#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 2.07 -0.08 2.45 2.96 0.13 -1.39 118.68 124.82 1gkq s LEU 3 Ca 0.00 -0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 53.55 1gkq s LEU 3 Cb 0.00 -0.81 0.03 0.00 0.50 0.00 0.00 46.19 45.91 1gkq s LEU 3 CO 0.00 0.17 0.04 -0.22 -1.32 0.00 0.00 176.35 175.02 1gkq s LEU 4 N -0.57 0.38 -0.27 -0.68 2.96 -0.34 -0.46 118.68 119.69 1gkq s LEU 4 Ca 0.06 -0.11 -0.05 0.00 -0.22 0.00 0.00 54.13 53.80 1gkq s LEU 4 Cb -0.07 -0.28 0.01 0.00 0.50 0.00 0.00 46.19 46.35 1gkq s LEU 4 CO -0.00 -0.25 0.03 -0.63 -1.32 0.00 0.00 176.35 174.18 1gkq s ILE 5 N 2.08 3.63 0.23 6.68 1.01 -0.37 -0.46 121.20 134.00 1gkq s ILE 5 Ca 0.04 -0.73 0.12 0.00 0.00 0.00 0.00 60.65 60.08 1gkq s ILE 5 Cb -0.13 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.46 1gkq s ILE 5 CO -0.05 0.16 -0.22 -1.59 0.00 0.00 0.00 174.94 173.24 1gkq s LYS 6 N 1.46 1.58 -1.86 2.79 -2.85 -0.45 -0.90 119.74 119.50 1gkq s LYS 6 Ca 0.02 -1.64 0.00 0.00 -1.00 0.00 0.00 55.97 53.36 1gkq s LYS 6 Cb -0.17 -1.79 0.00 0.00 -2.06 0.00 0.00 37.83 33.81 1gkq s LYS 6 CO 0.00 0.36 0.00 0.09 0.10 0.00 0.00 175.35 175.90 1gkq n ASN 7 N -0.15 -5.32 -4.94 0.03 3.02 -1.26 -0.25 115.26 106.40 1gkq n ASN 7 Ca -0.09 0.30 -0.26 0.00 -0.03 0.00 0.00 54.58 54.51 1gkq n ASN 7 Cb 0.58 -4.44 -0.03 0.00 -0.61 0.00 0.00 39.78 35.28 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 -2.59 1.68 -0.47 7.41 0.00 -1.25 -3.09 107.32 109.01 1gkq s GLY 8 Ca 0.00 -1.05 -0.21 0.00 0.00 0.00 0.00 44.72 43.47 1gkq s GLY 8 CO 0.00 -1.05 0.68 1.85 0.00 0.00 0.00 173.10 174.58 1gkq s GLU 9 N -3.27 3.24 -0.02 2.90 2.12 -0.57 -3.34 118.70 119.76 1gkq s GLU 9 Ca 0.34 -0.51 -0.30 0.00 0.36 0.00 0.00 54.97 54.87 1gkq s GLU 9 Cb -0.11 -4.01 -0.03 0.00 0.26 0.00 0.00 34.13 30.24 1gkq s GLU 9 CO 0.28 -1.13 1.04 0.42 -0.54 0.00 0.00 175.26 175.33 1gkq s ILE 10 N 2.91 4.67 -0.12 -3.70 1.01 0.25 -0.98 121.20 125.24 1gkq s ILE 10 Ca 0.21 1.93 -0.01 0.00 0.00 0.00 0.00 60.65 62.78 1gkq s ILE 10 Cb -0.15 -4.24 0.04 0.00 0.01 0.00 0.00 42.46 38.11 1gkq s ILE 10 CO 0.17 0.10 -0.02 -0.63 0.00 0.00 0.00 174.94 174.56 1gkq s ILE 11 N 1.37 0.71 0.27 2.92 1.01 -0.74 -1.28 121.20 125.47 1gkq s ILE 11 Ca 0.52 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.93 1gkq s ILE 11 Cb -0.22 -0.90 0.00 0.00 0.01 0.00 0.00 42.46 41.36 1gkq s ILE 11 CO 0.25 0.18 0.01 0.35 0.00 0.00 0.00 174.94 175.73 1gkq n THR 12 N 5.03 0.00 0.26 2.92 -2.24 -0.37 -4.40 114.28 115.47 1gkq n THR 12 Ca -0.10 -1.28 0.11 0.00 -2.27 0.00 0.00 64.05 60.52 1gkq n THR 12 Cb 0.49 0.24 0.69 0.00 -2.10 0.00 0.00 70.33 69.65 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 1.12 1.34 0.00 6.98 0.00 -1.91 -3.27 119.26 123.53 1gkq h ALA 13 Ca -0.22 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1gkq h ALA 13 Cb 0.68 -0.02 -0.19 0.00 0.00 0.00 0.00 17.79 18.26 1gkq h ALA 13 CO 0.37 0.17 -0.72 -0.40 0.00 0.00 0.00 179.25 178.67 1gkq n ASP 14 N -3.74 1.06 -3.53 0.00 5.75 -1.26 -4.77 116.55 110.05 1gkq n ASP 14 Ca -0.02 -2.50 -0.15 0.00 -0.01 0.00 0.00 54.79 52.11 1gkq n ASP 14 Cb 0.24 -0.34 -0.05 0.00 -1.03 0.00 0.00 41.12 39.94 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 -2.13 -0.54 -0.24 -1.12 1.04 -1.23 -5.15 113.70 104.33 1gkq s SER 15 Ca 0.28 0.37 -0.06 0.00 0.48 0.00 0.00 55.95 57.01 1gkq s SER 15 Cb 0.29 0.52 0.12 0.00 0.10 0.00 0.00 66.02 67.06 1gkq s SER 15 CO -0.10 -0.70 0.49 -0.60 0.98 0.00 0.00 173.24 173.31 1gkq s ARG 16 N -2.09 0.42 0.20 4.02 3.52 -1.26 -1.24 118.95 122.52 1gkq s ARG 16 Ca -0.07 1.03 -0.23 0.00 -0.13 0.00 0.00 55.73 56.33 1gkq s ARG 16 Cb -0.01 0.33 0.06 0.00 -1.56 0.00 0.00 34.95 33.77 1gkq s ARG 16 CO 0.02 -0.36 0.91 1.52 -0.81 0.00 0.00 175.30 176.57 1gkq s TYR 17 N 2.70 -0.10 -0.16 5.12 1.13 -0.40 -4.99 117.35 120.65 1gkq s TYR 17 Ca 0.03 -0.28 -0.02 0.00 -1.41 0.00 0.00 57.07 55.39 1gkq s TYR 17 Cb -0.13 0.68 -0.01 0.00 -1.10 0.00 0.00 41.96 41.39 1gkq s TYR 17 CO -0.16 -0.98 -0.09 0.15 -2.51 0.00 0.00 175.55 171.96 1gkq s LYS 18 N -3.20 3.43 0.09 -3.49 1.02 -1.26 0.85 119.74 117.16 1gkq s LYS 18 Ca 0.13 -0.64 -0.26 0.00 0.02 0.00 0.00 55.97 55.23 1gkq s LYS 18 Cb -0.03 -2.79 0.09 0.00 -0.52 0.00 0.00 37.83 34.59 1gkq s LYS 18 CO 0.04 0.09 1.15 0.00 -0.92 0.00 0.00 175.35 175.72 1gkq s ALA 19 N 0.69 -1.98 0.10 5.17 0.00 -1.21 -4.88 121.76 119.65 1gkq s ALA 19 Ca -0.05 -0.04 0.03 0.00 0.00 0.00 0.00 51.96 51.91 1gkq s ALA 19 Cb -0.15 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 1gkq s ALA 19 CO 0.02 -1.09 0.13 -0.51 0.00 0.00 0.00 175.76 174.31 1gkq s ASP 20 N -3.45 5.71 -0.14 0.00 1.01 0.17 -3.99 116.67 115.98 1gkq s ASP 20 Ca 0.23 0.02 0.02 0.00 0.71 0.00 0.00 52.55 53.52 1gkq s ASP 20 Cb -0.01 -1.58 0.00 0.00 1.01 0.00 0.00 42.92 42.35 1gkq s ASP 20 CO 0.02 0.14 -0.20 -0.63 0.21 0.00 0.00 175.17 174.71 1gkq s ILE 21 N -1.51 2.27 -0.14 0.77 1.01 -0.08 -2.23 121.20 121.30 1gkq s ILE 21 Ca 0.31 -0.91 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1gkq s ILE 21 Cb -0.12 -1.92 0.01 0.00 0.01 0.00 0.00 42.46 40.44 1gkq s ILE 21 CO 0.24 0.54 -0.22 -0.47 0.00 0.00 0.00 174.94 175.03 1gkq s TYR 22 N 0.73 2.64 -0.23 3.97 5.04 -0.38 -1.24 117.35 127.87 1gkq s TYR 22 Ca -0.08 -1.32 0.02 0.00 -2.44 0.00 0.00 57.07 53.25 1gkq s TYR 22 Cb -0.16 -1.79 0.05 0.00 0.35 0.00 0.00 41.96 40.41 1gkq s TYR 22 CO 0.00 -0.60 -0.12 0.00 -1.34 0.00 0.00 175.55 173.50 1gkq s ALA 23 N 0.79 2.38 0.06 3.97 0.00 0.39 -0.05 121.76 129.30 1gkq s ALA 23 Ca -0.08 -1.54 -0.19 0.00 0.00 0.00 0.00 51.96 50.15 1gkq s ALA 23 Cb -0.16 -1.45 -0.12 0.00 0.00 0.00 0.00 23.12 21.39 1gkq s ALA 23 CO -0.01 -0.98 1.40 1.49 0.00 0.00 0.00 175.76 177.65 1gkq h GLU 24 N 7.85 0.43 0.00 0.00 4.81 -1.83 0.38 114.58 126.22 1gkq h GLU 24 Ca -0.25 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1gkq h GLU 24 Cb 1.07 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.45 1gkq h GLU 24 CO 0.49 0.75 0.00 0.41 -0.73 0.00 0.00 179.01 179.93 1gkq n GLY 25 N 0.07 2.20 0.14 1.92 0.00 -1.26 -3.30 105.19 104.96 1gkq n GLY 25 Ca -0.05 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 45.96 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 -6.16 1.61 5.08 -1.91 -3.38 114.58 109.82 1gkq h GLU 26 Ca 0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 1gkq h GLU 26 Cb 0.00 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.14 1gkq h GLU 26 CO 