1.47 -1.26 -4.80 116.67 118.70 1gkq s ASP 162 Ca 0.25 -0.24 0.05 0.00 1.18 0.00 0.00 52.55 53.78 1gkq s ASP 162 Cb -0.10 -0.04 0.68 0.00 -0.34 0.00 0.00 42.92 43.12 1gkq s ASP 162 CO 0.17 -2.09 1.92 0.44 0.68 0.00 0.00 175.17 176.28 1gkq h ASP 163 N -0.80 0.75 -0.34 2.11 5.19 -2.00 0.56 116.42 121.88 1gkq h ASP 163 Ca -0.38 0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.01 1gkq h ASP 163 Cb 1.26 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.61 1gkq h ASP 163 CO 0.39 0.46 0.06 1.23 -3.12 0.00 0.00 179.24 178.27 1gkq h GLY 164 N 0.84 0.61 1.13 2.75 0.00 -1.99 -0.55 103.07 105.85 1gkq h GLY 164 Ca 0.37 -0.40 -0.14 0.00 0.00 0.00 0.00 47.33 47.17 1gkq h GLY 164 CO -0.14 0.37 -0.26 0.83 0.00 0.00 0.00 176.54 177.34 1gkq h GLU 165 N 0.40 0.98 -0.57 4.80 5.08 -1.78 -2.21 114.58 121.29 1gkq h GLU 165 Ca 0.11 -0.44 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 1gkq h GLU 165 Cb 0.34 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 1gkq h GLU 165 CO 0.00 1.12 0.28 1.98 -1.00 0.00 0.00 179.01 181.39 1gkq h MET 166 N 0.84 0.81 -0.19 2.33 4.05 -0.78 -0.36 114.93 121.63 1gkq h MET 166 Ca 0.10 -0.12 0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1gkq h MET 166 Cb 0.84 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.48 1gkq h MET 166 CO 0.07 0.66 0.12 -0.92 0.23 0.00 0.00 176.91 177.07 1gkq h TYR 167 N 0.77 0.22 -0.77 1.39 5.03 -0.96 -1.11 116.97 121.54 1gkq h TYR 167 Ca 0.19 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.46 1gkq h TYR 167 Cb 0.11 -0.07 -0.03 0.00 1.55 0.00 0.00 36.73 38.29 1gkq h TYR 167 CO -0.00 0.13 0.28 1.96 -1.32 0.00 0.00 178.16 179.22 1gkq h GLN 168 N 0.24 1.17 -0.73 1.82 4.20 -1.18 -1.07 115.11 119.56 1gkq h GLN 168 Ca 0.07 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 1gkq h GLN 168 Cb -0.01 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 1gkq h GLN 168 CO -0.03 0.96 0.38 1.15 -0.67 0.00 0.00 178.83 180.63 1gkq h THR 169 N 1.13 1.23 -0.43 -0.54 2.02 -0.78 -1.54 112.91 114.00 1gkq h THR 169 Ca 0.25 -0.59 -0.13 0.00 0.77 0.00 0.00 66.41 66.71 1gkq h THR 169 Cb 0.25 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1gkq h THR 169 CO -0.02 0.26 -0.25 -0.07 0.37 0.00 0.00 175.52 175.81 1gkq h LEU 170 N 1.01 0.92 -0.54 2.58 4.07 -0.82 -0.54 115.31 121.98 1gkq h LEU 170 Ca 0.25 -0.35 -0.05 0.00 0.08 0.00 0.00 57.88 57.81 1gkq h LEU 170 Cb 0.06 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.53 1gkq h LEU 170 CO -0.04 1.11 0.13 0.03 -1.08 0.00 0.00 178.44 178.60 1gkq h ARG 171 N 0.76 0.86 -0.56 1.13 2.47 -0.95 -0.92 114.38 117.18 1gkq h ARG 171 Ca 0.10 -0.21 -0.04 0.00 -1.26 0.00 0.00 59.98 58.57 1gkq h ARG 171 Cb 0.80 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.99 1gkq h ARG 171 CO 0.07 0.82 0.20 1.25 0.56 0.00 0.00 179.97 182.86 1gkq h LEU 172 N 0.76 0.78 -0.75 3.04 5.85 -1.20 -1.70 115.31 122.10 1gkq h LEU 172 Ca 0.17 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.73 1gkq h LEU 172 Cb 0.34 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1gkq h LEU 172 CO 0.00 0.76 0.48 0.00 -0.34 0.00 0.00 178.44 179.34 1gkq h ALA 173 N 1.06 0.97 -0.65 1.25 0.00 -0.75 -0.47 119.26 120.67 1gkq h ALA 173 Ca 0.18 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1gkq h ALA 173 Cb 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1gkq h ALA 173 CO -0.01 0.30 0.25 -0.22 0.00 0.00 0.00 179.25 179.56 1gkq h LYS 174 N 0.95 0.99 -0.58 0.00 3.11 -0.91 0.35 116.57 120.48 1gkq h LYS 174 Ca 0.29 -0.19 -0.04 0.00 -2.81 0.00 0.00 60.65 57.90 1gkq h LYS 174 Cb -0.02 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.03 1gkq h LYS 174 CO -0.10 0.84 0.19 1.49 -2.81 0.00 0.00 179.45 179.06 1gkq h GLU 175 N 0.93 0.90 -0.00 1.90 4.81 -0.69 -2.87 114.58 119.55 1gkq h GLU 175 Ca 0.22 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1gkq h GLU 175 Cb 0.23 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1gkq h GLU 175 CO -0.01 0.80 -0.19 1.28 -0.73 0.00 0.00 179.01 180.16 1gkq n LEU 176 N -4.43 0.50 -0.41 1.64 4.77 -0.24 -4.93 117.00 113.91 1gkq n LEU 176 Ca 0.03 0.03 -0.05 0.00 -0.03 0.00 0.00 56.01 55.99 1gkq n LEU 176 Cb 0.20 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 1gkq n LEU 176 CO 0.40 0.10 -0.05 0.61 -1.33 0.00 0.00 177.39 177.12 1gkq n GLY 177 N 1.36 0.56 3.83 -0.72 0.00 0.51 -4.74 105.19 105.99 1gkq n GLY 177 Ca 0.12 -0.81 -0.37 0.00 0.00 0.00 0.00 46.02 44.96 1gkq n GLY 177 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gkq s VAL 178 N -2.19 4.75 -0.06 1.61 1.01 0.93 -1.10 120.40 125.36 1gkq s VAL 178 Ca 0.00 1.06 -0.14 0.00 0.00 0.00 0.00 61.98 62.90 1gkq s VAL 178 Cb 0.00 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 1gkq s VAL 178 CO 0.00 0.34 0.36 -0.51 0.00 0.00 0.00 175.10 175.29 1gkq s ILE 179 N -1.36 5.16 -0.26 2.22 2.07 -1.03 -4.46 121.20 123.54 1gkq s ILE 179 Ca 0.36 0.72 -0.08 0.00 -1.41 0.00 0.00 60.65 60.24 1gkq s ILE 179 Cb -0.17 -3.67 -0.03 0.00 0.13 0.00 0.00 42.46 38.73 1gkq s ILE 179 CO 0.20 0.53 0.09 -0.69 -1.91 0.00 0.00 174.94 173.15 1gkq s VAL 180 N -0.63 4.41 0.19 4.00 1.01 -0.54 -1.53 120.40 127.30 1gkq s VAL 180 Ca 0.22 -0.17 -0.10 0.00 0.00 0.00 0.00 61.98 61.93 1gkq s VAL 180 Cb -0.15 -3.08 -0.07 0.00 0.00 0.00 0.00 36.38 33.08 1gkq s VAL 180 CO 0.10 0.31 0.51 0.42 0.00 0.00 0.00 175.10 176.44 1gkq s THR 181 N 1.63 4.98 -0.09 3.92 -4.23 -0.50 -0.75 115.64 120.59 1gkq s THR 181 Ca 0.06 0.45 -0.08 0.00 -1.18 0.00 0.00 61.69 60.94 1gkq s THR 181 Cb -0.15 -3.64 0.03 0.00 1.34 0.00 0.00 72.50 70.07 1gkq s THR 181 CO 0.04 0.03 0.25 0.00 -0.54 0.00 0.00 174.62 174.41 1gkq s ALA 182 N -1.69 -0.61 -0.36 3.99 0.00 0.12 -1.66 121.76 121.55 1gkq s ALA 182 Ca 0.43 0.73 -0.19 0.00 0.00 0.00 0.00 51.96 52.93 1gkq s ALA 182 Cb -0.12 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.57 1gkq s ALA 182 CO 0.21 -0.12 0.55 -1.58 0.00 0.00 0.00 175.76 174.82 1gkq s HIS 183 N 0.23 3.17 -0.43 0.00 2.46 -0.71 -1.93 115.29 118.07 1gkq s HIS 183 Ca -0.01 0.20 -0.10 0.00 0.47 0.00 0.00 55.06 55.62 1gkq s HIS 183 Cb -0.02 -3.00 0.08 0.00 -0.13 0.00 0.00 32.58 29.50 1gkq s HIS 183 CO -0.00 -0.58 0.29 0.00 -2.47 0.00 0.00 174.74 171.97 1gkq n GLU 185 N 4.96 0.00 -3.42 0.00 1.02 -0.87 -4.40 120.64 117.94 1gkq n GLU 185 Ca -0.10 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.89 1gkq n GLU 185 Cb 0.43 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.74 1gkq n GLU 185 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1gkq s ASN 186 N 1.28 0.99 0.23 1.62 3.84 -0.81 -3.70 114.94 118.40 1gkq s ASN 186 Ca 0.00 -0.14 -0.06 0.00 0.21 0.00 0.00 52.86 52.87 1gkq s ASN 186 Cb 0.00 0.68 0.39 0.00 -0.55 0.00 0.00 41.25 41.77 1gkq s ASN 186 CO 0.00 -0.33 1.74 0.00 -2.79 0.00 0.00 177.10 175.72 1gkq h ALA 187 N 8.26 0.97 0.26 1.71 0.00 -1.85 -1.65 119.26 126.95 1gkq h ALA 187 Ca -0.17 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1gkq h ALA 187 Cb 1.14 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1gkq h ALA 187 CO 0.29 -0.19 -0.12 1.49 0.00 0.00 0.00 179.25 180.71 1gkq h GLU 188 N 0.44 -0.34 -0.76 0.00 4.57 -1.96 -2.38 114.58 114.16 1gkq h GLU 188 Ca 0.38 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.64 1gkq h GLU 188 Cb 0.53 0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 29.14 1gkq h GLU 188 CO -0.37 -0.02 0.45 -0.07 -1.18 0.00 0.00 179.01 177.83 1gkq h LEU 189 N -0.69 0.69 -0.30 1.64 3.38 -1.95 -0.63 115.31 117.46 1gkq h LEU 189 Ca -0.04 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1gkq h LEU 189 Cb 0.48 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1gkq h LEU 189 CO 0.06 0.45 0.12 0.58 0.09 0.00 0.00 178.44 179.73 1gkq h VAL 190 N 0.83 1.18 -0.36 1.22 2.07 -1.34 -0.14 116.25 119.70 1gkq h VAL 190 Ca 0.33 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 67.34 1gkq h VAL 190 Cb 0.17 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1gkq h VAL 190 CO -0.17 0.19 0.17 1.23 0.02 0.00 0.00 177.57 179.00 1gkq h GLY 191 N 0.33 0.48 0.89 2.17 0.00 -0.93 0.37 103.07 106.39 1gkq h GLY 191 Ca 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 1gkq h GLY 191 CO -0.01 0.07 0.08 3.21 0.00 0.00 0.00 176.54 179.90 1gkq h ARG 192 N 0.34 0.37 -0.17 4.80 2.47 -0.93 -2.04 114.38 119.22 1gkq h ARG 192 Ca 0.16 -0.08 -0.05 0.00 -1.26 0.00 0.00 59.98 58.75 1gkq h ARG 192 Cb 0.09 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.34 1gkq h ARG 192 CO -0.13 0.44 -0.13 -0.07 0.56 0.00 0.00 179.97 180.65 1gkq h LEU 193 N 0.23 0.26 -0.08 3.04 3.38 -0.83 -1.05 115.31 120.27 1gkq h LEU 193 Ca 0.08 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1gkq h LEU 193 Cb 0.22 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1gkq h LEU 193 CO -0.00 0.42 -0.00 1.56 0.09 0.00 0.00 178.44 180.50 1gkq h GLN 194 N 0.26 0.13 -0.77 1.13 4.20 -0.67 -2.28 115.11 117.11 1gkq h GLN 194 Ca 0.05 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.73 1gkq h GLN 194 Cb 0.39 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 1gkq h GLN 194 CO 0.02 0.41 0.50 1.96 -0.67 0.00 0.00 178.83 181.05 1gkq h GLN 195 N -0.15 1.02 -0.18 1.46 1.08 -1.09 -1.32 115.11 115.92 1gkq h GLN 195 Ca 0.02 -0.07 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1gkq h GLN 195 Cb 0.35 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 1gkq h GLN 195 CO 0.00 0.69 0.10 -0.22 -0.95 0.00 0.00 178.83 178.45 1gkq h LYS 196 N 1.05 0.21 -0.42 1.46 3.64 -1.14 -0.65 116.57 120.72 1gkq h LYS 196 Ca 0.28 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.62 1gkq h LYS 196 Cb -0.11 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1gkq h LYS 196 CO -0.06 0.14 0.17 -0.07 -2.27 0.00 0.00 179.45 177.36 1gkq h LEU 197 N 0.22 0.58 -0.32 5.20 3.38 -1.14 -2.57 115.31 120.65 1gkq h LEU 197 Ca 0.07 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1gkq h LEU 197 Cb -0.00 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1gkq h LEU 197 CO -0.04 0.59 0.19 -0.07 0.09 0.00 0.00 178.44 179.20 1gkq h LEU 198 N 0.54 0.39 -1.49 1.67 3.38 -1.06 -1.33 115.31 117.41 1gkq h LEU 198 Ca 0.14 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1gkq h LEU 198 Cb 0.19 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1gkq h LEU 198 CO -0.01 0.34 0.00 0.77 0.09 0.00 0.00 178.44 179.63 1gkq h SER 199 