0.00 0.02 -0.66 0.95 -1.00 0.00 0.00 179.01 178.31 1gkq s THR 27 N -3.31 3.02 -0.07 1.13 -4.23 -1.26 -0.04 115.64 110.88 1gkq s THR 27 Ca 0.01 -2.04 -0.30 0.00 -1.18 0.00 0.00 61.69 58.19 1gkq s THR 27 Cb 0.08 -2.71 -0.04 0.00 1.34 0.00 0.00 72.50 71.17 1gkq s THR 27 CO 0.76 -0.33 1.43 -0.63 -0.54 0.00 0.00 174.62 175.31 1gkq s ILE 28 N -2.42 3.86 -0.15 2.99 1.01 -0.03 -3.92 121.20 122.55 1gkq s ILE 28 Ca 0.32 1.13 -0.21 0.00 0.00 0.00 0.00 60.65 61.88 1gkq s ILE 28 Cb -0.05 -3.73 -0.24 0.00 0.01 0.00 0.00 42.46 38.46 1gkq s ILE 28 CO 0.19 -0.06 0.49 0.74 0.00 0.00 0.00 174.94 176.29 1gkq h THR 29 N 5.31 1.19 -3.01 2.92 2.02 -0.82 -1.09 112.91 119.43 1gkq h THR 29 Ca -0.35 -2.31 -0.04 0.00 0.77 0.00 0.00 66.41 64.49 1gkq h THR 29 Cb 1.15 2.71 -0.13 0.00 -1.74 0.00 0.00 68.15 70.14 1gkq h THR 29 CO 0.94 0.54 0.09 0.00 0.37 0.00 0.00 175.52 177.46 1gkq s ARG 30 N -2.37 1.16 -0.02 6.66 1.70 -0.89 -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 0.53 0.01 0.00 -0.57 0.00 0.00 34.95 34.94 1gkq s ARG 30 CO 0.69 -0.47 -0.07 0.42 -1.08 0.00 0.00 175.30 174.79 1gkq s ILE 31 N -3.36 0.63 -0.35 4.99 1.01 -1.26 -1.25 121.20 121.62 1gkq s ILE 31 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.38 1gkq s ILE 31 Cb -0.00 -0.58 0.00 0.00 0.01 0.00 0.00 42.46 41.89 1gkq s ILE 31 CO -0.09 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.67 1gkq n GLY 32 N 3.40 -1.21 3.87 6.18 0.00 -0.95 -4.98 105.19 111.50 1gkq n GLY 32 Ca -0.19 -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 -1.80 3.64 -1.09 1.61 -0.21 -1.26 0.45 119.66 120.99 1gkq s GLN 33 Ca 0.00 0.04 -0.18 0.00 0.02 0.00 0.00 55.36 55.24 1gkq s GLN 33 Cb 0.00 -3.13 -0.01 0.00 1.00 0.00 0.00 33.01 30.87 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 1.46 -5.55 -4.81 5.90 3.02 -1.26 -4.94 115.26 109.08 1gkq n ASN 34 Ca -0.14 -0.94 -0.35 0.00 -0.03 0.00 0.00 54.58 53.12 1gkq n ASN 34 Cb 0.53 -3.51 -0.06 0.00 -0.61 0.00 0.00 39.78 36.13 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 -6.19 4.22 -0.32 3.41 1.43 -1.26 -5.04 118.68 114.93 1gkq s LEU 35 Ca 0.43 1.61 -0.10 0.00 -1.03 0.00 0.00 54.13 55.04 1gkq s LEU 35 Cb -0.15 -4.02 -0.01 0.00 0.03 0.00 0.00 46.19 42.05 1gkq s LEU 35 CO 0.85 -0.12 0.17 -1.61 0.23 0.00 0.00 176.35 175.87 1gkq s GLU 36 N -2.40 3.36 -0.06 1.70 2.02 -1.26 -5.08 118.70 116.98 1gkq s GLU 36 Ca 0.51 -0.71 -0.14 0.00 0.02 0.00 0.00 54.97 54.65 1gkq s GLU 36 Cb -0.15 -3.62 -0.05 0.00 0.10 0.00 0.00 34.13 30.41 1gkq s GLU 36 CO 0.20 -0.43 0.35 0.00 0.02 0.00 0.00 175.26 175.40 1gkq s ALA 37 N 1.64 3.68 0.91 5.21 0.00 -1.26 -5.06 121.76 126.88 1gkq s ALA 37 Ca 0.05 -0.33 -0.13 0.00 0.00 0.00 0.00 51.96 51.55 1gkq s ALA 37 Cb -0.17 -2.35 0.03 0.00 0.00 0.00 0.00 23.12 20.63 1gkq s ALA 37 CO 0.07 0.37 0.50 -0.35 0.00 0.00 0.00 175.76 176.36 1gkq n PRO 38 N 2.41 -0.19 -1.89 0.00 -0.04 -1.26 -4.83 135.00 129.19 1gkq n PRO 38 Ca -0.14 -0.01 -0.39 0.00 -0.04 0.00 0.00 63.50 62.92 1gkq n PRO 38 Cb 0.53 -1.91 0.02 0.00 -0.04 0.00 0.00 33.50 32.09 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 -3.59 3.63 0.00 0.54 0.04 -1.26 -2.54 135.00 131.82 1gkq s PRO 39 Ca 0.59 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.89 1gkq s PRO 39 Cb -0.24 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 31.74 1gkq s PRO 39 CO 0.65 -0.81 0.00 0.41 0.04 0.00 0.00 177.00 177.29 1gkq n GLY 40 N 0.63 2.86 3.75 0.56 0.00 -1.26 -5.05 105.19 106.68 1gkq n GLY 40 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1gkq n GLY 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gkq n THR 41 N -1.99 1.24 -2.69 2.61 -1.04 -1.05 -4.81 114.28 106.55 1gkq n THR 41 Ca 0.00 -0.31 -0.43 0.00 -2.04 0.00 0.00 64.05 61.27 1gkq n THR 41 Cb 0.00 -1.96 -0.02 0.00 -1.82 0.00 0.00 70.33 66.53 1gkq n THR 41 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1gkq s GLU 42 N -0.87 4.27 -0.21 -2.82 2.12 -0.49 -4.93 118.70 115.78 1gkq s GLU 42 Ca 0.62 1.31 -0.07 0.00 0.36 0.00 0.00 54.97 57.18 1gkq s GLU 42 Cb -0.49 -3.63 -0.04 0.00 0.26 0.00 0.00 34.13 30.23 1gkq s GLU 42 CO 0.52 -0.58 0.07 0.08 -0.54 0.00 0.00 175.26 174.80 1gkq s VAL 43 N 3.04 4.62 -0.18 3.70 1.01 -1.26 -1.20 120.40 130.14 1gkq s VAL 43 Ca 0.43 -0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.31 1gkq s VAL 43 Cb -0.15 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 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 0.86 3.26 -0.33 2.22 -1.09 0.39 -4.99 121.20 121.51 1gkq s ILE 44 Ca 0.04 -0.56 -0.18 0.00 -2.23 0.00 0.00 60.65 57.72 1gkq s ILE 44 Cb -0.14 -2.43 -0.01 0.00 -1.58 0.00 0.00 42.46 38.31 1gkq s ILE 44 CO 0.02 0.48 0.50 -0.62 -1.23 0.00 0.00 174.94 174.09 1gkq s ASP 45 N 0.89 6.32 -0.26 3.58 2.15 -1.26 -1.35 116.67 126.74 1gkq s ASP 45 Ca -0.02 0.05 0.13 0.00 0.43 0.00 0.00 52.55 53.14 1gkq s ASP 45 Cb -0.15 -2.26 0.75 0.00 -0.30 0.00 0.00 42.92 40.96 1gkq s ASP 45 CO 0.01 -0.44 1.71 0.00 -0.17 0.00 0.00 175.17 176.28 1gkq n ALA 46 N 5.69 3.98 -1.66 3.66 0.00 0.66 -4.95 120.51 127.88 1gkq n ALA 46 Ca -0.05 -2.15 -0.48 0.00 0.00 0.00 0.00 53.44 50.76 1gkq n ALA 46 Cb 0.49 -1.09 -0.05 0.00 0.00 0.00 0.00 19.45 18.81 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 0.16 0.14 -1.07 0.00 -1.04 -1.18 -1.08 114.28 110.21 1gkq n THR 47 Ca 0.31 -0.03 -0.02 0.00 -2.04 0.00 0.00 64.05 62.27 1gkq n THR 47 Cb 1.21 -1.51 -0.01 0.00 -1.82 0.00 0.00 70.33 68.20 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 0.55 3.33 3.41 0.00 -1.26 -5.02 105.19 109.75 1gkq n GLY 48 Ca 0.19 -0.32 -0.17 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.34 1.29 0.17 1.61 1.02 -0.24 -4.72 119.74 117.53 1gkq s LYS 49 Ca 0.00 -1.60 -0.05 0.00 0.02 0.00 0.00 55.97 54.34 1gkq s LYS 49 Cb 0.00 -0.88 -0.06 0.00 -0.52 0.00 0.00 37.83 36.37 1gkq s LYS 49 CO 0.00 0.07 0.41 0.71 -0.92 0.00 0.00 175.35 175.62 1gkq s TYR 50 N -3.17 3.47 -0.27 3.18 2.02 -0.40 -1.51 117.35 120.66 1gkq s TYR 50 Ca 0.23 0.59 0.02 0.00 -0.37 0.00 0.00 57.07 57.54 1gkq s TYR 50 Cb 0.02 -2.03 0.07 0.00 -0.40 0.00 0.00 41.96 39.62 1gkq s TYR 50 CO 0.06 0.39 -0.04 0.08 -1.57 0.00 0.00 175.55 174.47 1gkq s VAL 51 N -1.72 1.91 0.33 0.71 1.01 -0.15 0.17 120.40 122.66 1gkq s VAL 51 Ca 0.42 -1.65 0.07 0.00 0.00 0.00 0.00 61.98 60.82 1gkq s VAL 51 Cb -0.12 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 1gkq s VAL 51 CO 0.25 -0.22 0.32 -0.36 0.00 0.00 0.00 175.10 175.09 1gkq s PHE 52 N 1.18 2.97 0.55 5.22 0.08 -0.34 -1.79 117.98 125.84 1gkq s PHE 52 Ca -0.02 -0.27 -0.17 0.00 0.12 0.00 0.00 56.93 56.59 1gkq s PHE 52 Cb -0.19 -1.80 -0.06 0.00 -0.57 0.00 0.00 43.02 40.40 1gkq s PHE 52 CO -0.07 0.17 1.03 -2.14 -0.10 0.00 0.00 175.22 174.11 1gkq s PRO 53 N -4.02 3.62 0.25 0.24 0.02 -1.26 -1.60 135.00 132.25 1gkq s PRO 53 Ca 0.41 1.13 -0.31 0.00 0.02 0.00 0.00 61.00 62.25 1gkq s PRO 53 Cb -0.07 -2.08 -0.13 0.00 0.02 0.00 0.00 34.50 32.25 1gkq s PRO 53 CO 0.27 -0.56 1.49 0.41 -0.33 0.00 0.00 177.00 178.28 1gkq n GLY 54 N -1.10 1.01 3.81 0.52 0.00 -0.32 -4.59 105.19 104.52 1gkq n GLY 54 Ca 0.08 0.50 -0.33 0.00 0.00 0.00 0.00 46.02 46.27 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 3.19 -0.11 1.61 0.08 -0.98 -4.56 117.98 117.26 1gkq s PHE 55 Ca 0.68 1.55 0.02 0.00 0.12 0.00 0.00 56.93 59.30 1gkq s PHE 55 Cb -0.59 -2.93 0.01 0.00 -0.57 0.00 0.00 43.02 38.94 1gkq s PHE 55 CO 0.48 -0.55 -0.18 0.42 -0.10 0.00 0.00 175.22 175.29 1gkq s ILE 56 N -2.25 1.67 -0.40 0.64 1.01 -0.65 -1.09 121.20 120.13 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 -1.49 0.04 0.00 0.01 0.00 0.00 42.46 40.89 1gkq s ILE 56 CO 0.23 0.47 0.25 -0.62 0.00 0.00 0.00 174.94 175.28 1gkq s ASP 57 N 0.80 5.84 0.00 3.58 -1.08 -0.73 -4.49 116.67 120.59 1gkq s ASP 57 Ca -0.10 -1.10 0.19 0.00 -0.52 0.00 0.00 52.55 51.02 1gkq s ASP 57 Cb -0.16 -2.06 1.14 0.00 -1.46 0.00 0.00 42.92 40.38 1gkq s ASP 57 CO 0.01 -0.45 1.74 -0.81 0.52 0.00 0.00 175.17 176.17 1gkq n PRO 58 N 5.04 1.01 -3.34 4.34 -0.04 -1.26 -0.81 135.00 139.94 1gkq n PRO 58 Ca -0.11 -0.01 -0.14 0.00 -0.04 0.00 0.00 63.50 63.19 1gkq n PRO 58 Cb 0.45 -1.30 -0.07 0.00 -0.04 0.00 0.00 33.50 32.54 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 -2.00 -0.53 0.16 0.54 5.04 -1.23 -4.61 115.29 112.66 1gkq s HIS 59 Ca 0.29 -0.60 0.02 0.00 -1.54 0.00 0.00 55.06 53.23 1gkq s HIS 59 Cb 0.13 -0.30 -0.05 0.00 0.04 0.00 0.00 32.58 32.40 1gkq s HIS 59 CO 0.22 -1.00 -0.03 0.14 -2.34 0.00 0.00 174.74 171.74 1gkq s VAL 60 N 1.58 0.80 -0.21 0.89 -7.23 -0.84 -0.30 120.40 115.08 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 -0.14 -2.03 0.05 0.00 0.56 0.00 0.00 36.38 34.83 1gkq s VAL 60 CO -0.06 -0.57 -0.03 -1.00 -0.31 0.00 0.00 175.10 173.12 1gkq s HIS 61 N -3.57 1.90 0.00 2.82 3.76 -0.17 -1.93 115.29 118.10 1gkq s HIS 61 Ca 0.21 -1.37 0.00 0.00 -0.15 0.00 0.00 55.06 53.75 1gkq s HIS 61 Cb 0.05 -1.39 0.00 0.00 1.11 0.00 0.00 32.58 32.36 1gkq s HIS 61 CO 0.02 -0.70 0.00 -0.89 -0.85 0.00 0.00 174.74 172.33 1gkq n ILE 62 N 4.81 0.00 -3.05 0.60 2.08 -1.26 -4.56 119.36 117.97 1gkq n ILE 62 Ca -0.11 0.43 -0.41 0.00 0.56 0.00 0.00 62.75 63.21 1gkq n ILE 62 Cb 0.46 -1.42 -0.06 0.00 -0.75 0.00 0.00 39.64 37.86 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 -0.92 3.20 -0.25 1.39 5.04 -1.26 -4.45 117.35 120.09 1gkq s TYR 63 Ca 0.00 0.64 -0.02 0.00 -2.44 0.00 0.00 57.07 55.25 1gkq s TYR 63 Cb 0.00 -3.09 0.14 0.00 0.35 0.00 0.00 41.96 39.36 1gkq s TYR 63 CO 0.00 -0.53 0.39 -1.17 -1.34 0.00 0.00 175.55 172.90 1gkq s LEU 64 N 2.75 -0.67 -0.52 6.97 2.96 -1.26 -4.82 118.68 124.09 1gkq s LEU 64 Ca 0.28 0.10 -0.24 0.00 -0.22 0.00 0.00 54.13 54.05 1gkq s LEU 64 Cb -0.15 1.12 0.04 0.00 0.50 0.00 0.00 46.19 47.70 1gkq s LEU 64 CO 0.12 -0.31 0.91 -2.84 -1.32 0.00 0.00 176.35 172.91 1gkq s PRO 65 N 2.55 3.37 -0.10 0.98 0.02 -1.26 -1.68 135.00 138.88 1gkq s PRO 65 Ca 0.12 -0.19 -0.12 0.00 0.02 0.00 0.00 61.00 60.83 1gkq s PRO 65 Cb -0.15 -4.02 0.03 0.00 0.02 0.00 0.00 34.50 30.38 1gkq s PRO 65 CO -0.19 -1.39 0.32 0.12 -0.33 0.00 0.00 177.00 175.54 1gkq s PHE 66 N 3.79 -0.31 -1.26 6.54 5.36 0.14 -4.94 117.98 127.31 1gkq s PHE 66 Ca 0.31 0.72 -0.20 0.00 -0.96 0.00 0.00 56.93 56.80 1gkq s PHE 66 Cb -0.12 0.12 0.01 0.00 -0.34 0.00 0.00 43.02 42.69 1gkq s PHE 66 CO 0.21 -0.23 0.60 -1.33 -1.46 0.00 0.00 175.22 173.01 1gkq n MET 67 N 2.47 -1.23 -0.97 10.12 2.81 -1.26 -1.50 117.12 127.56 1gkq n MET 67 Ca -0.15 0.27 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 1gkq n MET 67 Cb 0.57 -3.58 0.00 0.00 -0.71 0.00 0.00 33.22 29.50 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 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1gkq n ALA 68 Cb 0.61 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.23 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 -2.38 0.00 -4.82 0.00 5.66 -0.56 -5.18 114.28 107.00 1gkq n THR 69 Ca 0.00 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.75 1gkq n THR 69 Cb 0.26 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 68.88 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 -5.02 1.56 0.51 1.09 0.40 -1.26 0.28 117.98 115.55 1gkq s PHE 70 Ca 0.00 -0.32 -0.23 0.00 -0.60 0.00 0.00 56.93 55.78 1gkq s PHE 70 Cb 0.00 -1.01 -0.06 0.00 0.51 0.00 0.00 43.02 42.46 1gkq s PHE 70 CO 0.00 -0.05 1.38 0.00 0.70 0.00 0.00 175.22 177.25 1gkq s ALA 71 N -0.33 2.96 0.23 5.36 0.00 -0.67 -4.96 121.76 124.35 1gkq s ALA 71 Ca 0.05 1.37 0.01 0.00 0.00 0.00 0.00 51.96 53.39 1gkq s ALA 71 Cb -0.07 -3.57 0.24 0.00 0.00 0.00 0.00 23.12 19.71 1gkq s ALA 71 CO -0.00 -1.30 1.58 0.87 0.00 0.00 0.00 175.76 176.90 1gkq h LYS 72 N 1.76 0.43 -7.24 0.00 1.79 -1.35 -3.44 116.57 108.51 1gkq h LYS 72 Ca -0.51 -0.25 -0.49 0.00 -2.18 0.00 0.00 60.65 57.22 1gkq h LYS 72 Cb 1.29 0.02 0.06 0.00 -1.58 0.00 0.00 32.23 32.02 1gkq h LYS 72 CO 0.59 0.83 0.38 -0.51 -1.08 0.00 0.00 179.45 179.65 1gkq s ASP 73 N -6.89 5.87 0.38 0.86 1.01 -1.26 -4.80 116.67 111.84 1gkq s ASP 73 Ca -0.06 1.70 0.08 0.00 0.71 0.00 0.00 52.55 54.98 1gkq s ASP 73 Cb 0.12 -2.52 -0.06 0.00 1.01 0.00 0.00 42.92 41.48 1gkq s ASP 73 CO 0.81 -1.11 0.06 0.42 0.21 0.00 0.00 175.17 175.57 1gkq s THR 74 N -2.68 2.40 0.55 -1.27 -4.23 -1.26 -4.50 115.64 104.65 1gkq s THR 74 Ca 0.61 -1.90 0.41 0.00 -1.18 0.00 0.00 61.69 59.64 1gkq s THR 74 Cb -0.14 -2.90 0.43 0.00 1.34 0.00 0.00 72.50 71.23 1gkq s THR 74 CO 0.41 -0.10 2.29 0.45 -0.54 0.00 0.00 174.62 177.13 1gkq h HIS 75 N 1.69 0.00 0.09 3.99 3.86 -1.86 0.44 115.15 123.36 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 0.69 0.01 -0.04 1.49 0.86 0.00 0.00 177.93 180.93 1gkq h GLU 76 N 0.00 -0.11 -0.19 2.45 4.81 -1.89 -2.51 114.58 117.14 1gkq h GLU 76 Ca -0.00 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 1gkq h GLU 76 Cb 0.11 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1gkq h GLU 76 CO 0.00 0.24 -0.34 1.79 -0.73 0.00 0.00 179.01 179.97 1gkq h THR 77 N -0.98 1.28 -0.02 0.32 1.35 -1.79 -2.58 112.91 110.49 1gkq h THR 77 Ca -0.01 -1.40 -0.00 0.00 -0.55 0.00 0.00 66.41 64.44 1gkq h THR 77 Cb 0.40 1.51 -0.00 0.00 -1.73 0.00 0.00 68.15 68.33 1gkq h THR 77 CO 0.02 0.43 -0.01 1.23 -0.25 0.00 0.00 175.52 176.95 1gkq h GLY 78 N 1.09 0.04 1.80 5.82 0.00 -0.26 -1.86 103.07 109.71 1gkq h GLY 78 Ca 0.04 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 1gkq h GLY 78 CO 0.06 0.03 -0.16 1.48 0.00 0.00 0.00 176.54 177.95 1gkq h SER 79 N -0.34 0.23 -0.11 0.19 4.64 -1.47 -1.21 113.55 115.48 1gkq h SER 79 Ca 0.00 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.25 1gkq h SER 79 Cb 0.41 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1gkq h SER 79 CO 0.00 0.42 -0.02 0.50 -0.87 0.00 0.00 176.83 176.86 1gkq h LYS 80 N 0.22 0.20 -0.79 4.77 3.64 -1.42 -1.69 116.57 121.51 1gkq h LYS 80 Ca 0.04 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1gkq h LYS 80 Cb 0.43 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.20 1gkq h LYS 80 CO 0.03 0.49 0.47 0.00 -2.27 0.00 0.00 179.45 178.17 1gkq h ALA 81 N 0.71 1.35 0.13 5.00 0.00 -1.08 -1.54 119.26 123.81 1gkq h ALA 81 Ca 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1gkq h ALA 81 Cb 0.41 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1gkq h ALA 81 CO 0.01 0.56 -0.06 0.00 0.00 0.00 0.00 179.25 179.76 1gkq h ALA 82 N 1.43 -0.17 -0.56 0.00 0.00 -1.05 -2.49 119.26 116.42 1gkq h ALA 82 Ca 0.28 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1gkq h ALA 82 Cb -0.04 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1gkq h ALA 82 CO -0.05 -0.57 0.33 -0.07 0.00 0.00 0.00 179.25 178.89 1gkq h LEU 83 N -0.22 0.52 -1.96 0.00 3.38 -0.94 -0.25 115.31 115.84 1gkq h LEU 83 Ca -0.02 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1gkq h LEU 83 Cb 0.17 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1gkq h LEU 83 CO 0.03 0.36 0.19 0.24 0.09 0.00 0.00 178.44 179.35 1gkq h MET 84 N 0.65 0.05 -0.01 1.13 2.86 -1.16 -0.38 114.93 118.07 1gkq h MET 84 Ca 0.23 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1gkq h MET 84 Cb 0.06 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1gkq h MET 84 CO -0.12 0.03 -0.19 0.41 1.06 0.00 0.00 176.91 178.10 1gkq n GLY 85 N -1.58 -0.67 0.00 8.32 0.00 -0.34 -4.63 105.19 106.29 1gkq n GLY 85 Ca 0.03 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 1.31 0.51 3.60 -0.02 0.00 -0.15 -4.51 105.19 105.92 1gkq n GLY 86 Ca 0.13 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 5.02 -0.95 2.61 2.01 -0.25 -2.31 115.64 119.77 1gkq s THR 87 Ca 0.00 0.71 0.20 0.00 0.31 0.00 0.00 61.69 62.91 1gkq s THR 87 Cb 0.00 -3.91 -0.22 0.00 0.01 0.00 0.00 72.50 68.38 1gkq s THR 87 CO 0.00 -0.06 0.86 0.35 -0.69 0.00 0.00 174.62 175.09 1gkq n THR 88 N 5.30 0.00 -3.78 -0.82 -2.24 -0.25 -2.82 114.28 109.67 1gkq n THR 88 Ca -0.04 -0.02 -0.13 0.00 -2.27 0.00 0.00 64.05 61.59 1gkq n THR 88 Cb 0.49 0.99 -0.13 0.00 -2.10 0.00 0.00 70.33 69.59 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 -1.15 -3.42 115.64 114.46 1gkq s THR 89 Ca 0.08 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.18 1gkq s THR 89 Cb 0.15 -0.28 -0.02 0.00 0.01 0.00 0.00 72.50 72.36 1gkq s THR 89 CO 0.84 0.03 -0.09 -0.72 -0.69 0.00 0.00 174.62 173.98 1gkq s TYR 90 N 0.58 0.80 -0.22 4.92 1.13 -1.19 -1.77 117.35 121.60 1gkq s TYR 90 Ca -0.04 -0.47 -0.03 0.00 -1.41 0.00 0.00 57.07 55.12 1gkq s TYR 90 Cb -0.05 -0.47 0.00 0.00 -1.10 0.00 0.00 41.96 40.33 1gkq s TYR 90 CO -0.03 -0.05 -0.07 0.42 -2.51 0.00 0.00 175.55 173.31 1gkq s ILE 91 N -1.29 3.09 0.01 -3.49 1.01 0.01 -2.55 121.20 118.00 1gkq s ILE 91 Ca -0.07 -0.63 -0.07 0.00 0.00 0.00 0.00 60.65 59.88 1gkq s ILE 91 Cb -0.10 -2.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 1gkq s ILE 91 CO 0.01 0.42 0.27 -0.70 0.00 0.00 0.00 174.94 174.94 1gkq s GLU 92 N 1.43 3.59 -0.43 2.79 2.12 -0.34 -1.99 118.70 125.86 1gkq s GLU 92 Ca 0.05 -0.07 -0.27 0.00 0.36 0.00 0.00 54.97 55.04 1gkq s GLU 92 Cb -0.14 -3.07 0.02 0.00 0.26 0.00 0.00 34.13 31.20 1gkq s GLU 92 CO -0.05 0.64 1.03 -1.64 -0.54 0.00 0.00 175.26 174.70 1gkq s MET 93 N -1.79 3.73 -0.50 4.30 -1.94 -0.81 -1.36 119.30 120.94 1gkq s MET 93 Ca 0.28 0.51 -0.28 0.00 -1.71 0.00 0.00 55.69 54.50 1gkq s MET 93 Cb -0.13 -3.87 0.03 0.00 2.01 0.00 0.00 34.83 32.87 1gkq s MET 93 CO 0.16 -1.20 1.08 0.00 -0.01 0.00 0.00 175.02 175.06 1gkq s PRO 96 N -3.05 4.25 0.87 0.00 0.04 -1.26 -4.91 135.00 130.94 1gkq s PRO 96 Ca 0.41 1.70 -0.15 0.00 0.04 0.00 0.00 61.00 63.00 1gkq s PRO 96 Cb 0.18 -2.75 0.20 0.00 0.04 0.00 0.00 34.50 32.17 1gkq s PRO 96 CO -0.04 -0.11 1.13 -1.13 0.04 0.00 0.00 177.00 176.89 1gkq n SER 97 N 0.30 -0.10 0.10 6.66 3.41 -1.26 -4.58 113.62 118.15 1gkq n SER 97 Ca 0.03 -1.38 0.06 0.00 -0.26 0.00 0.00 58.87 57.32 1gkq n SER 97 Cb 0.47 -0.88 0.52 0.00 -0.26 0.00 0.00 64.21 64.06 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 0.30 -0.00 4.33 2.43 -1.27 -2.23 114.38 117.94 1gkq h ARG 98 Ca -0.37 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.78 1gkq h ARG 98 Cb 1.03 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1gkq h ARG 98 CO 0.26 0.20 -0.08 0.09 -1.51 0.00 0.00 179.97 178.93 1gkq n ASN 99 N -4.50 0.43 -4.96 -3.80 3.02 -1.26 -4.88 115.26 99.31 1gkq n ASN 99 Ca 0.01 -0.64 -0.23 0.00 -0.03 0.00 0.00 54.58 53.70 1gkq n ASN 99 Cb 0.10 -0.08 -0.02 0.00 -0.61 0.00 0.00 39.78 39.17 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 -2.40 6.33 -0.15 6.41 1.01 -0.84 -5.06 116.67 121.97 1gkq s ASP 100 Ca 0.32 0.19 -0.26 0.00 0.71 0.00 0.00 52.55 53.51 1gkq s ASP 100 Cb 0.20 -1.91 -0.02 0.00 1.01 0.00 0.00 42.92 42.20 1gkq s ASP 100 CO 0.45 -0.08 0.86 -0.62 0.21 0.00 0.00 175.17 175.98 1gkq s ASP 101 N -3.77 7.02 0.13 0.27 2.15 -1.26 -4.83 116.67 116.37 1gkq s ASP 101 Ca 0.36 1.25 -0.20 0.00 0.43 0.00 0.00 52.55 54.38 1gkq s ASP 101 Cb -0.10 -2.47 -0.02 0.00 -0.30 0.00 0.00 42.92 40.03 1gkq s ASP 101 CO 0.30 -0.39 1.70 0.00 -0.17 0.00 0.00 175.17 176.61 1gkq h ALA 102 N 7.24 0.13 -0.82 3.66 0.00 -1.96 0.19 119.26 127.70 1gkq h ALA 102 Ca -0.30 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1gkq h ALA 102 Cb 1.14 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 1gkq h ALA 102 CO 0.83 -0.48 0.53 1.25 0.00 0.00 0.00 179.25 181.38 1gkq h LEU 103 N -0.01 0.95 -0.62 0.00 5.85 -1.93 0.43 115.31 