N 0.41 0.00 -0.33 -0.43 4.64 -1.00 0.13 113.55 116.97 1gkq h SER 199 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1gkq h SER 199 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1gkq h SER 199 CO -0.02 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.32 1gkq n GLU 200 N -2.41 2.22 -0.81 4.77 1.02 -0.60 -4.92 120.64 119.91 1gkq n GLU 200 Ca -0.01 -1.85 0.00 0.00 -0.02 0.00 0.00 57.16 55.28 1gkq n GLU 200 Cb 0.10 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1gkq n GLU 200 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gkq n GLY 201 N 1.37 0.95 3.52 0.62 0.00 0.46 -4.97 105.19 107.13 1gkq n GLY 201 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1gkq n GLY 201 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gkq s LYS 202 N -0.17 3.39 -0.00 1.61 1.02 -0.63 -4.76 119.74 120.19 1gkq s LYS 202 Ca 0.00 -0.94 0.09 0.00 0.02 0.00 0.00 55.97 55.14 1gkq s LYS 202 Cb 0.00 -4.73 -0.11 0.00 -0.52 0.00 0.00 37.83 32.47 1gkq s LYS 202 CO 0.00 -2.04 0.30 0.25 -0.92 0.00 0.00 175.35 172.94 1gkq n THR 203 N 6.30 0.00 -0.92 2.17 -2.24 -1.26 -3.86 114.28 114.47 1gkq n THR 203 Ca 0.16 -0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.38 1gkq n THR 203 Cb 0.49 0.75 0.18 0.00 -2.10 0.00 0.00 70.33 69.65 1gkq n THR 203 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gkq s GLY 204 N -2.24 1.60 0.59 3.38 0.00 -1.26 -1.46 107.32 107.93 1gkq s GLY 204 Ca 0.01 -0.02 0.33 0.00 0.00 0.00 0.00 44.72 45.04 1gkq s GLY 204 CO 0.35 0.54 2.23 -2.55 0.00 0.00 0.00 173.10 173.68 1gkq h PRO 205 N -1.98 0.00 0.00 2.90 0.11 -1.92 -2.65 132.00 128.46 1gkq h PRO 205 Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1gkq h PRO 205 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1gkq h PRO 205 CO 0.52 0.03 0.00 -0.85 -0.21 0.00 0.00 178.00 177.49 1gkq n GLU 206 N -3.55 0.20 0.00 1.05 0.00 -1.19 -2.28 120.64 114.87 1gkq n GLU 206 Ca -0.02 0.15 0.12 0.00 0.00 0.00 0.00 57.16 57.40 1gkq n GLU 206 Cb 0.13 -1.50 0.09 0.00 0.00 0.00 0.00 31.44 30.16 1gkq n GLU 206 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 1gkq n TRP 207 N -1.28 0.00 0.13 -1.84 7.02 -1.00 -4.44 117.44 116.03 1gkq n TRP 207 Ca 0.07 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.41 1gkq n TRP 207 Cb 0.11 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 28.92 1gkq n TRP 207 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1gkq h HIS 208 N 4.40 -0.26 0.00 -5.99 2.76 -1.65 -2.26 115.15 112.15 1gkq h HIS 208 Ca 0.00 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1gkq h HIS 208 Cb 0.95 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.98 1gkq h HIS 208 CO 0.00 -0.06 -0.07 1.49 -1.30 0.00 0.00 177.93 177.99 1gkq h GLU 209 N -0.41 -0.12 -0.00 5.26 4.22 -1.80 -2.15 114.58 119.58 1gkq h GLU 209 Ca -0.03 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.42 1gkq h GLU 209 Cb 0.31 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1gkq h GLU 209 CO 0.05 -0.08 0.01 -1.35 -2.18 0.00 0.00 179.01 175.45 1gkq h PRO 210 N -0.12 0.00 0.00 0.92 0.11 -1.80 -1.08 132.00 130.03 1gkq h PRO 210 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1gkq h PRO 210 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 1gkq h PRO 210 CO -0.07 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.59 1gkq n SER 211 N -3.62 0.73 -2.98 -2.05 3.41 -0.81 -4.00 113.62 104.31 1gkq n SER 211 Ca -0.03 0.62 -0.16 0.00 -0.26 0.00 0.00 58.87 59.04 1gkq n SER 211 Cb 0.08 -0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 63.23 1gkq n SER 211 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1gkq n ARG 212 N -2.24 0.78 -0.64 4.33 1.85 -0.43 -4.53 116.66 115.78 1gkq n ARG 212 Ca 0.04 -2.53 -0.29 0.00 -1.00 0.00 0.00 57.85 54.07 1gkq n ARG 212 Cb 0.33 -1.34 0.23 0.00 -1.05 0.00 0.00 32.46 30.63 1gkq n ARG 212 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1gkq s PRO 213 N -0.39 -0.45 0.38 2.89 0.04 -1.07 -4.80 135.00 131.59 1gkq s PRO 213 Ca 0.33 0.94 0.14 0.00 0.04 0.00 0.00 61.00 62.44 1gkq s PRO 213 Cb 0.21 -1.60 0.97 0.00 0.04 0.00 0.00 34.50 34.12 1gkq s PRO 213 CO -0.16 -3.44 1.83 0.93 0.04 0.00 0.00 177.00 176.20 1gkq h GLU 214 N -2.42 0.52 -0.42 4.56 5.08 -1.97 -0.62 114.58 119.30 1gkq h GLU 214 Ca -0.58 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 57.82 1gkq h GLU 214 Cb 1.32 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 1gkq h GLU 214 CO 0.50 0.34 0.29 0.00 -1.00 0.00 0.00 179.01 179.13 1gkq h ALA 215 N 1.61 2.03 -0.11 3.43 0.00 -1.99 -1.06 119.26 123.17 1gkq h ALA 215 Ca 0.50 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.30 1gkq h ALA 215 Cb 1.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1gkq h ALA 215 CO -0.24 -0.12 -0.32 0.28 0.00 0.00 0.00 179.25 178.86 1gkq h VAL 216 N 0.28 1.38 -0.53 0.00 2.07 -1.43 -1.79 116.25 116.24 1gkq h VAL 216 Ca 0.19 -1.63 -0.05 0.00 0.82 0.00 0.00 66.70 66.03 1gkq h VAL 216 Cb 0.39 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.26 1gkq h VAL 216 CO -0.04 0.48 0.12 -0.08 0.02 0.00 0.00 177.57 178.07 1gkq h GLU 217 N -0.01 0.81 -0.63 1.57 4.81 -1.44 -1.50 114.58 118.19 1gkq h GLU 217 Ca -0.01 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 58.99 1gkq h GLU 217 Cb 0.93 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 1gkq h GLU 217 CO 0.07 0.73 0.15 0.00 -0.73 0.00 0.00 179.01 179.23 1gkq h ALA 218 N 1.35 0.83 -0.07 2.92 0.00 -1.16 -0.38 119.26 122.76 1gkq h ALA 218 Ca 0.17 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1gkq h ALA 218 Cb 0.30 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1gkq h ALA 218 CO -0.00 0.55 0.02 1.49 0.00 0.00 0.00 179.25 181.31 1gkq h GLU 219 N 0.93 0.10 -0.60 0.00 4.22 -0.85 -1.21 114.58 117.18 1gkq h GLU 219 Ca 0.20 -0.02 -0.05 0.00 0.08 0.00 0.00 59.36 59.57 1gkq h GLU 219 Cb 0.37 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1gkq h GLU 219 CO 0.00 0.26 0.18 0.78 -2.18 0.00 0.00 179.01 178.05 1gkq h GLY 220 N -0.07 0.97 0.96 1.92 0.00 -1.18 0.10 103.07 105.77 1gkq h GLY 220 Ca 0.02 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 1gkq h GLY 220 CO -0.00 0.51 0.06 -0.84 0.00 0.00 0.00 176.54 176.27 1gkq h THR 221 N 0.87 1.25 -0.37 4.70 2.02 -0.89 -1.09 112.91 119.41 1gkq h THR 221 Ca 0.20 -0.91 -0.14 0.00 0.77 0.00 0.00 66.41 66.33 1gkq h THR 221 Cb 0.26 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1gkq h THR 221 CO -0.01 0.32 -0.33 0.00 0.37 0.00 0.00 175.52 175.87 1gkq h ALA 222 N 0.94 0.72 -0.04 6.16 0.00 -0.97 -1.96 119.26 124.12 1gkq h ALA 222 Ca 0.13 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1gkq h ALA 222 Cb 0.39 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1gkq h ALA 222 CO 0.01 0.66 0.02 -0.09 0.00 0.00 0.00 179.25 179.85 1gkq h ARG 223 N 0.69 0.06 -0.52 0.00 2.43 -0.81 -1.26 114.38 114.97 1gkq h ARG 223 Ca 0.07 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.31 1gkq h ARG 223 Cb 0.89 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.36 1gkq h ARG 223 CO 0.08 0.12 0.18 0.35 -1.51 0.00 0.00 179.97 179.19 1gkq h PHE 224 N -0.02 0.32 -0.88 2.20 3.57 -1.12 -1.30 116.94 119.71 1gkq h PHE 224 Ca 0.01 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1gkq h PHE 224 Cb 0.07 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.70 1gkq h PHE 224 CO -0.05 0.10 0.58 0.00 -2.23 0.00 0.00 178.31 176.71 1gkq h ALA 225 N 1.35 1.40 -0.54 2.41 0.00 -1.05 -1.43 119.26 121.40 1gkq h ALA 225 Ca 0.25 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 1gkq h ALA 225 Cb 0.28 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1gkq h ALA 225 CO -0.26 0.53 0.01 1.15 0.00 0.00 0.00 179.25 180.68 1gkq h THR 226 N 1.15 1.25 -0.03 0.00 2.02 -0.14 -0.89 112.91 116.28 1gkq h THR 226 Ca 0.34 -1.06 -0.13 0.00 0.77 0.00 0.00 66.41 66.32 1gkq h THR 226 Cb -0.07 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 1gkq h THR 226 CO -0.09 0.38 -0.59 -0.26 0.37 0.00 0.00 175.52 175.34 1gkq h PHE 227 N 0.84 0.13 -0.04 3.16 -1.00 -0.74 -1.24 116.94 118.05 1gkq h PHE 227 Ca 0.16 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 1gkq h PHE 227 Cb 0.49 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 40.02 1gkq h PHE 227 CO 0.03 0.66 -0.02 -0.07 -1.61 0.00 0.00 178.31 177.30 1gkq h LEU 228 N 0.07 0.09 -1.42 1.54 3.38 -0.96 -1.14 115.31 116.88 1gkq h LEU 228 Ca -0.01 -0.43 0.03 0.00 0.09 0.00 0.00 57.88 57.57 1gkq h LEU 228 Cb 1.06 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 1gkq h LEU 228 CO 0.08 0.49 0.42 -0.08 0.09 0.00 0.00 178.44 179.45 1gkq h GLU 229 N -0.32 0.73 0.00 1.13 4.81 -1.07 0.13 114.58 119.99 1gkq h GLU 229 Ca 0.01 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 59.03 1gkq h GLU 229 Cb 0.46 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1gkq h GLU 229 CO 0.01 0.49 -0.80 1.15 -0.73 0.00 0.00 179.01 179.12 1gkq h THR 230 N 0.76 1.37 0.00 0.32 2.02 -1.14 -3.35 112.91 112.88 1gkq h THR 230 Ca 0.26 -2.93 0.00 0.00 0.77 0.00 0.00 66.41 64.51 1gkq h THR 230 Cb 0.08 2.67 0.00 0.00 -1.74 0.00 0.00 68.15 69.17 1gkq h THR 230 CO -0.07 0.78 -1.79 0.35 0.37 0.00 0.00 175.52 175.16 1gkq n THR 231 N -3.30 0.13 -0.65 3.16 -2.24 -0.44 -4.98 114.28 105.96 1gkq n THR 231 Ca 0.01 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1gkq n THR 231 Cb 0.86 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 1gkq n THR 231 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gkq n GLY 232 N 1.24 0.70 3.87 3.38 0.00 0.41 -4.89 105.19 109.91 1gkq n GLY 232 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1gkq n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gkq s ALA 233 N -2.25 3.30 -0.09 4.61 0.00 -1.18 -4.95 121.76 121.20 1gkq s ALA 233 Ca 0.00 -0.16 -0.15 0.00 0.00 0.00 0.00 51.96 51.65 1gkq s ALA 233 Cb 0.00 -2.77 -0.05 0.00 0.00 0.00 0.00 23.12 20.30 1gkq s ALA 233 CO 0.00 -0.08 0.39 0.99 0.00 0.00 0.00 175.76 177.06 1gkq s THR 234 N -2.45 5.17 0.36 0.00 2.01 -1.26 -4.71 115.64 114.75 1gkq s THR 234 Ca 0.52 0.78 0.05 0.00 0.31 0.00 0.00 61.69 63.35 1gkq s THR 234 Cb -0.10 -3.72 -0.06 0.00 0.01 0.00 0.00 72.50 68.62 1gkq s THR 234 CO 0.33 0.44 0.05 -0.83 -0.69 0.00 0.00 174.62 173.91 1gkq s GLY 235 N -0.04 2.26 -0.17 4.40 0.00 -0.53 -1.47 107.32 111.77 1gkq s GLY 235 Ca 0.22 -2.02 -0.06 0.00 0.00 0.00 0.00 44.72 