119.98 1gkq h LEU 103 Ca 0.10 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 1gkq h LEU 103 Cb 0.17 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1gkq h LEU 103 CO -0.22 0.70 0.20 -0.33 -0.34 0.00 0.00 178.44 178.45 1gkq h GLU 104 N 1.12 0.97 -0.30 1.25 5.08 -1.89 -1.63 114.58 119.17 1gkq h GLU 104 Ca 0.30 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1gkq h GLU 104 Cb -0.11 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1gkq h GLU 104 CO -0.06 0.85 0.20 0.78 -1.00 0.00 0.00 179.01 179.78 1gkq h GLY 105 N 0.89 0.43 0.72 -3.84 0.00 -0.19 0.24 103.07 101.33 1gkq h GLY 105 Ca 0.20 -0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.40 1gkq h GLY 105 CO -0.01 0.16 -0.02 -1.82 0.00 0.00 0.00 176.54 174.85 1gkq h TYR 106 N 0.41 -0.05 -0.11 5.60 3.20 -0.75 -1.94 116.97 123.33 1gkq h TYR 106 Ca 0.11 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 1gkq h TYR 106 Cb -0.04 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 1gkq h TYR 106 CO -0.05 -0.05 -0.07 1.96 -1.64 0.00 0.00 178.16 178.31 1gkq h GLN 107 N 0.02 0.16 0.11 1.82 4.20 -0.95 0.20 115.11 120.67 1gkq h GLN 107 Ca 0.07 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1gkq h GLN 107 Cb 0.10 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1gkq h GLN 107 CO -0.14 0.25 -0.05 1.25 -0.67 0.00 0.00 178.83 179.46 1gkq h LEU 108 N 0.16 -0.12 -0.62 1.46 5.85 -0.39 -1.07 115.31 120.58 1gkq h LEU 108 Ca 0.04 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.49 1gkq h LEU 108 Cb 0.23 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1gkq h LEU 108 CO 0.01 0.22 0.41 -0.50 -0.34 0.00 0.00 178.44 178.24 1gkq h TRP 109 N -0.48 0.78 -0.77 1.25 6.55 -1.11 -1.74 115.95 120.43 1gkq h TRP 109 Ca -0.01 0.02 0.01 0.00 0.95 0.00 0.00 58.89 59.85 1gkq h TRP 109 Cb 0.39 -0.26 -0.04 0.00 -0.86 0.00 0.00 29.16 28.39 1gkq h TRP 109 CO 0.03 0.49 0.51 -0.22 -1.05 0.00 0.00 178.44 178.20 1gkq h LYS 110 N 0.84 1.00 0.00 0.49 3.64 -0.91 -2.70 116.57 118.93 1gkq h LYS 110 Ca 0.23 -0.06 -0.13 0.00 -1.27 0.00 0.00 60.65 59.42 1gkq h LYS 110 Cb -0.10 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.48 1gkq h LYS 110 CO -0.05 0.66 -0.61 0.66 -2.27 0.00 0.00 179.45 177.85 1gkq h SER 111 N 1.03 0.00 0.62 4.20 4.64 -0.93 -2.79 113.55 120.32 1gkq h SER 111 Ca 0.29 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.55 1gkq h SER 111 Cb -0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 1gkq h SER 111 CO -0.07 0.61 -0.28 0.11 -0.87 0.00 0.00 176.83 176.32 1gkq h LYS 112 N 0.00 0.00 0.08 4.77 1.57 -1.03 -3.18 116.57 118.77 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 1.35 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.64 1gkq h LYS 112 CO 0.08 0.28 -1.66 0.00 -0.57 0.00 0.00 179.45 177.59 1gkq h ALA 113 N 1.72 0.46 -2.00 3.86 0.00 -1.40 -3.43 119.26 118.47 1gkq h ALA 113 Ca -0.00 -1.27 -0.63 0.00 0.00 0.00 0.00 54.91 53.01 1gkq h ALA 113 Cb 0.67 0.41 0.05 0.00 0.00 0.00 0.00 17.79 18.92 1gkq h ALA 113 CO 0.04 1.32 0.75 0.39 0.00 0.00 0.00 179.25 181.75 1gkq n GLU 114 N -3.33 1.78 -0.86 0.00 1.02 -1.06 -1.14 120.64 117.04 1gkq n GLU 114 Ca -0.19 0.64 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 1gkq n GLU 114 Cb 1.04 -2.38 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 3.37 0.20 0.10 0.62 0.00 -1.26 -4.79 105.19 103.42 1gkq n GLY 115 Ca 0.19 0.00 0.02 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 -0.43 0.91 -4.66 1.61 3.02 -0.29 -3.21 115.26 112.20 1gkq n ASN 116 Ca 0.00 -0.96 -0.35 0.00 -0.03 0.00 0.00 54.58 53.25 1gkq n ASN 116 Cb 0.22 0.34 -0.10 0.00 -0.61 0.00 0.00 39.78 39.63 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 -0.64 5.45 0.45 6.41 0.15 -1.18 -2.75 113.70 121.58 1gkq s SER 117 Ca 0.03 0.12 0.24 0.00 0.70 0.00 0.00 55.95 57.04 1gkq s SER 117 Cb 0.03 -1.78 0.51 0.00 -1.71 0.00 0.00 66.02 63.08 1gkq s SER 117 CO 0.08 0.27 1.67 1.88 1.20 0.00 0.00 173.24 178.34 1gkq h TYR 118 N 5.95 0.00 -3.57 3.44 0.05 -1.83 0.13 116.97 121.14 1gkq h TYR 118 Ca -0.43 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.00 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 0.04 -0.64 0.00 -1.05 0.00 0.00 178.16 177.12 1gkq s ASP 120 N -3.29 4.33 0.34 0.00 1.01 -1.22 -4.18 116.67 113.66 1gkq s ASP 120 Ca 0.31 1.95 -0.18 0.00 0.71 0.00 0.00 52.55 55.34 1gkq s ASP 120 Cb 0.07 -2.54 0.04 0.00 1.01 0.00 0.00 42.92 41.50 1gkq s ASP 120 CO 0.10 -2.15 0.77 -0.72 0.21 0.00 0.00 175.17 173.37 1gkq s TYR 121 N -2.71 0.00 0.32 4.23 1.13 -0.66 -3.19 117.35 116.47 1gkq s TYR 121 Ca 0.64 -0.59 -0.18 0.00 -1.41 0.00 0.00 57.07 55.53 1gkq s TYR 121 Cb -0.19 0.79 0.06 0.00 -1.10 0.00 0.00 41.96 41.52 1gkq s TYR 121 CO 0.53 -1.43 0.88 -0.08 -2.51 0.00 0.00 175.55 172.94 1gkq s THR 122 N -2.91 0.00 0.23 -3.49 -1.32 -1.06 -0.07 115.64 107.02 1gkq s THR 122 Ca 0.14 -0.85 0.06 0.00 -1.21 0.00 0.00 61.69 59.82 1gkq s THR 122 Cb -0.05 -2.92 -0.05 0.00 -1.51 0.00 0.00 72.50 67.97 1gkq s THR 122 CO 0.10 0.00 -0.07 -0.36 -2.21 0.00 0.00 174.62 172.08 1gkq s PHE 123 N -2.21 1.68 -0.16 9.09 0.08 -1.26 -1.20 117.98 124.00 1gkq s PHE 123 Ca 0.18 -0.74 -0.01 0.00 0.12 0.00 0.00 56.93 56.47 1gkq s PHE 123 Cb -0.04 -0.91 -0.01 0.00 -0.57 0.00 0.00 43.02 41.49 1gkq s PHE 123 CO 0.09 0.18 -0.10 -1.01 -0.10 0.00 0.00 175.22 174.28 1gkq s HIS 124 N -3.17 2.87 -0.38 0.36 3.76 -0.46 -4.62 115.29 113.65 1gkq s HIS 124 Ca 0.26 -0.74 -0.21 0.00 -0.15 0.00 0.00 55.06 54.21 1gkq s HIS 124 Cb 0.03 -1.93 0.01 0.00 1.11 0.00 0.00 32.58 31.80 1gkq s HIS 124 CO 0.08 -0.31 0.68 1.41 -0.85 0.00 0.00 174.74 175.74 1gkq s MET 125 N 0.70 3.61 0.25 1.40 1.75 -0.14 -0.90 119.30 125.97 1gkq s MET 125 Ca -0.05 0.02 -0.30 0.00 -1.25 0.00 0.00 55.69 54.12 1gkq s MET 125 Cb -0.15 -3.84 -0.09 0.00 2.84 0.00 0.00 34.83 33.59 1gkq s MET 125 CO 0.02 -0.83 1.15 0.00 -0.65 0.00 0.00 175.02 174.71 1gkq s ALA 126 N 2.85 3.42 -0.48 4.11 0.00 -0.54 -4.26 121.76 126.85 1gkq s ALA 126 Ca 0.26 0.94 0.01 0.00 0.00 0.00 0.00 51.96 53.17 1gkq s ALA 126 Cb -0.14 -3.37 0.13 0.00 0.00 0.00 0.00 23.12 19.74 1gkq s ALA 126 CO 0.16 -0.27 0.25 0.08 0.00 0.00 0.00 175.76 175.98 1gkq s VAL 127 N -0.78 2.91 -0.78 0.00 1.01 -1.26 -4.77 120.40 116.74 1gkq s VAL 127 Ca 0.48 -2.79 0.13 0.00 0.00 0.00 0.00 61.98 59.80 1gkq s VAL 127 Cb -0.33 -3.01 0.63 0.00 0.00 0.00 0.00 36.38 33.68 1gkq s VAL 127 CO 0.40 -0.75 1.49 -1.54 0.00 0.00 0.00 