42.86 1gkq s GLY 235 CO 0.09 -1.91 0.36 -0.47 0.00 0.00 0.00 173.10 171.18 1gkq s TYR 236 N -3.12 -0.66 -0.29 1.90 6.14 0.07 -1.18 117.35 120.20 1gkq s TYR 236 Ca 0.34 1.33 -0.21 0.00 0.64 0.00 0.00 57.07 59.18 1gkq s TYR 236 Cb 0.08 0.18 -0.01 0.00 0.42 0.00 0.00 41.96 42.64 1gkq s TYR 236 CO 0.16 -0.44 0.65 0.08 0.64 0.00 0.00 175.55 176.64 1gkq s VAL 237 N 2.54 4.93 0.43 3.14 1.01 0.68 -0.70 120.40 132.43 1gkq s VAL 237 Ca -0.01 0.98 -0.16 0.00 0.00 0.00 0.00 61.98 62.80 1gkq s VAL 237 Cb -0.12 -4.00 -0.08 0.00 0.00 0.00 0.00 36.38 32.17 1gkq s VAL 237 CO -0.11 -0.11 0.88 0.68 0.00 0.00 0.00 175.10 176.44 1gkq s VAL 238 N 2.63 4.58 -0.40 2.92 -7.23 -0.81 -1.11 120.40 120.98 1gkq s VAL 238 Ca 0.26 1.09 -0.05 0.00 -1.81 0.00 0.00 61.98 61.48 1gkq s VAL 238 Cb -0.15 -3.67 0.01 0.00 0.56 0.00 0.00 36.38 33.12 1gkq s VAL 238 CO 0.11 -0.47 0.26 0.00 -0.31 0.00 0.00 175.10 174.69 1gkq n HIS 239 N -1.07 -0.76 -2.56 2.82 1.44 -1.11 -4.70 115.22 109.28 1gkq n HIS 239 Ca 0.05 0.24 -0.42 0.00 -2.01 0.00 0.00 57.72 55.57 1gkq n HIS 239 Cb 0.54 -1.15 -0.03 0.00 0.12 0.00 0.00 29.99 29.47 1gkq n HIS 239 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1gkq s LEU 240 N -4.21 4.28 -0.00 2.39 0.20 0.46 -4.70 118.68 117.10 1gkq s LEU 240 Ca 0.07 1.72 0.09 0.00 0.69 0.00 0.00 54.13 56.70 1gkq s LEU 240 Cb -0.04 -3.56 -0.10 0.00 -0.43 0.00 0.00 46.19 42.06 1gkq s LEU 240 CO 0.39 -0.50 0.34 -1.54 -0.29 0.00 0.00 176.35 174.75 1gkq n SER 241 N 4.93 0.91 -4.03 3.68 3.41 -1.26 -4.62 113.62 116.64 1gkq n SER 241 Ca 0.10 -0.57 -0.09 0.00 -0.26 0.00 0.00 58.87 58.05 1gkq n SER 241 Cb 0.47 1.08 -0.09 0.00 -0.26 0.00 0.00 64.21 65.42 1gkq n SER 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gkq h LYS 243 N 2.79 -0.02 -0.94 0.00 3.64 -1.97 -1.05 116.57 119.03 1gkq h LYS 243 Ca -0.34 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.19 1gkq h LYS 243 Cb 1.20 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.93 1gkq h LYS 243 CO 0.56 -0.01 0.55 -1.35 -2.27 0.00 0.00 179.45 176.93 1gkq h PRO 244 N -0.02 0.79 -0.22 1.90 0.11 -1.98 0.32 132.00 132.90 1gkq h PRO 244 Ca 0.15 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.11 1gkq h PRO 244 Cb 0.26 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.19 1gkq h PRO 244 CO -0.34 0.52 -0.27 0.00 -0.21 0.00 0.00 178.00 177.71 1gkq h ALA 245 N 1.56 0.33 -0.76 -0.75 0.00 -1.74 -2.51 119.26 115.40 1gkq h ALA 245 Ca 0.49 -0.39 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1gkq h ALA 245 Cb 0.62 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1gkq h ALA 245 CO -0.32 0.32 0.47 1.25 0.00 0.00 0.00 179.25 180.97 1gkq h LEU 246 N 0.26 0.75 -0.65 0.00 5.85 -0.08 -0.65 115.31 120.80 1gkq h LEU 246 Ca 0.03 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1gkq h LEU 246 Cb 0.83 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 1gkq h LEU 246 CO 0.06 0.51 0.41 0.44 -0.34 0.00 0.00 178.44 179.52 1gkq h ASP 247 N 0.89 0.70 -0.45 1.25 3.32 -0.33 0.23 116.42 122.04 1gkq h ASP 247 Ca 0.32 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.33 1gkq h ASP 247 Cb 0.08 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1gkq h ASP 247 CO -0.14 0.49 0.17 0.00 -1.72 0.00 0.00 179.24 178.04 1gkq h ALA 248 N 1.26 0.58 -0.32 3.45 0.00 -0.89 -1.10 119.26 122.24 1gkq h ALA 248 Ca 0.25 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1gkq h ALA 248 Cb -0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1gkq h ALA 248 CO -0.08 0.20 -0.35 0.00 0.00 0.00 0.00 179.25 179.01 1gkq h ALA 249 N 1.02 0.77 -0.63 0.00 0.00 -0.79 -2.74 119.26 116.90 1gkq h ALA 249 Ca 0.15 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1gkq h ALA 249 Cb 0.21 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1gkq h ALA 249 CO -0.01 0.65 0.07 0.52 0.00 0.00 0.00 179.25 180.48 1gkq h MET 250 N 0.61 1.06 -0.94 0.00 2.07 -0.40 -1.18 114.93 116.15 1gkq h MET 250 Ca 0.06 -0.30 0.00 0.00 -2.07 0.00 0.00 59.70 57.39 1gkq h MET 250 Cb 0.89 -0.11 -0.05 0.00 -1.87 0.00 0.00 31.60 30.46 1gkq h MET 250 CO 0.08 1.00 0.61 0.00 1.07 0.00 0.00 176.91 179.67 1gkq h ALA 251 N 1.02 1.29 -0.39 6.32 0.00 -1.11 0.10 119.26 126.50 1gkq h ALA 251 Ca 0.19 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1gkq h ALA 251 Cb 0.48 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1gkq h ALA 251 CO 0.02 0.64 -0.10 0.00 0.00 0.00 0.00 179.25 179.80 1gkq h ALA 252 N 1.38 0.53 -0.30 0.00 0.00 -1.17 -2.21 119.26 117.49 1gkq h ALA 252 Ca 0.34 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1gkq h ALA 252 Cb -0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1gkq h ALA 252 CO -0.07 0.41 0.20 0.87 0.00 0.00 0.00 179.25 180.65 1gkq h LYS 253 N 0.56 0.39 -0.65 0.00 1.57 -0.53 -1.42 116.57 116.49 1gkq h LYS 253 Ca 0.10 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1gkq h LYS 253 Cb 0.63 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.81 1gkq h LYS 253 CO 0.04 0.27 0.43 0.00 -0.57 0.00 0.00 179.45 179.61 1gkq h ALA 254 N 1.11 1.69 -0.36 3.86 0.00 -0.70 -1.88 119.26 122.98 1gkq h ALA 254 Ca 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1gkq h ALA 254 Cb -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1gkq h ALA 254 CO -0.02 0.23 0.00 2.89 0.00 0.00 0.00 179.25 182.34 1gkq n ARG 255 N -4.47 2.02 -0.10 0.00 1.85 -0.84 -4.92 116.66 110.21 1gkq n ARG 255 Ca 0.08 -1.36 0.00 0.00 -1.00 0.00 0.00 57.85 55.57 1gkq n ARG 255 Cb 0.17 -1.38 0.00 0.00 -1.05 0.00 0.00 32.46 30.20 1gkq n ARG 255 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1gkq n GLY 256 N 0.96 0.53 3.72 2.89 0.00 -0.71 -5.06 105.19 107.52 1gkq n GLY 256 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1gkq n GLY 256 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gkq s VAL 257 N -2.21 3.20 -1.18 1.61 1.01 -0.56 -4.90 120.40 117.38 1gkq s VAL 257 Ca 0.00 0.86 -0.20 0.00 0.00 0.00 0.00 61.98 62.64 1gkq s VAL 257 Cb 0.00 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.87 1gkq s VAL 257 CO 0.00 0.07 1.68 -2.16 0.00 0.00 0.00 175.10 174.69 1gkq s PRO 258 N 1.08 3.62 0.03 2.72 0.04 -1.26 -4.41 135.00 136.82 1gkq s PRO 258 Ca 0.65 -1.53 0.05 0.00 0.04 0.00 0.00 61.00 60.21 1gkq s PRO 258 Cb -0.38 -5.42 -0.02 0.00 0.04 0.00 0.00 34.50 28.72 1gkq s PRO 258 CO 0.31 -2.49 -0.15 -1.50 0.04 0.00 0.00 177.00 173.20 1gkq s ILE 259 N 5.54 1.19 0.19 0.56 2.07 -1.26 -1.45 121.20 128.04 1gkq s ILE 259 Ca 0.54 -0.99 0.09 0.00 -1.41 0.00 0.00 60.65 58.89 1gkq s ILE 259 Cb 0.02 -1.06 -0.04 0.00 0.13 0.00 0.00 42.46 41.50 1gkq s ILE 259 CO 0.02 0.07 -0.19 -0.31 -1.91 0.00 0.00 174.94 172.63 1gkq s TYR 260 N -0.79 1.92 -0.05 3.50 2.02 -0.33 -4.87 117.35 118.75 1gkq s TYR 260 Ca 0.03 -0.45 0.06 0.00 -0.37 0.00 0.00 57.07 56.33 1gkq s TYR 260 Cb -0.08 -0.93 -0.02 0.00 -0.40 0.00 0.00 41.96 40.54 1gkq s TYR 260 CO 0.01 0.40 -0.23 0.42 -1.57 0.00 0.00 175.55 174.58 1gkq s ILE 261 N -2.20 2.23 0.01 2.71 1.01 -1.26 -0.23 121.20 123.47 1gkq s ILE 261 Ca 0.19 -1.01 0.06 0.00 0.00 0.00 0.00 60.65 59.89 1gkq s ILE 261 Cb -0.05 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 1gkq s ILE 261 CO 0.08 0.57 -0.19 -0.70 0.00 0.00 0.00 174.94 174.70 1gkq s GLU 262 N -0.33 1.43 0.05 2.79 2.12 -0.26 -0.80 118.70 123.69 1gkq s GLU 262 Ca 0.02 -0.78 0.04 0.00 0.36 0.00 0.00 54.97 54.60 1gkq s GLU 262 Cb -0.12 -1.44 -0.03 0.00 0.26 0.00 0.00 34.13 32.80 1gkq s GLU 262 CO 0.02 0.38 -0.12 -1.12 -0.54 0.00 0.00 175.26 173.89 1gkq s SER 263 N -0.78 1.38 0.00 -1.70 0.01 -0.87 -0.40 113.70 111.34 1gkq s SER 263 Ca 0.07 -0.54 0.03 0.00 1.31 0.00 0.00 55.95 56.81 1gkq s SER 263 Cb -0.08 -0.04 -0.03 0.00 0.21 0.00 0.00 66.02 66.08 1gkq s SER 263 CO 0.00 -0.09 -0.05 0.68 0.41 0.00 0.00 173.24 174.20 1gkq s VAL 264 N -1.17 3.81 0.33 3.43 -7.23 -1.26 -1.46 120.40 116.86 1gkq s VAL 264 Ca -0.04 -0.72 0.11 0.00 -1.81 0.00 0.00 61.98 59.52 1gkq s VAL 264 Cb -0.09 -2.67 0.36 0.00 0.56 0.00 0.00 36.38 34.54 1gkq s VAL 264 CO 0.01 0.39 1.60 -0.29 -0.31 0.00 0.00 175.10 176.50 1gkq h ILE 265 N 3.68 0.09 -0.04 -0.62 6.09 -1.53 -1.01 117.51 124.18 1gkq h ILE 265 Ca -0.49 -0.03 0.01 0.00 -1.37 0.00 0.00 64.86 62.99 1gkq h ILE 265 Cb 1.17 0.01 -0.00 0.00 0.47 0.00 0.00 36.82 38.47 1gkq h ILE 265 CO 0.55 0.01 0.03 1.55 -3.07 0.00 0.00 178.15 177.22 1gkq h PRO 266 N 0.08 0.00 0.00 2.19 0.13 -1.87 -1.27 132.00 131.26 1gkq h PRO 266 Ca 0.71 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.84 1gkq h PRO 266 Cb 1.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.79 1gkq h PRO 266 CO -0.78 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 177.71 1gkq n HIS 267 N -4.34 0.00 -0.01 1.56 8.25 -0.38 -0.84 115.22 119.45 1gkq n HIS 267 Ca -0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.41 1gkq n HIS 267 Cb 0.13 -0.48 -0.12 0.00 1.12 0.00 0.00 29.99 30.64 1gkq n HIS 267 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1gkq n PHE 268 N -1.48 0.77 -0.00 4.41 3.01 -0.49 -4.61 117.46 119.06 1gkq n PHE 268 Ca 0.06 0.26 0.01 0.00 1.01 0.00 0.00 57.45 58.80 1gkq n PHE 268 Cb 0.27 -1.07 -0.02 0.00 -0.01 0.00 0.00 39.48 38.65 1gkq n PHE 268 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1gkq n LEU 269 N -2.87 0.00 -4.72 4.37 4.77 -1.15 -4.86 117.00 112.54 1gkq n LEU 269 Ca -0.15 -0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.60 1gkq n LEU 269 Cb 0.93 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.96 1gkq n LEU 269 CO 0.44 0.00 -0.23 -0.76 -1.33 0.00 0.00 177.39 175.50 1gkq s LEU 270 N -3.16 3.33 0.21 2.23 1.43 -0.02 -5.11 118.68 117.58 1gkq s LEU 270 Ca -0.01 -0.65 -0.03 0.00 -1.03 0.00 0.00 54.13 52.42 1gkq s LEU 270 Cb 0.02 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 1gkq s LEU 270 CO 0.10 -0.16 0.19 1.51 0.23 0.00 0.00 176.35 178.21 1gkq s ASP 271 N -3.79 0.15 0.51 2.29 1.47 -1.26 -4.64 116.67 111.40 1gkq s ASP 271 Ca 0.35 -1.33 0.32 0.00 1.18 0.00 0.00 52.55 53.07 1gkq s ASP 271 Cb -0.05 0.42 1.44 0.00 -0.34 0.00 0.00 42.92 44.39 1gkq s ASP 271 CO 0.22 -0.89 1.82 0.07 0.68 0.00 0.00 175.17 177.07 1gkq h LYS 272 N 2.55 0.08 -0.01 2.11 2.10 -0.80 -1.95 116.57 120.65 1gkq h LYS 272 Ca -0.34 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1gkq h LYS 272 Cb 1.25 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1gkq h LYS 