175.10 174.70 1gkq n SER 128 N 3.72 4.43 0.00 3.32 3.41 -1.26 -4.66 113.62 122.58 1gkq n SER 128 Ca 0.04 -2.57 0.00 0.00 -0.26 0.00 0.00 58.87 56.08 1gkq n SER 128 Cb 0.37 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 1gkq n SER 128 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1gkq n LYS 129 N 0.68 0.00 -3.74 4.33 2.85 -1.26 -4.35 118.16 116.66 1gkq n LYS 129 Ca 0.22 0.00 -0.15 0.00 -1.05 0.00 0.00 58.31 57.33 1gkq n LYS 129 Cb 0.89 0.00 -0.16 0.00 -0.65 0.00 0.00 35.03 35.12 1gkq n LYS 129 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 1gkq s PHE 130 N -2.00 -0.06 0.27 5.58 2.19 -1.26 -5.00 117.98 117.70 1gkq s PHE 130 Ca 0.00 0.32 -0.21 0.00 0.33 0.00 0.00 56.93 57.37 1gkq s PHE 130 Cb 0.00 -0.20 0.04 0.00 -1.31 0.00 0.00 43.02 41.54 1gkq s PHE 130 CO 0.00 -0.14 0.80 0.16 1.83 0.00 0.00 175.22 177.87 1gkq s ASP 131 N 1.31 -0.18 0.20 6.13 1.47 -1.26 -4.98 116.67 119.36 1gkq s ASP 131 Ca -0.07 -0.67 -0.14 0.00 1.18 0.00 0.00 52.55 52.85 1gkq s ASP 131 Cb -0.12 0.69 0.20 0.00 -0.34 0.00 0.00 42.92 43.35 1gkq s ASP 131 CO -0.04 -1.30 1.65 -0.33 0.68 0.00 0.00 175.17 175.83 1gkq h GLU 132 N 2.00 0.03 -0.23 2.11 3.07 -2.00 -0.13 114.58 119.43 1gkq h GLU 132 Ca -0.23 -0.00 0.05 0.00 -0.50 0.00 0.00 59.36 58.68 1gkq h GLU 132 Cb 1.24 -0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 29.10 1gkq h GLU 132 CO 0.27 0.02 -0.08 -0.22 -1.40 0.00 0.00 179.01 177.60 1gkq h LYS 133 N 0.03 -0.04 -0.75 2.33 3.64 -2.00 -2.56 116.57 117.22 1gkq h LYS 133 Ca 0.27 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.60 1gkq h LYS 133 Cb 0.42 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 1gkq h LYS 133 CO -0.53 -0.02 0.26 1.15 -2.27 0.00 0.00 179.45 178.03 1gkq h THR 134 N -0.04 1.26 -0.60 1.00 2.02 -1.70 -2.72 112.91 112.14 1gkq h THR 134 Ca 0.11 -0.87 0.05 0.00 0.77 0.00 0.00 66.41 66.48 1gkq h THR 134 Cb 0.21 0.41 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 1gkq h THR 134 CO -0.25 0.35 0.32 -0.08 0.37 0.00 0.00 175.52 176.22 1gkq h GLU 135 N 1.10 0.59 -0.94 6.66 4.81 -0.72 0.72 114.58 126.79 1gkq h GLU 135 Ca 0.25 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1gkq h GLU 135 Cb 0.27 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.47 1gkq h GLU 135 CO -0.01 0.39 0.57 0.78 -0.73 0.00 0.00 179.01 180.00 1gkq h GLY 136 N 0.60 1.37 1.59 1.92 0.00 -1.24 -1.84 103.07 105.47 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 -0.17 0.55 -0.57 1.46 0.00 0.00 0.00 176.54 177.81 1gkq h GLN 137 N 1.30 0.43 -0.57 4.80 4.20 -1.05 -2.91 115.11 121.31 1gkq h GLN 137 Ca 0.34 -0.28 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 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 0.88 0.04 -0.07 -0.67 0.00 0.00 178.83 178.94 1gkq h LEU 138 N 0.32 0.91 -1.32 1.46 3.38 -0.41 -0.33 115.31 119.32 1gkq h LEU 138 Ca 0.00 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1gkq h LEU 138 Cb 1.09 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1gkq h LEU 138 CO 0.10 0.95 0.17 0.03 0.09 0.00 0.00 178.44 179.78 1gkq h ARG 139 N 0.88 0.64 -0.17 1.13 3.08 -1.25 -0.03 114.38 118.65 1gkq h ARG 139 Ca 0.17 -0.09 -0.13 0.00 0.07 0.00 0.00 59.98 60.00 1gkq h ARG 139 Cb 0.47 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1gkq h ARG 139 CO 0.02 0.54 -0.40 1.49 -1.07 0.00 0.00 179.97 180.55 1gkq h GLU 140 N 0.63 0.58 -0.70 0.04 4.81 -1.20 -2.01 114.58 116.73 1gkq h GLU 140 Ca 0.15 -0.39 -0.06 0.00 -0.13 0.00 0.00 59.36 58.94 1gkq h GLU 140 Cb 0.14 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 1gkq h GLU 140 CO -0.01 1.00 0.19 0.82 -0.73 0.00 0.00 179.01 180.28 1gkq h ILE 141 N 0.23 1.26 -0.46 2.32 2.04 -0.66 -1.85 117.51 120.40 1gkq h ILE 141 Ca -0.00 -0.92 -0.03 0.00 1.00 0.00 0.00 64.86 64.90 1gkq h ILE 141 Cb 1.00 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1gkq h ILE 141 CO 0.09 0.36 0.16 0.58 0.00 0.00 0.00 178.15 179.34 1gkq h VAL 142 N 1.03 1.21 0.00 1.67 2.07 -1.02 -1.79 116.25 119.43 1gkq h VAL 142 Ca 0.22 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 1gkq h VAL 142 Cb 0.34 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1gkq h VAL 142 CO -0.00 0.25 -0.00 0.00 0.02 0.00 0.00 177.57 177.84 1gkq h ALA 143 N 1.01 1.03 -0.16 1.67 0.00 -0.95 0.61 119.26 122.48 1gkq h ALA 143 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1gkq h ALA 143 Cb 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 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 -3.13 1.17 0.00 0.00 2.03 -0.68 -4.89 116.55 111.05 1gkq n ASP 144 Ca -0.03 -1.76 0.00 0.00 0.52 0.00 0.00 54.79 53.52 1gkq n ASP 144 Cb 0.10 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 0.63 3.51 0.27 0.00 0.20 -4.87 105.19 105.88 1gkq n GLY 145 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 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 4.82 -0.59 -0.61 -1.09 -1.16 -0.21 121.20 120.35 1gkq s ILE 146 Ca 0.00 0.02 0.16 0.00 -2.23 0.00 0.00 60.65 58.60 1gkq s ILE 146 Cb 0.00 -4.23 0.74 0.00 -1.58 0.00 0.00 42.46 37.38 1gkq s ILE 146 CO 0.00 -0.65 1.65 -1.54 -1.23 0.00 0.00 174.94 173.18 1gkq n SER 147 N 6.29 5.07 -3.89 3.58 3.41 -1.26 -4.04 113.62 122.78 1gkq n SER 147 Ca -0.02 -2.73 -0.12 0.00 -0.26 0.00 0.00 58.87 55.73 1gkq n SER 147 Cb 0.47 -0.62 -0.14 0.00 -0.26 0.00 0.00 64.21 63.67 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 -0.99 0.08 0.00 4.04 1.04 -1.26 -2.47 113.70 114.14 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 0.37 -0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1gkq s SER 148 CO 0.18 -0.01 0.00 0.49 0.98 0.00 0.00 173.24 174.88 1gkq n PHE 149 N 2.96 0.00 -3.58 5.02 3.72 -0.55 -0.96 117.46 124.07 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 -0.04 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 3.06 0.00 -0.11 4.37 -4.36 -0.65 -1.54 121.20 121.98 1gkq s ILE 151 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 60.65 60.42 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 -0.20 -0.36 0.24 0.00 0.00 174.94 174.62 1gkq s PHE 152 N -1.85 2.64 -0.89 1.37 0.40 -1.26 -1.72 117.98 116.67 1gkq s PHE 152 Ca 0.04 -0.87 0.01 0.00 -0.60 0.00 0.00 56.93 55.51 1gkq s PHE 152 Cb -0.01 -1.75 0.31 0.00 0.51 0.00 0.00 43.02 42.09 1gkq s PHE 152 CO -0.04 -0.32 1.43 1.28 0.70 0.00 0.00 175.22 178.27 1gkq n LEU 153 N 3.45 6.10 0.00 -0.37 4.77 0.24 -2.62 117.00 128.57 1gkq n LEU 153 Ca -0.19 -5.43 