272 CO 0.50 0.05 0.01 1.79 -2.00 0.00 0.00 179.45 179.80 1gkq h THR 273 N 0.08 0.97 -0.44 0.07 1.35 -1.92 -1.02 112.91 112.01 1gkq h THR 273 Ca 0.53 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 66.41 1gkq h THR 273 Cb 1.95 1.00 -0.02 0.00 -1.73 0.00 0.00 68.15 69.34 1gkq h THR 273 CO -0.06 0.00 0.29 1.88 -0.25 0.00 0.00 175.52 177.38 1gkq h TYR 274 N 0.00 0.51 -0.13 4.73 -1.99 -1.76 0.21 116.97 118.54 1gkq h TYR 274 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1gkq h TYR 274 Cb 0.02 -0.17 0.00 0.00 2.00 0.00 0.00 36.73 38.57 1gkq h TYR 274 CO 0.00 0.31 0.00 0.00 -0.00 0.00 0.00 178.16 178.47 1gkq n ALA 275 N -2.48 2.54 -0.49 3.88 0.00 -0.39 -3.38 120.51 120.18 1gkq n ALA 275 Ca 0.04 -0.38 0.06 0.00 0.00 0.00 0.00 53.44 53.16 1gkq n ALA 275 Cb 0.10 -1.13 0.16 0.00 0.00 0.00 0.00 19.45 18.57 1gkq n ALA 275 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1gkq n GLU 276 N -0.03 2.75 0.06 0.00 1.02 0.06 -3.17 120.64 121.32 1gkq n GLU 276 Ca 0.14 -2.26 0.13 0.00 -0.02 0.00 0.00 57.16 55.15 1gkq n GLU 276 Cb 0.23 -1.43 0.50 0.00 -0.02 0.00 0.00 31.44 30.72 1gkq n GLU 276 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1gkq n ARG 277 N -0.16 0.15 -0.25 3.49 1.74 -1.18 -4.99 116.66 115.45 1gkq n ARG 277 Ca 0.13 0.12 0.01 0.00 -0.77 0.00 0.00 57.85 57.34 1gkq n ARG 277 Cb 0.56 -1.67 -0.01 0.00 -1.02 0.00 0.00 32.46 30.33 1gkq n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gkq n GLY 278 N 1.38 -2.92 7.00 -0.13 0.00 -1.26 -4.76 105.19 104.51 1gkq n GLY 278 Ca 0.06 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1gkq n GLY 278 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gkq n GLY 279 N -1.93 -0.36 0.24 -0.02 0.00 -1.26 -3.03 105.19 98.83 1gkq n GLY 279 Ca -0.01 -1.07 0.10 0.00 0.00 0.00 0.00 46.02 45.04 1gkq n GLY 279 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1gkq h VAL 280 N 0.00 0.75 -0.67 1.61 3.04 -1.98 -2.54 116.25 116.47 1gkq h VAL 280 Ca 0.00 -0.71 -0.00 0.00 -1.01 0.00 0.00 66.70 64.98 1gkq h VAL 280 Cb 0.00 1.43 -0.03 0.00 -2.01 0.00 0.00 31.29 30.68 1gkq h VAL 280 CO 0.00 0.17 0.40 -0.08 -1.01 0.00 0.00 177.57 177.05 1gkq h GLU 281 N 0.00 0.91 -0.12 4.17 4.57 -1.93 -2.48 114.58 119.70 1gkq h GLU 281 Ca -0.00 -0.09 -0.18 0.00 -1.18 0.00 0.00 59.36 57.91 1gkq h GLU 281 Cb 0.42 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.81 1gkq h GLU 281 CO 0.02 0.65 -0.68 0.00 -1.18 0.00 0.00 179.01 177.83 1gkq h ALA 282 N 1.21 0.60 0.00 2.92 0.00 -1.38 -3.10 119.26 119.51 1gkq h ALA 282 Ca 0.24 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1gkq h ALA 282 Cb -0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1gkq h ALA 282 CO -0.04 0.73 -0.03 0.52 0.00 0.00 0.00 179.25 180.43 1gkq h MET 283 N 0.35 0.00 0.00 0.00 2.86 -1.10 -1.24 114.93 115.80 1gkq h MET 283 Ca -0.02 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1gkq h MET 283 Cb 1.25 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.90 1gkq h MET 283 CO 0.12 0.03 -0.10 0.87 1.06 0.00 0.00 176.91 178.89 1gkq h LYS 284 N 0.00 0.00 -0.40 1.72 1.57 -1.37 -2.92 116.57 115.16 1gkq h LYS 284 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1gkq h LYS 284 Cb 0.10 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1gkq h LYS 284 CO 0.00 0.10 0.02 0.66 -0.57 0.00 0.00 179.45 179.67 1gkq n TYR 285 N -3.40 1.43 -3.14 -1.35 4.01 -0.47 -4.75 117.16 109.49 1gkq n TYR 285 Ca -0.01 -0.91 -0.41 0.00 -0.16 0.00 0.00 57.90 56.41 1gkq n TYR 285 Cb 0.27 -0.42 -0.07 0.00 -0.31 0.00 0.00 39.34 38.81 1gkq n TYR 285 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1gkq s ILE 286 N -2.86 4.99 0.30 -0.72 -1.09 -1.11 -4.66 121.20 116.06 1gkq s ILE 286 Ca 0.47 0.99 -0.08 0.00 -2.23 0.00 0.00 60.65 59.80 1gkq s ILE 286 Cb 0.38 -3.92 0.00 0.00 -1.58 0.00 0.00 42.46 37.34 1gkq s ILE 286 CO 0.11 -0.00 0.50 0.00 -1.23 0.00 0.00 174.94 174.32 1gkq s MET 287 N 2.48 1.77 -0.05 2.79 0.23 -1.26 -0.72 119.30 124.55 1gkq s MET 287 Ca 0.25 -1.50 -0.00 0.00 -1.03 0.00 0.00 55.69 53.41 1gkq s MET 287 Cb -0.15 0.47 0.03 0.00 -1.53 0.00 0.00 34.83 33.64 1gkq s MET 287 CO 0.09 -0.75 -0.01 -1.12 -2.03 0.00 0.00 175.02 171.21 1gkq s SER 288 N -3.12 0.96 0.63 -1.18 0.01 -1.26 -2.52 113.70 107.21 1gkq s SER 288 Ca 0.25 -0.07 -0.18 0.00 1.31 0.00 0.00 55.95 57.27 1gkq s SER 288 Cb -0.01 -0.35 -0.02 0.00 0.21 0.00 0.00 66.02 65.85 1gkq s SER 288 CO 0.14 -0.12 1.24 -2.84 0.41 0.00 0.00 173.24 172.07 1gkq s PRO 289 N 1.31 2.70 0.94 12.44 0.02 -1.26 -5.04 135.00 146.12 1gkq s PRO 289 Ca -0.05 1.90 -0.10 0.00 0.02 0.00 0.00 61.00 62.76 1gkq s PRO 289 Cb -0.13 -1.88 0.16 0.00 0.02 0.00 0.00 34.50 32.66 1gkq s PRO 289 CO -0.02 -1.44 1.09 -2.30 -0.33 0.00 0.00 177.00 174.00 1gkq n PRO 290 N -1.88 -0.63 -2.16 5.54 -0.02 -1.05 -4.95 135.00 129.85 1gkq n PRO 290 Ca 0.14 -0.12 -0.39 0.00 -2.02 0.00 0.00 63.50 61.11 1gkq n PRO 290 Cb 0.49 -2.33 -0.01 0.00 -0.02 0.00 0.00 33.50 31.63 1gkq n PRO 290 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1gkq s LEU 291 N -6.36 4.20 0.00 2.45 1.43 -1.26 -5.01 118.68 114.13 1gkq s LEU 291 Ca 0.67 2.51 0.05 0.00 -1.03 0.00 0.00 54.13 56.33 1gkq s LEU 291 Cb -0.23 -3.96 0.05 0.00 0.03 0.00 0.00 46.19 42.08 1gkq s LEU 291 CO 0.59 -0.78 0.43 0.54 0.23 0.00 0.00 176.35 177.36 1gkq n ARG 292 N 0.09 0.72 -1.85 1.70 5.12 -1.26 -3.82 116.66 117.36 1gkq n ARG 292 Ca 0.04 -3.16 -0.41 0.00 -1.93 0.00 0.00 57.85 52.39 1gkq n ARG 292 Cb 0.45 0.27 -0.01 0.00 -1.16 0.00 0.00 32.46 32.00 1gkq n ARG 292 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1gkq s ASP 293 N -4.04 6.44 0.42 0.55 -1.08 -1.26 -0.37 116.67 117.33 1gkq s ASP 293 Ca 0.32 2.90 0.24 0.00 -0.52 0.00 0.00 52.55 55.49 1gkq s ASP 293 Cb -0.03 -2.64 1.29 0.00 -1.46 0.00 0.00 42.92 40.08 1gkq s ASP 293 CO 0.21 -0.84 1.70 0.07 0.52 0.00 0.00 175.17 176.82 1gkq h LYS 294 N 4.47 0.00 -0.00 4.34 2.10 -1.95 -1.84 116.57 123.69 1gkq h LYS 294 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1gkq h LYS 294 Cb 1.22 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.55 1gkq h LYS 294 CO 0.75 0.00 0.01 0.07 -2.00 0.00 0.00 179.45 178.29 1gkq h ARG 295 N 0.00 0.00 0.00 0.07 0.11 -2.00 -1.49 114.38 111.07 1gkq h ARG 295 Ca 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 1gkq h ARG 295 Cb 0.26 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.34 1gkq h ARG 295 CO 0.00 0.00 -0.13 -0.91 0.10 0.00 0.00 179.97 179.03 1gkq h ASN 296 N 0.00 0.00 -0.65 0.08 2.35 -1.69 -3.31 115.58 112.36 1gkq h ASN 296 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1gkq h ASN 296 Cb 0.03 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.37 1gkq h ASN 296 CO -0.00 0.13 0.32 1.56 -1.65 0.00 0.00 177.43 177.79 1gkq h GLN 297 N 0.00 0.93 -0.66 0.81 4.20 -1.48 -1.46 115.11 117.44 1gkq h GLN 297 Ca -0.00 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.53 1gkq h GLN 297 Cb 0.87 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.46 1gkq h GLN 297 CO 0.02 0.74 0.24 -0.22 -0.67 0.00 0.00 178.83 178.93 1gkq h LYS 298 N 0.89 1.01 -0.26 1.46 3.64 -1.73 -0.20 116.57 121.38 1gkq h LYS 298 Ca 0.22 -0.20 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 1gkq h LYS 298 Cb 0.11 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1gkq h LYS 298 CO -0.03 0.86 0.07 0.28 -2.27 0.00 0.00 179.45 178.36 1gkq h VAL 299 N 0.94 0.91 -0.32 2.00 2.07 -1.61 0.71 116.25 120.95 1gkq h VAL 299 Ca 0.22 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.63 1gkq h VAL 299 Cb 0.25 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1gkq h VAL 299 CO -0.01 0.03 0.03 -0.07 0.02 0.00 0.00 177.57 177.57 1gkq h LEU 300 N 0.17 0.53 -0.34 2.57 3.38 -0.98 -1.27 115.31 119.38 1gkq h LEU 300 Ca 0.12 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.81 1gkq h LEU 300 Cb 0.10 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1gkq h LEU 300 CO -0.14 0.68 0.21 -0.50 0.09 0.00 0.00 178.44 178.78 1gkq h TRP 301 N 0.37 0.39 -0.62 1.13 4.06 -0.74 0.16 115.95 120.69 1gkq h TRP 301 Ca 0.10 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.05 1gkq h TRP 301 Cb 0.39 -0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 28.39 1gkq h TRP 301 CO 0.03 0.23 0.37 -0.44 -3.56 0.00 0.00 178.44 175.08 1gkq h ASP 302 N 0.42 0.75 -0.50 -3.49 3.32 -0.77 -1.42 116.42 114.73 1gkq h ASP 302 Ca 0.13 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 1gkq h ASP 302 Cb -0.02 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 1gkq h ASP 302 CO -0.05 0.59 0.20 0.00 -1.72 0.00 0.00 179.24 178.26 1gkq h ALA 303 N 1.19 1.34 -0.25 3.45 0.00 -0.82 -2.50 119.26 121.67 1gkq h ALA 303 Ca 0.22 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1gkq h ALA 303 Cb -0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1gkq h ALA 303 CO -0.04 0.49 -0.05 1.25 0.00 0.00 0.00 179.25 180.90 1gkq h LEU 304 N 0.78 0.47 -1.35 0.00 5.85 -0.47 0.30 115.31 120.90 1gkq h LEU 304 Ca 0.19 -0.36 0.05 0.00 0.84 0.00 0.00 57.88 58.60 1gkq h LEU 304 Cb 0.18 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1gkq h LEU 304 CO -0.02 0.72 0.48 0.00 -0.34 0.00 0.00 178.44 179.28 1gkq h ALA 305 N 0.77 1.64 -0.10 1.25 0.00 -0.98 -1.59 119.26 120.24 1gkq h ALA 305 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1gkq h ALA 305 Cb 0.50 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1gkq h ALA 305 CO 0.02 0.27 0.00 1.04 0.00 0.00 0.00 179.25 180.58 1gkq n GLN 306 N -4.47 1.70 -1.00 0.00 1.13 -0.97 -4.90 117.38 108.88 1gkq n GLN 306 Ca 0.10 -1.04 -0.00 0.00 -1.94 0.00 0.00 57.00 54.12 1gkq n GLN 306 Cb 0.17 -1.43 -0.00 0.00 0.11 0.00 0.00 30.24 29.09 1gkq n GLN 306 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1gkq n GLY 307 N 1.15 0.49 0.23 1.08 0.00 -0.60 -4.91 105.19 102.63 1gkq n GLY 307 Ca 0.17 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 1gkq n GLY 307 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1gkq h PHE 308 N 0.00 0.84 -3.55 1.61 0.04 -0.65 -3.39 116.94 111.85 1gkq h PHE 308 Ca -0.00 -0.27 -0.61 0.00 2.80 0.00 0.00 57.97 59.89 1gkq h PHE 308 Cb 0.01 -0.17 -0.12 0.00 2.20 0.00 0.00 35.95 37.86 1gkq h PHE 308 CO 0.00 1.02 -0.12 0.42 -0.60 0.00 0.00 178.31 179.04 1gkq s ILE 309 N -4.18 5.14 -0.08 -0.55 1.01 -1.08 -4.65 121.20 116.80 1gkq s ILE 309 Ca -0.09 0.78 -0.26 0.00 0.00 0.00 0.00 60.65 61.08 1gkq s ILE 309 Cb 0.11 -3.77 -0.24 0.00 0.01 0.00 0.00 42.46 38.57 1gkq s ILE 309 CO 0.85 0.17 0.97 0.44 0.00 0.00 0.00 174.94 177.37 1gkq h ASP 310 N 7.73 0.12 -3.80 3.58 5.19 -1.17 -3.43 116.42 124.65 1gkq h ASP 310 Ca -0.33 -0.82 -0.36 0.00 -0.62 0.00 0.00 57.03 54.90 1gkq h ASP 310 Cb 1.15 -0.04 -0.14 0.00 0.18 0.00 0.00 39.33 40.48 1gkq h ASP 310 CO 0.71 0.92 -0.70 0.42 -3.12 0.00 0.00 179.24 177.47 1gkq s THR 311 N -2.96 1.23 -0.13 0.35 -4.23 -0.96 -4.38 115.64 104.56 1gkq s THR 311 Ca -0.17 -2.08 0.01 0.00 -1.18 0.00 0.00 61.69 58.27 1gkq s THR 311 Cb -0.00 -2.03 0.02 0.00 1.34 0.00 0.00 72.50 71.82 1gkq s THR 311 CO 0.72 -0.60 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.37 1gkq s VAL 312 N -3.29 1.48 0.00 2.29 1.01 -0.28 -2.04 120.40 119.57 1gkq s VAL 312 Ca 0.21 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1gkq s VAL 312 Cb 0.03 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 35.02 1gkq s VAL 312 CO 0.04 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.19 1gkq n GLY 313 N 4.57 6.59 0.00 4.51 0.00 -0.53 -4.73 105.19 115.59 1gkq n GLY 313 Ca -0.17 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.81 1gkq n GLY 313 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gkq n THR 314 N 0.00 0.00 -3.39 2.61 -2.24 -1.25 -1.48 114.28 108.52 1gkq n THR 314 Ca 0.00 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.59 1gkq n THR 314 Cb 0.00 -0.66 0.07 0.00 -2.10 0.00 0.00 70.33 67.64 1gkq n THR 314 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1gkq n ASP 315 N -2.01 -4.99 -4.61 3.42 2.03 0.74 -4.65 116.55 106.48 1gkq n ASP 315 Ca 0.00 -0.48 -0.50 0.00 0.52 0.00 0.00 54.79 54.33 1gkq n ASP 315 Cb 0.42 -4.39 -0.06 0.00 -0.72 0.00 0.00 41.12 36.37 1gkq n ASP 315 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 1gkq n HIS 316 N -4.45 2.05 -3.25 -0.67 -0.00 -1.20 -4.58 115.22 103.12 1gkq n HIS 316 Ca -0.04 0.15 -0.19 0.00 -0.00 0.00 0.00 57.72 57.64 1gkq n HIS 316 Cb 0.57 -2.60 -0.07 0.00 -0.00 0.00 0.00 29.99 27.89 1gkq n HIS 316 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1gkq s PRO 318 N 0.73 4.56 0.02 0.00 0.04 -1.26 -2.69 135.00 136.40 1gkq s PRO 318 Ca 0.26 1.71 -0.02 0.00 0.04 0.00 0.00 61.00 62.99 1gkq s PRO 318 Cb -0.05 -3.30 -0.02 0.00 0.04 0.00 0.00 34.50 31.17 1gkq s PRO 318 CO -0.10 0.01 0.01 -0.06 0.04 0.00 0.00 177.00 176.91 1gkq s PHE 319 N 0.08 0.25 0.37 0.56 0.08 -1.26 -1.07 117.98 116.99 1gkq s PHE 319 Ca 0.51 -0.53 -0.12 0.00 0.12 0.00 0.00 56.93 56.91 1gkq s PHE 319 Cb -0.29 -0.19 -0.07 0.00 -0.57 0.00 0.00 43.02 41.90 1gkq s PHE 319 CO 0.33 -0.25 0.75 -0.51 -0.10 0.00 0.00 175.22 175.44 1gkq s ASP 320 N -1.73 6.62 0.46 1.36 1.01 -1.26 -4.55 116.67 118.58 1gkq s ASP 320 Ca -0.11 1.19 0.17 0.00 0.71 0.00 0.00 52.55 54.50 1gkq s ASP 320 Cb -0.06 -2.34 1.13 0.00 1.01 0.00 0.00 42.92 42.66 1gkq s ASP 320 CO -0.02 -0.32 1.99 0.71 0.21 0.00 0.00 175.17 177.74 1gkq h THR 321 N 1.45 0.85 -0.66 -1.27 1.35 -1.98 0.84 112.91 113.50 1gkq h THR 321 Ca -0.47 -0.10 -0.00 0.00 -0.55 0.00 0.00 66.41 65.28 1gkq h THR 321 Cb 1.18 0.54 -0.03 0.00 -1.73 0.00 0.00 68.15 68.11 1gkq h THR 321 CO 0.64 0.05 0.40 -0.08 -0.25 0.00 0.00 175.52 176.29 1gkq h GLU 322 N 0.29 0.89 -0.36 4.72 4.81 -1.99 -1.31 114.58 121.62 1gkq h GLU 322 Ca 0.27 -0.08 -0.14 0.00 -0.13 0.00 0.00 59.36 59.27 1gkq h GLU 322 Cb 0.66 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 1gkq h GLU 322 CO -0.06 0.63 -0.34 1.96 -0.73 0.00 0.00 179.01 180.47 1gkq h GLN 323 N 0.89 0.83 -0.76 1.92 4.20 -1.28 -2.87 115.11 118.05 1gkq h GLN 323 Ca 0.24 -0.40 0.05 0.00 0.06 0.00 0.00 58.65 58.60 1gkq h GLN 323 Cb -0.03 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 1gkq h GLN 323 CO -0.04 1.04 0.50 0.87 -0.67 0.00 0.00 178.83 180.52 1gkq h LYS 324 N 0.69 0.83 0.00 1.46 1.79 -0.60 -0.79 116.57 119.94 1gkq h LYS 324 Ca 0.07 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1gkq h LYS 324 Cb 0.90 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 1gkq h LYS 324 CO 0.08 0.55 0.00 1.28 -1.08 0.00 0.00 179.45 180.28 1gkq n LEU 325 N -4.47 0.00 0.17 2.94 4.77 -0.54 -2.39 117.00 117.48 1gkq n LEU 325 Ca 0.11 0.34 0.12 0.00 -0.03 0.00 0.00 56.01 56.55 1gkq n LEU 325 Cb 0.18 -0.34 0.62 0.00 -2.33 0.00 0.00 43.42 41.55 1gkq n LEU 325 CO 0.34 -0.25 0.87 -0.07 -1.33 0.00 0.00 177.39 176.94 1gkq h LEU 326 N 0.00 0.00 -3.39 2.23 3.38 -1.23 -1.80 115.31 114.50 1gkq h LEU 326 Ca 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.71 1gkq h LEU 326 Cb 0.09 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.67 1gkq h LEU 326 CO 0.00 0.00 -0.36 0.61 0.09 0.00 0.00 178.44 178.78 1gkq n GLY 327 N -1.04 5.47 0.28 0.83 0.00 -1.01 -4.69 105.19 105.04 1gkq n GLY 327 Ca -0.01 -1.72 0.18 0.00 0.00 0.00 0.00 46.02 44.47 1gkq n GLY 327 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1gkq h LYS 328 N 1.39 0.00 0.15 1.61 2.10 -1.55 -3.05 116.57 117.23 1gkq h LYS 328 Ca 0.22 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.52 1gkq h LYS 328 Cb 1.36 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.69 1gkq h LYS 328 CO 0.44 0.01 -1.78 0.93 -2.00 0.00 0.00 179.45 177.05 1gkq h GLU 329 N 0.00 0.32 -3.23 0.07 4.39 -1.84 -3.47 114.58 110.81 1gkq h GLU 329 Ca -0.00 -0.55 -0.22 0.00 0.34 0.00 0.00 59.36 58.93 1gkq h GLU 329 Cb 0.45 0.20 -0.30 0.00 -0.10 0.00 0.00 28.75 29.00 1gkq h GLU 329 CO 0.00 1.26 -0.56 0.00 -1.16 0.00 0.00 179.01 178.55 1gkq s ALA 330 N -2.55 -0.35 0.59 3.43 0.00 -1.15 -4.83 121.76 116.90 1gkq s ALA 330 Ca -0.19 0.68 0.29 0.00 0.00 0.00 0.00 51.96 52.74 1gkq s ALA 330 Cb 0.06 -0.44 1.70 0.00 0.00 0.00 0.00 23.12 24.43 1gkq s ALA 330 CO 0.81 -0.14 2.15 0.27 0.00 0.00 0.00 175.76 178.84 1gkq h PHE 331 N 6.90 0.00 0.00 0.00 -0.00 -1.38 -0.38 116.94 122.09 1gkq h PHE 331 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.59 1gkq h PHE 331 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.11 1gkq h PHE 331 CO 0.41 0.00 0.00 1.79 -0.00 0.00 0.00 178.31 180.51 1gkq h THR 332 N 0.00 0.00 -0.14 0.88 1.35 -1.88 -2.31 112.91 110.81 1gkq h THR 332 Ca 0.06 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1gkq h THR 332 Cb 0.34 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1gkq h THR 332 CO -0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1gkq n ALA 333 N -1.87 2.45 -2.58 6.62 0.00 -0.15 -4.90 120.51 120.08 1gkq n ALA 333 Ca 0.00 -0.78 -0.43 0.00 0.00 0.00 0.00 53.44 52.23 1gkq n ALA 333 Cb 0.16 -0.82 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 1gkq n ALA 333 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1gkq s ILE 334 N -1.83 4.48 0.06 0.00 1.01 -0.87 -3.58 121.20 120.47 1gkq s ILE 334 Ca 0.31 1.74 -0.31 0.00 0.00 0.00 0.00 60.65 62.39 1gkq s ILE 334 Cb 0.21 -4.28 -0.10 0.00 0.01 0.00 0.00 42.46 38.29 1gkq s ILE 334 CO 0.30 -0.33 1.90 -0.81 0.00 0.00 0.00 174.94 176.00 1gkq n PRO 335 N 6.71 2.74 -2.46 2.79 -0.04 -1.26 -4.91 135.00 138.57 1gkq n PRO 335 Ca 0.13 1.00 -0.42 0.00 -0.04 0.00 0.00 63.50 64.17 1gkq n PRO 335 Cb 0.46 -2.92 -0.03 0.00 -0.04 0.00 0.00 33.50 30.98 1gkq n PRO 335 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1gkq s ASN 336 N 3.65 7.14 0.00 3.54 0.02 -1.26 -4.92 114.94 123.10 1gkq s ASN 336 Ca 0.86 2.02 0.00 0.00 -1.02 0.00 0.00 52.86 54.73 1gkq s ASN 336 Cb -0.49 -2.59 0.00 0.00 0.02 0.00 0.00 41.25 38.19 1gkq s ASN 336 CO 0.41 -0.40 0.00 0.61 0.02 0.00 0.00 177.10 177.74 1gkq n GLY 337 N 2.89 4.19 2.99 0.66 0.00 0.10 -4.88 105.19 111.14 1gkq n GLY 337 Ca 0.07 -0.83 -0.16 0.00 0.00 0.00 0.00 46.02 45.11 1gkq n GLY 337 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gkq s ILE 338 N -1.82 0.49 0.30 -0.61 1.01 -1.10 -4.68 121.20 114.79 1gkq s ILE 338 Ca 0.00 -0.40 -0.18 0.00 0.00 0.00 0.00 60.65 60.07 1gkq s ILE 338 Cb 0.00 -0.44 -0.09 0.00 0.01 0.00 0.00 42.46 41.94 1gkq s ILE 338 CO 0.00 0.04 0.77 -2.16 0.00 0.00 0.00 174.94 173.59 1gkq s PRO 339 N -0.39 4.15 0.00 2.79 0.04 -1.26 -1.94 135.00 138.39 1gkq s PRO 339 Ca 0.00 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1gkq s PRO 339 Cb -0.04 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.92 1gkq s PRO 339 CO -0.00 0.23 0.00 0.00 0.04 0.00 0.00 177.00 177.27 1gkq n ALA 340 N 0.05 0.00 -0.12 8.56 0.00 -1.26 -4.42 120.51 123.32 1gkq n ALA 340 Ca 0.02 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.72 1gkq n ALA 340 Cb 0.52 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.69 1gkq n ALA 340 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1gkq h ILE 341 N 0.40 0.60 0.00 0.00 2.10 -1.93 -1.29 117.51 117.39 1gkq h ILE 341 Ca 0.00 0.00 -0.08 0.00 1.08 0.00 0.00 64.86 65.86 1gkq h ILE 341 Cb 0.20 0.61 -0.01 0.00 -1.09 0.00 0.00 36.82 36.52 1gkq h ILE 341 CO 0.00 0.00 -0.97 -0.08 -1.08 0.00 0.00 178.15 176.02 1gkq h GLU 342 N 0.00 0.00 0.00 2.19 4.81 -1.90 -3.39 114.58 116.29 1gkq h GLU 342 Ca 0.37 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.60 1gkq h GLU 342 Cb 1.