0.00 0.00 -0.03 0.00 0.00 56.01 50.36 1gkq n LEU 153 Cb 0.53 -0.99 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 1gkq n LEU 153 CO 0.29 2.05 0.00 -1.54 -1.33 0.00 0.00 177.39 176.86 1gkq n SER 154 N 0.28 0.00 -3.18 -1.43 3.41 -1.26 -1.74 113.62 109.70 1gkq n SER 154 Ca 0.37 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.86 1gkq n SER 154 Cb 0.32 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.33 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 -0.04 -2.52 -1.61 7.33 4.01 -1.26 -1.88 117.16 121.20 1gkq n TYR 155 Ca 0.00 0.90 -0.47 0.00 -0.16 0.00 0.00 57.90 58.16 1gkq n TYR 155 Cb 0.00 -4.09 -0.04 0.00 -0.31 0.00 0.00 39.34 34.90 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 -2.92 1.46 -0.26 -0.72 4.81 -1.26 -1.70 118.16 117.57 1gkq n LYS 156 Ca -0.06 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 1gkq n LYS 156 Cb 0.59 -2.07 0.00 0.00 0.02 0.00 0.00 35.03 33.58 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 2.05 0.00 -0.05 3.14 3.02 -1.26 -4.69 115.26 117.46 1gkq n ASN 157 Ca 0.14 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.58 1gkq n ASN 157 Cb 0.27 -1.01 -0.03 0.00 -0.61 0.00 0.00 39.78 38.39 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 -0.92 -4.67 117.46 112.97 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 -0.36 0.00 0.00 -0.00 0.00 0.00 39.48 39.12 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 -3.52 0.00 -1.84 -5.13 0.99 -0.69 -1.01 117.46 106.26 1gkq n PHE 159 Ca -0.19 0.00 -0.41 0.00 -0.00 0.00 0.00 57.45 56.85 1gkq n PHE 159 Cb 0.59 0.00 -0.01 0.00 -1.00 0.00 0.00 39.48 39.06 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 -2.93 2.49 0.11 1.37 0.00 -0.74 -4.34 107.32 103.27 1gkq s GLY 160 Ca 0.00 1.52 0.06 0.00 0.00 0.00 0.00 44.72 46.29 1gkq s GLY 160 CO 0.00 2.37 -0.03 -1.34 0.00 0.00 0.00 173.10 174.10 1gkq s VAL 161 N -0.46 3.79 0.81 1.40 -7.23 -1.08 -4.54 120.40 113.10 1gkq s VAL 161 Ca 0.58 -1.13 -0.06 0.00 -1.81 0.00 0.00 61.98 59.56 1gkq s VAL 161 Cb -0.46 -2.82 0.16 0.00 0.56 0.00 0.00 36.38 33.82 1gkq s VAL 161 CO 0.53 0.08 1.11 1.51 -0.31 0.00 0.00 175.10 178.02 1gkq s ASP 162 N -2.38 3.88 0.31 4.85 1.47 -1.26 -4.79 116.67 118.75 1gkq s ASP 162 Ca 0.25 -0.19 0.02 0.00 1.18 0.00 0.00 52.55 53.81 1gkq s ASP 162 Cb -0.11 -0.05 0.58 0.00 -0.34 0.00 0.00 42.92 43.00 1gkq s ASP 162 CO 0.17 -2.19 1.90 0.44 0.68 0.00 0.00 175.17 176.17 1gkq h ASP 163 N -0.93 0.87 -0.41 2.11 5.19 -2.00 0.85 116.42 122.11 1gkq h ASP 163 Ca -0.39 0.02 -0.04 0.00 -0.62 0.00 0.00 57.03 56.00 1gkq h ASP 163 Cb 1.25 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 40.58 1gkq h ASP 163 CO 0.38 0.53 0.11 1.23 -3.12 0.00 0.00 179.24 178.37 1gkq h GLY 164 N 0.97 0.70 1.19 2.75 0.00 -1.99 -0.46 103.07 106.22 1gkq h GLY 164 Ca 0.41 -0.43 -0.15 0.00 0.00 0.00 0.00 47.33 47.16 1gkq h GLY 164 CO -0.17 0.40 -0.33 0.83 0.00 0.00 0.00 176.54 177.28 1gkq h GLU 165 N 0.52 0.91 -0.55 4.80 5.08 -1.76 -2.29 114.58 121.28 1gkq h GLU 165 Ca 0.13 -0.44 -0.02 0.00 -1.00 0.00 0.00 59.36 58.03 1gkq h GLU 165 Cb 0.30 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1gkq h GLU 165 CO 0.00 1.09 0.27 1.98 -1.00 0.00 0.00 179.01 181.35 1gkq h MET 166 N 0.76 0.79 -0.32 2.33 4.05 -0.71 -0.14 114.93 121.68 1gkq h MET 166 Ca 0.08 -0.12 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1gkq h MET 166 Cb 0.90 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.54 1gkq h MET 166 CO 0.08 0.65 0.21 -0.92 0.23 0.00 0.00 176.91 177.16 1gkq h TYR 167 N 0.74 0.42 -0.71 1.39 5.03 -0.95 -1.06 116.97 121.83 1gkq h TYR 167 Ca 0.19 0.00 -0.07 0.00 2.58 0.00 0.00 58.73 61.43 1gkq h TYR 167 Cb 0.12 -0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.23 1gkq h TYR 167 CO -0.00 0.28 0.17 1.96 -1.32 0.00 0.00 178.16 179.25 1gkq h GLN 168 N 0.43 1.13 -0.67 1.82 4.20 -1.15 -1.28 115.11 119.59 1gkq h GLN 168 Ca 0.12 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 1gkq h GLN 168 Cb -0.02 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.58 1gkq h GLN 168 CO -0.02 1.00 0.37 1.15 -0.67 0.00 0.00 178.83 180.66 1gkq h THR 169 N 1.07 1.21 -0.50 -0.54 2.02 -0.74 -1.61 112.91 113.82 1gkq h THR 169 Ca 0.22 -0.52 -0.11 0.00 0.77 0.00 0.00 66.41 66.77 1gkq h THR 169 Cb 0.38 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1gkq h THR 169 CO 0.00 0.23 -0.13 -0.07 0.37 0.00 0.00 175.52 175.92 1gkq h LEU 170 N 0.92 0.95 -0.56 2.58 4.07 -0.92 -0.44 115.31 121.91 1gkq h LEU 170 Ca 0.24 -0.32 -0.06 0.00 0.08 0.00 0.00 57.88 57.82 1gkq h LEU 170 Cb 0.03 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.49 1gkq h LEU 170 CO -0.04 1.08 0.12 0.03 -1.08 0.00 0.00 178.44 178.55 1gkq h ARG 171 N 0.84 0.90 -0.51 1.13 2.47 -1.00 -0.98 114.38 117.23 1gkq h ARG 171 Ca 0.13 -0.23 -0.03 0.00 -1.26 0.00 0.00 59.98 58.59 1gkq h ARG 171 Cb 0.68 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.86 1gkq h ARG 171 CO 0.05 0.85 0.19 1.25 0.56 0.00 0.00 179.97 182.87 1gkq h LEU 172 N 0.80 0.71 -0.76 3.04 5.85 -1.18 -1.55 115.31 122.23 1gkq h LEU 172 Ca 0.17 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1gkq h LEU 172 Cb 0.37 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 1gkq h LEU 172 CO 0.00 0.70 0.48 0.00 -0.34 0.00 0.00 178.44 179.28 1gkq h ALA 173 N 1.04 1.00 -0.69 1.25 0.00 -0.77 -0.17 119.26 120.92 1gkq h ALA 173 Ca 0.17 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1gkq h ALA 173 Cb 0.22 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1gkq h ALA 173 CO -0.01 0.26 0.24 -0.22 0.00 0.00 0.00 179.25 179.52 1gkq h LYS 174 N 0.92 1.05 -0.50 0.00 3.11 -0.89 0.30 116.57 120.56 1gkq h LYS 174 Ca 0.31 -0.21 -0.05 0.00 -2.81 0.00 0.00 60.65 57.89 1gkq h LYS 174 Cb 0.04 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.09 1gkq h LYS 174 CO -0.12 0.90 0.14 1.49 -2.81 0.00 0.00 179.45 179.04 1gkq h GLU 175 N 1.00 0.80 -0.00 1.90 4.81 -0.54 -2.91 114.58 119.63 1gkq h GLU 175 Ca 0.22 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1gkq h GLU 175 Cb 0.27 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1gkq h GLU 175 CO -0.01 0.76 -0.16 1.28 -0.73 0.00 0.00 179.01 180.15 1gkq n LEU 176 N -4.47 0.44 -0.49 1.64 4.77 -0.15 -4.93 117.00 113.82 1gkq n LEU 176 Ca 0.02 0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 56.01 1gkq n LEU 176 Cb 0.21 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 1gkq n LEU 