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.87 1gkq h GLU 342 CO -0.00 0.19 -0.99 -0.25 -0.73 0.00 0.00 179.01 177.23 1gkq n ASP 343 N -2.89 0.84 -0.17 1.04 8.00 -0.54 -4.11 116.55 118.73 1gkq n ASP 343 Ca -0.03 -0.82 -0.12 0.00 0.71 0.00 0.00 54.79 54.53 1gkq n ASP 343 Cb 0.69 1.11 -0.09 0.00 -0.02 0.00 0.00 41.12 42.80 1gkq n ASP 343 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1gkq h ARG 344 N 0.00 -0.30 0.05 -1.24 2.43 -1.62 0.10 114.38 113.80 1gkq h ARG 344 Ca 0.00 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1gkq h ARG 344 Cb 0.48 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 1gkq h ARG 344 CO 0.00 -0.20 -0.14 0.28 -1.51 0.00 0.00 179.97 178.40 1gkq h VAL 345 N -0.31 0.66 -0.87 0.20 2.07 -1.84 0.72 116.25 116.87 1gkq h VAL 345 Ca 0.08 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 1gkq h VAL 345 Cb 0.52 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 1gkq h VAL 345 CO -0.59 0.00 0.52 0.78 0.02 0.00 0.00 177.57 178.30 1gkq h ASN 346 N -0.27 1.04 -0.31 0.57 2.35 -1.75 0.99 115.58 118.21 1gkq h ASN 346 Ca 0.03 -0.06 -0.08 0.00 -0.55 0.00 0.00 56.30 55.64 1gkq h ASN 346 Cb 0.30 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1gkq h ASN 346 CO -0.10 0.80 -0.14 -0.07 -1.65 0.00 0.00 177.43 176.27 1gkq h LEU 347 N 1.20 0.66 -0.44 1.61 3.38 -0.68 -0.69 115.31 120.35 1gkq h LEU 347 Ca 0.31 -0.40 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 1gkq h LEU 347 Cb -0.05 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1gkq h LEU 347 CO -0.06 0.91 -0.01 0.25 0.09 0.00 0.00 178.44 179.62 1gkq h LEU 348 N 0.41 0.77 -0.26 1.67 5.85 -0.56 -1.55 115.31 121.63 1gkq h LEU 348 Ca 0.07 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 1gkq h LEU 348 Cb 0.66 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1gkq h LEU 348 CO 0.04 0.90 0.09 0.22 -0.34 0.00 0.00 178.44 179.35 1gkq h TYR 349 N 0.62 0.40 0.85 1.25 3.20 -0.79 -0.09 116.97 122.42 1gkq h TYR 349 Ca 0.12 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.92 1gkq h TYR 349 Cb 0.51 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.67 1gkq h TYR 349 CO 0.04 0.42 -0.41 1.15 -1.64 0.00 0.00 178.16 177.72 1gkq h THR 350 N 0.26 0.01 0.00 1.81 2.02 -1.01 0.47 112.91 116.47 1gkq h THR 350 Ca 0.08 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1gkq h THR 350 Cb 0.20 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 1gkq h THR 350 CO -0.01 0.00 -0.05 -1.22 0.37 0.00 0.00 175.52 174.61 1gkq n TYR 351 N -5.53 0.30 -0.09 3.16 4.01 -0.60 -0.25 117.16 118.17 1gkq n TYR 351 Ca -0.14 0.09 -0.10 0.00 -0.16 0.00 0.00 57.90 57.59 1gkq n TYR 351 Cb 0.45 -0.62 -0.03 0.00 -0.31 0.00 0.00 39.34 38.82 1gkq n TYR 351 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gkq n GLY 352 N 1.44 -0.51 0.06 2.72 0.00 -0.05 -3.41 105.19 105.44 1gkq n GLY 352 Ca 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 46.02 45.77 1gkq n GLY 352 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1gkq h VAL 353 N -0.95 0.03 -0.46 1.61 2.07 -1.16 -0.65 116.25 116.74 1gkq h VAL 353 Ca -0.04 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1gkq h VAL 353 Cb 0.99 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1gkq h VAL 353 CO -0.03 0.01 0.29 -1.28 0.02 0.00 0.00 177.57 176.58 1gkq h SER 354 N -1.00 0.55 -0.09 0.57 0.87 -0.90 -3.30 113.55 110.24 1gkq h SER 354 Ca -0.00 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1gkq h SER 354 Cb 0.13 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1gkq h SER 354 CO -0.00 0.43 0.00 0.54 -0.53 0.00 0.00 176.83 177.27 1gkq n ARG 355 N -4.74 1.95 -0.03 2.24 1.74 0.66 -5.03 116.66 113.46 1gkq n ARG 355 Ca 0.02 -1.42 0.00 0.00 -0.77 0.00 0.00 57.85 55.68 1gkq n ARG 355 Cb 0.04 -1.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 1gkq n ARG 355 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gkq n GLY 356 N -0.02 7.38 0.99 -0.13 0.00 -1.00 -4.90 105.19 107.51 1gkq n GLY 356 Ca 0.04 -1.93 0.09 0.00 0.00 0.00 0.00 46.02 44.22 1gkq n GLY 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gkq n ARG 357 N 0.00 2.55 -2.35 1.61 1.74 -1.12 -4.73 116.66 114.35 1gkq n ARG 357 Ca 0.00 -2.25 -0.43 0.00 -0.77 0.00 0.00 57.85 54.40 1gkq n ARG 357 Cb 0.00 -1.43 -0.02 0.00 -1.02 0.00 0.00 32.46 29.99 1gkq n ARG 357 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1gkq s LEU 358 N -1.10 4.18 0.35 0.55 2.96 -0.28 -4.98 118.68 120.35 1gkq s LEU 358 Ca 0.35 1.75 -0.28 0.00 -0.22 0.00 0.00 54.13 55.73 1gkq s LEU 358 Cb 0.19 -3.54 -0.11 0.00 0.50 0.00 0.00 46.19 43.24 1gkq s LEU 358 CO 0.25 -0.81 1.37 -0.62 -1.32 0.00 0.00 176.35 175.23 1gkq s ASP 359 N 2.26 6.61 0.51 3.68 -1.08 -1.26 -4.02 116.67 123.36 1gkq s ASP 359 Ca 0.58 2.82 0.19 0.00 -0.52 0.00 0.00 52.55 55.62 1gkq s ASP 359 Cb -0.23 -2.66 1.28 0.00 -1.46 0.00 0.00 42.92 39.85 1gkq s ASP 359 CO 0.17 -0.66 2.10 -0.29 0.52 0.00 0.00 175.17 177.02 1gkq h ILE 360 N 3.01 0.93 0.03 4.11 2.10 -1.94 -1.30 117.51 124.44 1gkq h ILE 360 Ca -0.50 -0.28 -0.22 0.00 1.08 0.00 0.00 64.86 64.95 1gkq h ILE 360 Cb 1.23 1.16 -0.01 0.00 -1.09 0.00 0.00 36.82 38.11 1gkq h ILE 360 CO 0.65 0.08 -0.97 0.45 -1.08 0.00 0.00 178.15 177.27 1gkq h HIS 361 N 0.00 0.39 -0.04 2.19 3.86 -1.86 -2.66 115.15 117.02 1gkq h HIS 361 Ca -0.00 -0.23 -0.10 0.00 -1.16 0.00 0.00 60.37 58.88 1gkq h HIS 361 Cb 0.15 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 1gkq h HIS 361 CO 0.00 1.08 -0.44 -0.09 0.86 0.00 0.00 177.93 179.34 1gkq h ARG 362 N 0.12 0.10 -0.31 2.45 9.65 -1.69 -2.05 114.38 122.66 1gkq h ARG 362 Ca -0.07 -0.05 -0.02 0.00 -1.10 0.00 0.00 59.98 58.74 1gkq h ARG 362 Cb 1.63 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 30.20 1gkq h ARG 362 CO 0.15 0.52 0.10 0.35 2.80 0.00 0.00 179.97 183.90 1gkq h PHE 363 N 0.08 0.50 -0.57 2.20 3.57 -1.11 0.63 116.94 122.24 1gkq h PHE 363 Ca 0.00 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.37 1gkq h PHE 363 Cb 0.81 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 1gkq h PHE 363 CO 0.01 0.51 0.00 0.28 -2.23 0.00 0.00 178.31 176.87 1gkq h VAL 364 N 0.35 1.26 -0.32 1.41 2.07 -1.26 -1.23 116.25 118.53 1gkq h VAL 364 Ca 0.10 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.46 1gkq h VAL 364 Cb 0.24 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1gkq h VAL 364 CO -0.00 0.40 0.08 -0.78 0.02 0.00 0.00 177.57 177.29 1gkq h ASP 365 N 0.89 0.49 0.78 0.57 3.58 -1.19 0.16 116.42 121.70 1gkq h ASP 365 Ca 0.16 -0.23 -0.09 0.00 0.42 0.00 0.00 57.03 57.29 1gkq h ASP 365 Cb 0.54 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.45 1gkq h ASP 365 CO 0.03 0.60 -0.42 0.00 -2.88 0.00 0.00 179.24 176.57 1gkq h ALA 366 N 0.91 1.01 -0.02 -0.78 0.00 -0.79 0.01 119.26 119.60 1gkq h ALA 366 Ca 0.10 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1gkq h ALA 366 Cb 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1gkq h ALA 366 CO 0.00 0.53 -0.30 0.00 0.00 0.00 0.00 179.25 179.48 1gkq n ALA 367 N -2.33 3.13 0.02 0.00 0.00 -0.47 -1.12 120.51 119.73 1gkq n ALA 367 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.83 1gkq n ALA 367 Cb 0.53 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1gkq n ALA 367 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1gkq n SER 368 N 0.24 -0.16 -0.10 0.00 2.88 0.02 -1.63 113.62 114.87 1gkq n SER 368 Ca 0.09 0.06 -0.06 0.00 -1.33 0.00 0.00 58.87 57.62 1gkq n SER 368 Cb 0.43 0.36 0.01 0.00 -0.75 0.00 0.00 64.21 64.26 1gkq n SER 368 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1gkq h THR 369 N 0.00 0.91 -0.48 2.46 2.02 -1.50 -2.66 112.91 113.66 1gkq h THR 369 Ca 0.00 -0.10 0.03 0.00 0.77 0.00 0.00 66.41 67.11 1gkq h THR 369 Cb 0.00 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 1gkq h THR 369 CO 0.00 0.05 0.28 0.50 0.37 0.00 0.00 175.52 176.72 1gkq h LYS 370 N 0.28 0.54 -0.75 6.66 1.63 -1.26 -0.88 116.57 122.79 1gkq h LYS 370 Ca 0.16 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 59.89 1gkq h LYS 370 Cb 0.13 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 31.60 1gkq h LYS 370 CO -0.16 0.36 0.30 0.00 -3.45 0.00 0.00 179.45 176.50 1gkq h ALA 371 N 1.22 1.12 -0.76 5.00 0.00 -1.75 -0.43 119.26 123.67 1gkq h ALA 371 Ca 0.20 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1gkq h ALA 371 Cb 0.04 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1gkq h ALA 371 CO -0.10 0.63 0.29 0.00 0.00 0.00 0.00 179.25 180.07 1gkq h ALA 372 N 1.24 1.08 0.01 0.00 0.00 -1.06 -1.86 119.26 118.67 1gkq h ALA 372 Ca 0.25 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1gkq h ALA 372 Cb 0.20 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1gkq h ALA 372 CO -0.02 0.65 -0.01 0.87 0.00 0.00 0.00 179.25 180.74 1gkq h LYS 373 N 1.10 -0.02 -0.84 0.00 1.57 -0.67 0.31 116.57 118.02 1gkq h LYS 373 Ca 0.25 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 59.05 1gkq h LYS 373 Cb 0.23 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 1gkq h LYS 373 CO -0.02 0.39 0.56 -0.07 -0.57 0.00 0.00 179.45 179.74 1gkq h LEU 374 N -0.43 0.95 -3.56 2.94 3.38 -1.00 -3.06 115.31 114.53 1gkq h LEU 374 Ca -0.00 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1gkq h LEU 374 Cb 0.42 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 1gkq h LEU 374 CO 0.00 0.68 0.10 0.49 0.09 0.00 0.00 178.44 179.80 1gkq n PHE 375 N -4.42 1.95 -1.92 1.13 3.72 -0.71 -4.96 117.46 112.25 1gkq n PHE 375 Ca 0.10 -0.98 -0.14 0.00 -0.05 0.00 0.00 57.45 56.37 1gkq n PHE 375 Cb 0.05 -0.54 -0.03 0.00 -0.94 0.00 0.00 39.48 38.02 1gkq n PHE 375 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gkq n GLY 376 N 0.01 0.47 0.03 1.37 0.00 -1.09 -4.88 105.19 101.10 1gkq n GLY 376 Ca 0.32 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1gkq n GLY 376 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gkq n LEU 377 N -1.88 0.58 -4.83 0.99 4.77 0.96 -4.68 117.00 112.91 1gkq n LEU 377 Ca -0.16 -0.04 -0.35 0.00 -0.03 0.00 0.00 56.01 55.43 1gkq n LEU 377 Cb 0.56 -0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.52 1gkq n LEU 377 CO 0.21 0.04 0.37 0.12 -1.33 0.00 0.00 177.39 176.80 1gkq s PHE 378 N -3.23 3.58 -2.27 -1.77 2.19 -0.50 0.13 117.98 116.11 1gkq s PHE 378 Ca 0.02 1.26 0.24 0.00 0.33 0.00 0.00 56.93 58.78 1gkq s PHE 378 Cb 0.14 -2.53 1.07 0.00 -1.31 0.00 0.00 43.02 40.39 1gkq s PHE 378 CO 0.82 0.31 1.74 -0.35 1.83 0.00 0.00 175.22 179.57 1gkq n PRO 379 N 0.52 1.49 -0.14 10.12 -0.04 -1.26 -4.86 135.00 140.84 1gkq n PRO 379 Ca -0.02 -0.73 -0.04 0.00 -0.04 0.00 0.00 63.50 62.68 1gkq n PRO 379 Cb 0.52 -1.42 0.04 0.00 -0.04 0.00 0.00 33.50 32.60 1gkq n PRO 379 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1gkq h ARG 380 N 1.61 0.17 -5.50 0.54 2.43 -1.80 -3.43 114.38 108.41 1gkq h ARG 380 Ca 0.00 -0.01 -0.65 0.00 -0.81 0.00 0.00 59.98 58.51 1gkq h ARG 380 Cb 0.35 -0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 29.73 1gkq h ARG 380 CO 0.00 0.11 -0.56 0.15 -1.51 0.00 0.00 179.97 178.16 1gkq s LYS 381 N -6.16 2.06 0.00 0.20 -0.14 0.12 -1.79 119.74 114.03 1gkq s LYS 381 Ca -0.13 -2.21 0.00 0.00 -1.36 0.00 0.00 55.97 52.27 1gkq s LYS 381 Cb 0.15 -1.62 0.00 0.00 -1.68 0.00 0.00 37.83 34.68 1gkq s LYS 381 CO 0.72 -0.18 0.00 0.41 -0.76 0.00 0.00 175.35 175.54 1gkq n GLY 382 N -1.10 0.85 3.83 -3.33 0.00 -1.26 -4.09 105.19 100.08 1gkq n GLY 382 Ca -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 1gkq n GLY 382 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1gkq s THR 383 N -3.33 0.00 -0.29 2.61 -1.32 -1.26 -3.71 115.64 108.34 1gkq s THR 383 Ca 0.00 -1.03 -0.01 0.00 -1.21 0.00 0.00 61.69 59.44 1gkq s THR 383 Cb 0.00 -2.23 0.05 0.00 -1.51 0.00 0.00 72.50 68.81 1gkq s THR 383 CO 0.00 0.00 -0.02 -0.63 -2.21 0.00 0.00 174.62 171.76 1gkq s ILE 384 N -3.53 2.89 -0.10 5.08 1.01 -1.26 -4.85 121.20 120.44 1gkq s ILE 384 Ca 0.13 -1.38 -0.30 0.00 0.00 0.00 0.00 60.65 59.10 1gkq s ILE 384 Cb -0.05 -2.65 0.11 0.00 0.01 0.00 0.00 42.46 39.88 1gkq s ILE 384 CO 0.08 -0.07 0.93 0.00 0.00 0.00 0.00 174.94 175.88 1gkq s ALA 385 N 1.24 -1.88 0.19 9.38 0.00 -1.26 -5.05 121.76 124.38 1gkq s ALA 385 Ca -0.05 1.38 -0.33 0.00 0.00 0.00 0.00 51.96 52.96 1gkq s ALA 385 Cb -0.20 -0.28 -0.14 0.00 0.00 0.00 0.00 23.12 22.51 1gkq s ALA 385 CO -0.02 -0.44 1.47 0.28 0.00 0.00 0.00 175.76 177.05 1gkq n VAL 386 N 0.44 0.47 0.00 0.00 0.31 -1.26 -1.29 118.33 116.99 1gkq n VAL 386 Ca -0.11 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 1gkq n VAL 386 Cb 0.59 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 1gkq n VAL 386 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1gkq n GLY 387 N 2.72 2.94 3.83 2.92 0.00 -0.46 -4.98 105.19 112.15 1gkq n GLY 387 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1gkq n GLY 387 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gkq s SER 388 N -0.05 5.93 0.41 1.61 0.01 -0.41 -4.70 113.70 116.50 1gkq s SER 388 Ca 0.00 1.62 -0.26 0.00 1.31 0.00 0.00 55.95 58.62 1gkq s SER 388 Cb 0.00 -2.50 -0.09 0.00 0.21 0.00 0.00 66.02 63.64 1gkq s SER 388 CO 0.00 -1.06 1.37 -1.81 0.41 0.00 0.00 173.24 172.15 1gkq s ASP 389 N -3.44 6.22 -1.17 2.44 1.01 -0.74 -0.88 116.67 120.11 1gkq s ASP 389 Ca 0.59 2.81 -0.08 0.00 0.71 0.00 0.00 52.55 56.58 1gkq s ASP 389 Cb -0.13 -2.65 -0.10 0.00 1.01 0.00 0.00 42.92 41.05 1gkq s ASP 389 CO 0.45 -0.93 2.78 0.00 0.21 0.00 0.00 175.17 177.68 1gkq n ALA 390 N 0.14 6.49 -2.85 5.23 0.00 0.94 -4.69 120.51 125.77 1gkq n ALA 390 Ca 0.03 -2.79 -0.44 0.00 0.00 0.00 0.00 53.44 50.24 1gkq n ALA 390 Cb 0.42 -3.10 -0.06 0.00 0.00 0.00 0.00 19.45 16.71 1gkq n ALA 390 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gkq s ASP 391 N 2.50 6.20 0.14 0.00 1.11 -1.26 -1.90 116.67 123.45 1gkq s ASP 391 Ca 0.60 -1.12 0.07 0.00 0.18 0.00 0.00 52.55 52.27 1gkq s ASP 391 Cb 0.17 -2.26 -0.04 0.00 1.07 0.00 0.00 42.92 41.87 1gkq s ASP 391 CO -0.04 -0.85 -0.15 -0.76 1.18 0.00 0.00 175.17 174.56 1gkq s LEU 392 N 2.32 2.45 -0.21 1.23 1.43 -1.09 -1.28 118.68 123.52 1gkq s LEU 392 Ca 0.11 -0.87 -0.02 0.00 -1.03 0.00 0.00 54.13 52.32 1gkq s LEU 392 Cb -0.22 -0.60 0.06 0.00 0.03 0.00 0.00 46.19 45.47 1gkq s LEU 392 CO 0.09 -0.15 0.03 -0.69 0.23 0.00 0.00 176.35 175.87 1gkq s VAL 393 N -2.36 0.70 -0.50 -1.59 1.01 -0.65 -1.11 120.40 115.90 1gkq s VAL 393 Ca 0.13 -0.75 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 1gkq s VAL 393 Cb -0.04 -1.21 0.03 0.00 0.00 0.00 0.00 36.38 35.16 1gkq s VAL 393 CO 0.04 -0.25 0.95 -0.69 0.00 0.00 0.00 175.10 175.16 1gkq s VAL 394 N 1.77 4.40 -0.18 2.92 1.01 0.84 -1.07 120.40 130.10 1gkq s VAL 394 Ca -0.01 0.60 -0.10 0.00 0.00 0.00 0.00 61.98 62.48 1gkq s VAL 394 Cb -0.17 -4.50 -0.05 0.00 0.00 0.00 0.00 36.38 31.66 1gkq s VAL 394 CO -0.10 -0.98 0.15 -0.47 0.00 0.00 0.00 175.10 173.71 1gkq s TYR 395 N 3.93 3.46 -0.46 5.22 5.04 0.15 -0.05 117.35 134.64 1gkq s TYR 395 Ca 0.35 0.41 -0.15 0.00 -2.44 0.00 0.00 57.07 55.24 1gkq s TYR 395 Cb -0.11 -2.13 0.06 0.00 0.35 0.00 0.00 41.96 40.13 1gkq s TYR 395 CO 0.24 0.39 0.38 0.34 -1.34 0.00 0.00 175.55 175.55 1gkq s ASP 396 N 0.04 6.14 0.00 4.32 2.15 -0.51 -1.21 116.67 127.60 1gkq s ASP 396 Ca 0.11 -1.21 0.31 0.00 0.43 0.00 0.00 52.55 52.19 1gkq s ASP 396 Cb -0.12 -2.18 1.75 0.00 -0.30 0.00 0.00 42.92 42.08 1gkq s ASP 396 CO 0.00 -0.60 2.16 -0.81 -0.17 0.00 0.00 175.17 175.75 1gkq n PRO 397 N 5.21 0.81 0.02 4.34 -0.04 -1.26 -2.82 135.00 141.26 1gkq n PRO 397 Ca -0.12 -0.02 0.11 0.00 -0.04 0.00 0.00 63.50 63.43 1gkq n PRO 397 Cb 0.45 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.46 1gkq n PRO 397 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1gkq n GLN 398 N -1.08 0.19 -2.15 0.54 1.13 -1.26 -4.73 117.38 110.02 1gkq n GLN 398 Ca 0.20 -0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.88 1gkq n GLN 398 Cb 0.16 -1.56 -0.01 0.00 0.11 0.00 0.00 30.24 28.94 1gkq n GLN 398 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 1gkq s TYR 399 N -3.13 2.91 -0.03 1.08 5.04 -1.20 -4.98 117.35 117.03 1gkq s TYR 399 Ca 0.06 1.48 -0.01 0.00 -2.44 0.00 0.00 57.07 56.16 1gkq s TYR 399 Cb 0.15 -3.55 0.03 0.00 0.35 0.00 0.00 41.96 38.95 1gkq s TYR 399 CO 0.79 -1.77 0.06 1.03 -1.34 0.00 0.00 175.55 174.32 1gkq s ARG 400 N -2.29 -0.01 0.00 4.97 1.81 -1.26 -2.74 118.95 119.43 1gkq s ARG 400 Ca 0.58 0.24 0.00 0.00 -1.72 0.00 0.00 55.73 54.83 1gkq s ARG 400 Cb -0.35 -0.24 0.00 0.00 -0.45 0.00 0.00 34.95 33.92 1gkq s ARG 400 CO 0.44 -0.17 0.00 0.41 -0.68 0.00 0.00 175.30 175.30 1gkq n GLY 401 N 4.22 1.38 3.10 -3.53 0.00 -1.08 -5.02 105.19 104.25 1gkq n GLY 401 Ca -0.27 -0.89 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 1gkq n GLY 401 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gkq s THR 402 N -2.56 0.73 0.17 2.61 -4.23 -1.26 -1.32 115.64 109.78 1gkq s THR 402 Ca 0.00 -1.18 -0.26 0.00 -1.18 0.00 0.00 61.69 59.07 1gkq s THR 402 Cb 0.00 -0.79 -0.08 0.00 1.34 0.00 0.00 72.50 72.97 1gkq s THR 402 CO 0.00 -0.35 0.82 -0.63 -0.54 0.00 0.00 174.62 173.92 1gkq s ILE 403 N -1.41 4.35 -0.06 2.99 1.01 0.59 -4.94 121.20 123.72 1gkq s ILE 403 Ca -0.07 1.79 -0.22 0.00 0.00 0.00 0.00 60.65 62.16 1gkq s ILE 403 Cb -0.10 -4.18 0.05 0.00 0.01 0.00 0.00 42.46 38.24 1gkq s ILE 403 CO 0.01 0.49 0.49 -0.55 0.00 0.00 0.00 174.94 175.39 1gkq s SER 404 N -0.98 -0.44 0.47 3.58 0.15 -1.26 -0.39 113.70 114.83 1gkq s SER 404 Ca 0.38 0.52 0.18 0.00 0.70 0.00 0.00 55.95 57.73 1gkq s SER 404 Cb -0.23 0.55 1.16 0.00 -1.71 0.00 0.00 66.02 65.79 1gkq s SER 404 CO 0.27 -0.46 2.03 1.62 1.20 0.00 0.00 173.24 177.91 1gkq h VAL 405 N 3.63 0.96 0.00 4.45 3.04 -1.93 -1.99 116.25 124.40 1gkq h VAL 405 Ca -0.28 -0.55 0.00 0.00 -1.01 0.00 0.00 66.70 64.86 1gkq h VAL 405 Cb 1.16 1.31 0.00 0.00 -2.01 0.00 0.00 31.29 31.75 1gkq h VAL 405 CO 0.35 0.15 0.00 0.11 -1.01 0.00 0.00 177.57 177.17 1gkq h LYS 406 N 0.00 0.00 0.00 4.17 1.57 -1.98 -2.79 116.57 117.54 1gkq h LYS 406 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1gkq h LYS 406 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1gkq h LYS 406 CO 0.02 0.00 -0.02 0.25 -0.57 0.00 0.00 179.45 179.13 1gkq n THR 407 N -3.01 0.90 -2.34 -0.16 -2.24 -0.77 -5.07 114.28 101.59 1gkq n THR 407 Ca -0.02 -0.95 -0.26 0.00 -2.27 0.00 0.00 64.05 60.55 1gkq n THR 407 Cb 0.11 0.49 0.05 0.00 -2.10 0.00 0.00 70.33 68.87 1gkq n THR 407 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gkq s GLN 408 N -1.04 2.57 0.00 -0.78 -2.07 -1.06 -4.98 119.66 112.31 1gkq s GLN 408 Ca 0.05 -0.18 0.01 0.00 -1.82 0.00 0.00 55.36 53.41 1gkq s GLN 408 Cb 0.04 -2.25 0.02 0.00 -1.09 0.00 0.00 33.01 29.73 1gkq s GLN 408 CO 0.00 -0.93 0.82 0.72 -1.32 0.00 0.00 175.29 174.58 1gkq n HIS 409 N -2.71 0.03 -2.47 9.60 8.25 -1.26 -5.00 115.22 121.66 1gkq n HIS 409 Ca 0.06 -0.28 -0.41 0.00 -0.26 0.00 0.00 57.72 56.83 1gkq n HIS 409 Cb 0.59 -0.03 -0.04 0.00 1.12 0.00 0.00 29.99 31.64 1gkq n HIS 409 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1gkq s VAL 410 N -0.61 3.79 0.00 1.59 1.01 -1.26 -4.61 120.40 120.31 1gkq s VAL 410 Ca 0.02 1.52 -0.04 0.00 0.00 0.00 0.00 61.98 63.48 1gkq s VAL 410 Cb 0.01 -3.97 -0.18 0.00 0.00 0.00 0.00 36.38 32.24 1gkq s VAL 410 CO 0.02 0.25 2.64 -3.20 0.00 0.00 0.00 175.10 174.81 1gkq n ASN 411 N 2.48 3.73 -3.66 3.32 5.15 -1.26 -4.81 115.26 120.21 1gkq n ASN 411 Ca 0.03 -2.18 -0.16 0.00 -0.60 0.00 0.00 54.58 51.67 1gkq n ASN 411 Cb 0.46 -1.00 -0.08 0.00 -0.53 0.00 0.00 39.78 38.63 1gkq n ASN 411 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1gkq s ASN 412 N 2.27 0.98 -0.09 1.20 4.22 -1.26 -4.56 114.94 117.70 1gkq s ASN 412 Ca 0.45 -1.56 0.16 0.00 -2.14 0.00 0.00 52.86 49.76 1gkq s ASN 412 Cb 0.21 0.51 0.62 0.00 1.28 0.00 0.00 41.25 43.87 1gkq s ASN 412 CO 0.00 -1.02 1.50 -0.90 -2.04 0.00 0.00 177.10 174.64 1gkq n ASP 413 N -1.04 4.11 -3.54 3.54 5.75 -1.26 -4.96 116.55 119.15 1gkq n ASP 413 Ca 0.04 -2.36 -0.16 0.00 -0.01 0.00 0.00 54.79 52.30 1gkq n ASP 413 Cb 0.63 -0.53 -0.06 0.00 -1.03 0.00 0.00 41.12 40.14 1gkq n ASP 413 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1gkq s TYR 414 N -1.78 -0.54 -0.11 2.11 1.13 -1.26 -4.90 117.35 112.00 1gkq s TYR 414 Ca 0.44 0.79 0.01 0.00 -1.41 0.00 0.00 57.07 56.90 1gkq s TYR 414 Cb 0.28 0.38 -0.02 0.00 -1.10 0.00 0.00 41.96 41.50 1gkq s TYR 414 CO 0.21 -0.63 -0.13 1.21 -2.51 0.00 0.00 175.55 173.70 1gkq s ASN 415 N -1.58 4.02 0.55 -0.18 3.84 -1.26 -4.89 114.94 115.43 1gkq s ASN 415 Ca -0.08 -0.29 0.33 0.00 0.21 0.00 0.00 52.86 53.03 1gkq s ASN 415 Cb -0.01 -1.39 1.49 0.00 -0.55 0.00 0.00 41.25 40.80 1gkq s ASN 415 CO 0.04 0.22 2.04 1.23 -2.79 0.00 0.00 177.10 177.84 1gkq h GLY 416 N 6.30 0.00 -2.66 1.21 0.00 -1.94 -3.06 103.07 102.93 1gkq h GLY 416 Ca -0.32 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.69 1gkq h GLY 416 CO 0.54 0.00 -0.16 0.69 0.00 0.00 0.00 176.54 177.61 1gkq n PHE 417 N -3.24 1.70 -1.66 5.60 3.72 -1.26 -5.04 117.46 117.29 1gkq n PHE 417 Ca -0.01 -1.93 -0.52 0.00 -0.05 0.00 0.00 57.45 54.94 1gkq n PHE 417 Cb 0.27 -0.57 -0.06 0.00 -0.94 0.00 0.00 39.48 38.19 1gkq n PHE 417 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1gkq n GLU 418 N -1.01 1.51 0.00 -1.08 4.07 -1.16 -1.13 120.64 121.84 1gkq n GLU 418 Ca 0.39 0.55 0.00 0.00 -0.06 0.00 0.00 57.16 58.04 1gkq n GLU 418 Cb 0.97 -2.26 0.00 0.00 -0.06 0.00 0.00 31.44 30.08 1gkq n GLU 418 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1gkq n GLY 419 N 3.60 2.36 3.77 8.31 0.00 0.48 -5.00 105.19 118.71 1gkq n GLY 419 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 1gkq n GLY 419 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gkq s PHE 420 N -2.27 2.82 0.31 1.61 0.40 -0.29 -4.65 117.98 115.91 1gkq s PHE 420 Ca 0.00 1.19 -0.12 0.00 -0.60 0.00 0.00 56.93 57.40 1gkq s PHE 420 Cb 0.00 -3.89 -0.08 0.00 0.51 0.00 0.00 43.02 39.57 1gkq s PHE 420 CO 0.00 -2.63 0.67 -1.21 0.70 0.00 0.00 175.22 172.75 1gkq s GLU 421 N -1.57 3.88 -0.01 0.44 2.02 -1.26 -0.30 118.70 121.89 1gkq s GLU 421 Ca 0.54 0.47 0.02 0.00 0.02 0.00 0.00 54.97 56.02 1gkq s GLU 421 Cb -0.44 -2.50 -0.00 0.00 0.10 0.00 0.00 34.13 31.29 1gkq s GLU 421 CO 0.55 0.18 -0.08 0.96 0.02 0.00 0.00 175.26 176.89 1gkq s ILE 422 N -2.01 0.62 -0.46 -1.63 -4.36 -0.43 -4.91 121.20 108.02 1gkq s ILE 422 Ca 0.51 -0.32 0.04 0.00 -0.26 0.00 0.00 60.65 60.62 1gkq s ILE 422 Cb -0.11 -0.53 0.64 0.00 1.25 0.00 0.00 42.46 43.71 1gkq s ILE 422 CO 0.22 0.18 1.90 0.47 0.24 0.00 0.00 174.94 177.95 1gkq n ASP 423 N 2.99 4.07 0.00 4.36 8.00 -1.26 -2.63 116.55 132.08 1gkq n ASP 423 Ca -0.14 -3.64 0.00 0.00 0.71 0.00 0.00 54.79 51.72 1gkq n ASP 423 Cb 0.57 -0.84 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 1gkq n ASP 423 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gkq n GLY 424 N -1.12 0.50 3.56 0.44 0.00 -1.11 -4.56 105.19 102.89 1gkq n GLY 424 Ca 0.59 -0.92 -0.06 0.00 0.00 0.00 0.00 46.02 45.62 1gkq n GLY 424 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1gkq s ARG 425 N -2.00 0.54 0.18 1.61 1.70 -1.13 -4.89 118.95 114.96 1gkq s ARG 425 Ca 0.00 -0.18 -0.30 0.00 -0.47 0.00 0.00 55.73 54.78 1gkq s ARG 425 Cb 0.00 0.25 -0.08 0.00 -0.57 0.00 0.00 34.95 34.55 1gkq s ARG 425 CO 0.00 -0.23 1.23 -2.14 -1.08 0.00 0.00 175.30 173.08 1gkq s PRO 426 N -2.62 4.46 -0.25 3.89 0.02 -1.26 -1.42 135.00 137.82 1gkq s PRO 426 Ca 0.07 1.92 -0.07 0.00 0.02 0.00 0.00 61.00 62.93 1gkq s PRO 426 Cb -0.01 -3.23 -0.16 0.00 0.02 0.00 0.00 34.50 31.12 1gkq s PRO 426 CO -0.06 -0.14 -0.19 0.45 -0.33 0.00 0.00 177.00 176.72 1gkq n SER 427 N 2.64 1.97 -3.91 2.53 2.88 0.93 -4.49 113.62 116.17 1gkq n SER 427 Ca 0.05 0.14 -0.17 0.00 -1.33 0.00 0.00 58.87 57.56 1gkq n SER 427 Cb 0.44 -0.67 -0.15 0.00 -0.75 0.00 0.00 64.21 63.08 1gkq n SER 427 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1gkq s VAL 428 N -2.51 0.37 -0.05 2.46 1.01 -1.02 -0.14 120.40 120.51 1gkq s VAL 428 Ca -0.35 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1gkq s VAL 428 Cb 0.11 -0.37 0.02 0.00 0.00 0.00 0.00 36.38 36.14 1gkq s VAL 428 CO 0.57 0.15 -0.09 -0.69 0.00 0.00 0.00 175.10 175.04 1gkq s VAL 429 N 0.41 0.85 0.15 2.92 1.01 -0.39 -0.11 120.40 125.23 1gkq s VAL 429 Ca -0.05 -0.31 0.10 0.00 0.00 0.00 0.00 61.98 61.72 1gkq s VAL 429 Cb -0.08 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 1gkq s VAL 429 CO -0.00 0.29 -0.24 0.42 0.00 0.00 0.00 175.10 175.57 1gkq s THR 430 N 0.75 2.13 -0.20 3.92 -4.23 -0.26 -0.23 115.64 117.52 1gkq s THR 430 Ca -0.13 -1.82 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1gkq s THR 430 Cb -0.15 -1.94 0.05 0.00 1.34 0.00 0.00 72.50 71.80 1gkq s THR 430 CO 0.02 -0.05 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.29 1gkq s VAL 431 N -1.38 1.46 -1.42 2.29 1.01 0.21 -2.69 120.40 119.88 1gkq s VAL 431 Ca 0.15 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 1gkq s VAL 431 Cb -0.09 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.68 1gkq s VAL 431 CO 0.07 0.09 0.35 0.54 0.00 0.00 0.00 175.10 176.15 1gkq n ARG 432 N 4.74 -2.82 -0.28 2.72 1.74 -1.14 -1.57 116.66 120.05 1gkq n ARG 432 Ca -0.13 0.35 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 1gkq n ARG 432 Cb 0.46 -4.34 0.00 0.00 -1.02 0.00 0.00 32.46 27.57 1gkq n ARG 432 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gkq n GLY 433 N -2.09 1.73 3.42 -0.13 0.00 -0.80 -4.13 105.19 103.20 1gkq n GLY 433 Ca -0.31 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 1gkq n GLY 433 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gkq s LYS 434 N -0.25 3.53 0.06 1.61 2.20 -0.61 -4.74 119.74 121.54 1gkq s LYS 434 Ca 0.00 -0.59 -0.31 0.00 -0.36 0.00 0.00 55.97 54.72 1gkq s LYS 434 Cb 0.00 -2.86 -0.08 0.00 -1.51 0.00 0.00 37.83 33.38 1gkq s LYS 434 CO 0.00 0.14 1.57 0.08 -0.36 0.00 0.00 175.35 176.78 1gkq s VAL 435 N 0.60 3.19 -0.06 4.02 1.01 -1.26 -0.62 120.40 127.28 1gkq s VAL 435 Ca -0.04 0.65 0.09 0.00 0.00 0.00 0.00 61.98 62.68 1gkq s VAL 435 Cb -0.15 -3.42 -0.13 0.00 0.00 0.00 0.00 36.38 32.68 1gkq s VAL 435 CO 0.03 0.00 0.11 0.00 0.00 0.00 0.00 175.10 175.24 1gkq n ALA 436 N 5.36 2.03 -3.72 5.51 0.00 0.67 -4.55 120.51 125.82 1gkq n ALA 436 Ca 0.15 -0.45 -0.21 0.00 0.00 0.00 0.00 53.44 52.93 1gkq n ALA 436 Cb 0.41 -0.12 -0.17 0.00 0.00 0.00 0.00 19.45 19.57 1gkq n ALA 436 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1gkq s VAL 437 N -2.43 0.14 -0.15 0.00 1.01 -0.85 -0.59 120.40 117.53 1gkq s VAL 437 Ca -0.04 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1gkq s VAL 437 Cb 0.04 -0.33 0.03 0.00 0.00 0.00 0.00 36.38 36.12 1gkq s VAL 437 CO 0.40 0.21 -0.10 -0.60 0.00 0.00 0.00 175.10 175.00 1gkq s ARG 438 N 1.87 1.91 -1.38 2.72 3.52 -0.35 -1.27 118.95 125.97 1gkq s ARG 438 Ca 0.02 -0.52 -0.00 0.00 -0.13 0.00 0.00 55.73 55.09 1gkq s ARG 438 Cb -0.12 -2.01 -0.00 0.00 -1.56 0.00 0.00 34.95 31.25 1gkq s ARG 438 CO -0.04 -0.31 0.48 -0.25 -0.81 0.00 0.00 175.30 174.37 1gkq n ASP 439 N 4.82 -0.54 0.00 -2.12 8.00 0.80 -0.84 116.55 126.66 1gkq n ASP 439 Ca -0.15 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.38 1gkq n ASP 439 Cb 0.49 -3.25 0.00 0.00 -0.02 0.00 0.00 41.12 38.34 1gkq n ASP 439 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gkq n GLY 440 N -1.90 0.38 3.57 0.44 0.00 -1.24 -5.00 105.19 101.44 1gkq n GLY 440 Ca -0.31 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 1gkq n GLY 440 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gkq s GLN 441 N -0.69 3.73 -0.27 1.61 -1.52 -0.02 -5.07 119.66 117.41 1gkq s GLN 441 Ca 0.00 -0.43 -0.25 0.00 -1.95 0.00 0.00 55.36 52.72 1gkq s GLN 441 Cb 0.00 -3.02 0.00 0.00 -0.22 0.00 0.00 33.01 29.77 1gkq s GLN 441 CO 0.00 0.31 0.87 0.12 -0.25 0.00 0.00 175.29 176.34 1gkq s PHE 442 N 0.22 3.25 -0.13 0.91 5.36 -1.26 -1.21 117.98 125.12 1gkq s PHE 442 Ca 0.01 1.07 0.15 0.00 -0.96 0.00 0.00 56.93 57.20 1gkq s PHE 442 Cb -0.13 -3.23 0.37 0.00 -0.34 0.00 0.00 43.02 39.69 1gkq s PHE 442 CO 0.02 -0.52 1.18 1.33 -1.46 0.00 0.00 175.22 175.77 1gkq n VAL 443 N 5.45 1.41 -1.11 3.12 0.24 0.24 -5.00 118.33 122.68 1gkq n VAL 443 Ca 0.07 -2.25 -0.31 0.00 -2.04 0.00 0.00 64.34 59.80 1gkq n VAL 443 Cb 0.47 0.15 0.11 0.00 -1.47 0.00 0.00 33.84 33.10 1gkq n VAL 443 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1gkq s GLY 444 N -2.68 1.69 -0.23 7.63 0.00 -0.97 -4.71 107.32 108.05 1gkq s GLY 444 Ca 0.33 0.36 -0.07 0.00 0.00 0.00 0.00 44.72 45.35 1gkq s GLY 444 CO -0.08 0.73 0.05 1.85 0.00 0.00 0.00 173.10 175.65 1gkq s GLU 445 N -4.82 3.66 0.30 2.90 2.12 -1.26 -5.08 118.70 116.51 1gkq s GLU 445 Ca 0.63 -0.48 -0.30 0.00 0.36 0.00 0.00 54.97 55.18 1gkq s GLU 445 Cb -0.19 -3.26 -0.12 0.00 0.26 0.00 0.00 34.13 30.82 1gkq s GLU 445 CO 0.56 -0.12 1.46 1.63 -0.54 0.00 0.00 175.26 178.25 1gkq n LYS 446 N 4.70 2.38 -0.94 4.30 5.02 -1.26 -2.18 118.16 130.18 1gkq n LYS 446 Ca -0.16 0.84 0.00 0.00 -2.02 0.00 0.00 58.31 56.97 1gkq n LYS 446 Cb 0.51 -2.54 0.00 0.00 -0.02 0.00 0.00 35.03 32.99 1gkq n LYS 446 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gkq n GLY 447 N 1.67 0.67 0.25 0.72 0.00 -1.20 -4.88 105.19 102.42 1gkq n GLY 447 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 1gkq n GLY 447 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1gkq h TRP 448 N 0.00 0.68 -3.93 1.61 -0.00 -1.40 -3.43 115.95 109.48 1gkq h TRP 448 Ca 0.00 -0.15 -0.53 0.00 -0.00 0.00 0.00 58.89 58.20 1gkq h TRP 448 Cb 0.06 -0.16 0.10 0.00 -0.00 0.00 0.00 29.16 29.16 1gkq h TRP 448 CO 0.04 0.80 0.75 0.20 -0.00 0.00 0.00 178.44 180.22 1gkq s GLY 449 N -3.95 2.96 0.31 2.65 0.00 0.59 -4.88 107.32 104.99 1gkq s GLY 449 Ca -0.08 1.50 0.11 0.00 0.00 0.00 0.00 44.72 46.25 1gkq s GLY 449 CO 0.81 2.18 -0.13 0.54 0.00 0.00 0.00 173.10 176.49 1gkq s LYS 450 N -2.02 1.79 -0.08 2.90 -0.14 -1.26 -4.67 119.74 116.26 1gkq s LYS 450 Ca 0.52 -1.82 -0.26 0.00 -1.36 0.00 0.00 55.97 53.05 1gkq s LYS 450 Cb -0.45 -1.77 -0.03 0.00 -1.68 0.00 0.00 37.83 33.90 1gkq s LYS 450 CO 0.61 0.24 0.83 -1.17 -0.76 0.00 0.00 175.35 175.10 1gkq s LEU 451 N -3.57 4.29 -0.28 3.17 2.96 -1.26 -1.73 118.68 122.26 1gkq s LEU 451 Ca 0.31 1.33 -0.16 0.00 -0.22 0.00 0.00 54.13 55.39 1gkq s LEU 451 Cb -0.02 -3.28 -0.03 0.00 0.50 0.00 0.00 46.19 43.36 1gkq s LEU 451 CO 0.16 -0.25 0.44 -0.76 -1.32 0.00 0.00 176.35 174.62 1gkq s LEU 452 N 1.30 4.08 -0.09 -0.68 1.43 0.99 -4.94 118.68 120.77 1gkq s LEU 452 Ca 0.42 0.33 -0.13 0.00 -1.03 0.00 0.00 54.13 53.72 1gkq s LEU 452 Cb -0.18 -2.52 -0.05 0.00 0.03 0.00 0.00 46.19 43.47 1gkq s LEU 452 CO 0.19 -0.25 0.31 -0.13 0.23 0.00 0.00 176.35 176.70 1gkq s ARG 453 N 2.18 3.97 0.30 1.70 0.52 -1.26 -4.71 118.95 121.66 1gkq s ARG 453 Ca 0.17 0.18 0.09 0.00 -0.52 0.00 0.00 55.73 55.66 1gkq s ARG 453 Cb -0.16 -3.30 -0.05 0.00 0.52 0.00 0.00 34.95 31.96 1gkq s ARG 453 CO 0.10 0.51 0.03 1.03 0.02 0.00 0.00 175.30 176.99 1gkq s ARG 454 N -0.39 2.24 -0.14 3.54 3.00 0.11 -5.02 118.95 122.29 1gkq s ARG 454 Ca 0.19 -1.54 -0.04 0.00 0.00 0.00 0.00 55.73 54.34 1gkq s ARG 454 Cb -0.14 -2.10 -0.03 0.00 0.00 0.00 0.00 34.95 32.68 1gkq s ARG 454 CO 0.08 0.24 -0.00 -1.21 0.00 0.00 0.00 175.30 174.40 1gkq s GLU 455 N -3.72 3.51 0.45 3.54 0.41 -1.26 -4.51 118.70 117.11 1gkq s GLU 455 Ca 0.34 -0.45 -0.24 0.00 -0.41 0.00 0.00 54.97 54.21 1gkq s GLU 455 Cb -0.04 -2.94 -0.08 0.00 -1.78 0.00 0.00 34.13 29.30 1gkq s GLU 455 CO 0.20 0.40 1.32 -2.14 -0.49 0.00 0.00 175.26 174.56 1gkq s PRO 456 N -0.06 3.69 0.00 0.39 0.02 -1.26 -4.87 135.00 132.91 1gkq s PRO 456 Ca 0.03 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.23 1gkq s PRO 456 Cb -0.13 -2.57 0.00 0.00 0.02 0.00 0.00 34.50 31.82 1gkq s PRO 456 CO 0.02 -0.73 0.05 0.00 -0.33 0.00 0.00 177.00 176.01 1gkq n MET 457 N -0.29 0.00 -3.38 5.54 0.00 -0.91 -4.98 117.12 113.10 1gkq n MET 457 Ca 0.06 -0.05 -0.36 0.00 0.00 0.00 0.00 57.70 57.36 1gkq n MET 457 Cb 0.44 -0.46 -0.05 0.00 0.00 0.00 0.00 33.22 33.16 1gkq n MET 457 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1gkq n TYR 458 N 0.00 3.51 1.62 3.17 4.02 -0.26 -5.05 117.16 124.18 1gkq n TYR 458 Ca 0.00 -3.68 0.14 0.00 -0.01 0.00 0.00 57.90 54.36 1gkq n TYR 458 Cb 0.27 -1.02 0.63 0.00 -0.02 0.00 0.00 39.34 39.20 1gkq n TYR 458 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04