176 CO 0.39 0.09 -0.06 0.61 -1.33 0.00 0.00 177.39 177.09 1gkq n GLY 177 N 1.35 0.50 3.84 -0.72 0.00 0.48 -4.73 105.19 105.91 1gkq n GLY 177 Ca 0.12 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.22 4.82 -0.07 1.61 1.01 0.77 -1.27 120.40 125.05 1gkq s VAL 178 Ca 0.00 0.89 -0.13 0.00 0.00 0.00 0.00 61.98 62.75 1gkq s VAL 178 Cb 0.00 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 1gkq s VAL 178 CO 0.00 0.26 0.31 -0.51 0.00 0.00 0.00 175.10 175.16 1gkq s ILE 179 N -1.45 5.22 -0.26 2.22 2.07 -1.03 -4.48 121.20 123.50 1gkq s ILE 179 Ca 0.38 0.61 -0.07 0.00 -1.41 0.00 0.00 60.65 60.16 1gkq s ILE 179 Cb -0.15 -3.62 -0.02 0.00 0.13 0.00 0.00 42.46 38.80 1gkq s ILE 179 CO 0.19 0.54 0.08 -0.69 -1.91 0.00 0.00 174.94 173.15 1gkq s VAL 180 N -0.66 4.30 0.19 4.00 1.01 -0.52 -1.48 120.40 127.23 1gkq s VAL 180 Ca 0.20 -0.22 -0.10 0.00 0.00 0.00 0.00 61.98 61.85 1gkq s VAL 180 Cb -0.15 -3.04 -0.07 0.00 0.00 0.00 0.00 36.38 33.13 1gkq s VAL 180 CO 0.09 0.31 0.52 0.42 0.00 0.00 0.00 175.10 176.43 1gkq s THR 181 N 1.61 4.95 -0.09 3.92 -4.23 -0.59 -0.80 115.64 120.41 1gkq s THR 181 Ca 0.06 0.52 -0.08 0.00 -1.18 0.00 0.00 61.69 61.02 1gkq s THR 181 Cb -0.15 -3.65 0.02 0.00 1.34 0.00 0.00 72.50 70.06 1gkq s THR 181 CO 0.04 0.05 0.23 0.00 -0.54 0.00 0.00 174.62 174.40 1gkq s ALA 182 N -1.67 -0.56 -0.38 3.99 0.00 0.20 -1.63 121.76 121.70 1gkq s ALA 182 Ca 0.43 0.67 -0.20 0.00 0.00 0.00 0.00 51.96 52.86 1gkq s ALA 182 Cb -0.12 -0.39 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1gkq s ALA 182 CO 0.21 -0.11 0.59 -1.58 0.00 0.00 0.00 175.76 174.86 1gkq s HIS 183 N 0.22 3.14 -0.43 0.00 2.46 -0.70 -1.89 115.29 118.09 1gkq s HIS 183 Ca -0.01 0.15 -0.12 0.00 0.47 0.00 0.00 55.06 55.55 1gkq s HIS 183 Cb -0.02 -3.12 0.07 0.00 -0.13 0.00 0.00 32.58 29.37 1gkq s HIS 183 CO -0.00 -0.67 0.30 0.00 -2.47 0.00 0.00 174.74 171.89 1gkq n GLU 185 N 5.03 0.00 -3.40 0.00 1.02 -0.86 -4.41 120.64 118.02 1gkq n GLU 185 Ca -0.11 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.90 1gkq n GLU 185 Cb 0.43 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.76 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 1.30 0.86 0.23 1.62 3.84 -0.71 -3.66 114.94 118.42 1gkq s ASN 186 Ca 0.00 -0.14 -0.07 0.00 0.21 0.00 0.00 52.86 52.86 1gkq s ASN 186 Cb 0.00 0.78 0.39 0.00 -0.55 0.00 0.00 41.25 41.87 1gkq s ASN 186 CO 0.00 -0.33 1.70 0.00 -2.79 0.00 0.00 177.10 175.68 1gkq h ALA 187 N 8.24 0.87 0.31 1.71 0.00 -1.85 -1.62 119.26 126.91 1gkq h ALA 187 Ca -0.17 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1gkq h ALA 187 Cb 1.14 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1gkq h ALA 187 CO 0.29 -0.29 -0.15 1.49 0.00 0.00 0.00 179.25 180.58 1gkq h GLU 188 N 0.30 -0.40 -0.81 0.00 4.57 -1.96 -2.33 114.58 113.95 1gkq h GLU 188 Ca 0.37 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.64 1gkq h GLU 188 Cb 0.59 0.09 -0.06 0.00 -0.16 0.00 0.00 28.75 29.21 1gkq h GLU 188 CO -0.44 -0.09 0.49 -0.07 -1.18 0.00 0.00 179.01 177.72 1gkq h LEU 189 N -0.72 0.77 -0.36 1.64 3.38 -1.94 -0.55 115.31 117.53 1gkq h LEU 189 Ca -0.04 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1gkq h LEU 189 Cb 0.49 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1gkq h LEU 189 CO 0.07 0.49 0.13 0.58 0.09 0.00 0.00 178.44 179.80 1gkq h VAL 190 N 0.90 1.20 -0.31 1.22 2.07 -1.34 -0.10 116.25 119.89 1gkq h VAL 190 Ca 0.35 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1gkq h VAL 190 Cb 0.17 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1gkq h VAL 190 CO -0.17 0.22 0.14 1.23 0.02 0.00 0.00 177.57 179.01 1gkq h GLY 191 N 0.44 0.40 0.88 2.17 0.00 -0.83 0.07 103.07 106.20 1gkq h GLY 191 Ca 0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 1gkq h GLY 191 CO -0.01 0.07 0.06 3.21 0.00 0.00 0.00 176.54 179.88 1gkq h ARG 192 N 0.30 0.40 -0.14 4.80 2.47 -0.95 -2.19 114.38 119.07 1gkq h ARG 192 Ca 0.13 -0.09 -0.05 0.00 -1.26 0.00 0.00 59.98 58.71 1gkq h ARG 192 Cb 0.06 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.31 1gkq h ARG 192 CO -0.10 0.49 -0.14 -0.07 0.56 0.00 0.00 179.97 180.71 1gkq h LEU 193 N 0.23 0.21 -0.07 3.04 3.38 -0.86 -0.95 115.31 120.29 1gkq h LEU 193 Ca 0.08 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1gkq h LEU 193 Cb 0.27 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1gkq h LEU 193 CO 0.00 0.37 -0.00 1.56 0.09 0.00 0.00 178.44 180.46 1gkq h GLN 194 N 0.21 0.12 -0.75 1.13 4.20 -0.75 -2.24 115.11 117.03 1gkq h GLN 194 Ca 0.04 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1gkq h GLN 194 Cb 0.38 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 1gkq h GLN 194 CO 0.02 0.41 0.49 1.96 -0.67 0.00 0.00 178.83 181.04 1gkq h GLN 195 N -0.18 1.00 -0.22 1.46 1.08 -1.11 -1.38 115.11 115.77 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 0.36 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 1gkq h GLN 195 CO 0.00 0.68 0.12 -0.22 -0.95 0.00 0.00 178.83 178.46 1gkq h LYS 196 N 1.03 0.24 -0.47 1.46 3.64 -1.13 -0.64 116.57 120.70 1gkq h LYS 196 Ca 0.27 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.60 1gkq h LYS 196 Cb -0.09 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1gkq h LYS 196 CO -0.06 0.16 0.14 -0.07 -2.27 0.00 0.00 179.45 177.35 1gkq h LEU 197 N 0.24 0.69 -0.35 5.20 3.38 -1.14 -2.58 115.31 120.76 1gkq h LEU 197 Ca 0.09 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1gkq h LEU 197 Cb 0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1gkq h LEU 197 CO -0.05 0.72 0.17 -0.07 0.09 0.00 0.00 178.44 179.30 1gkq h LEU 198 N 0.63 0.45 -1.54 1.67 3.38 -1.07 -1.29 115.31 117.54 1gkq h LEU 198 Ca 0.15 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1gkq h LEU 198 Cb 0.28 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1gkq h LEU 198 CO -0.00 0.44 0.00 0.77 0.09 0.00 0.00 178.44 179.74 1gkq h SER 199 N 0.43 0.00 -0.41 -0.43 4.64 -1.01 0.71 113.55 117.47 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 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 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 -2.45 2.28 -0.86 4.77 1.02 -0.68 -4.92 120.64 119.79 1gkq n GLU 200 Ca -0.01 -1.95 0.00 0.00 -0.02 0.00 0.00 57.16 55.18 1gkq n GLU 200 Cb 0.10 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 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 1.39 0.98 3.51 0.62 0.00 0.24 -4.97 105.19 106.97 1gkq n GLY 201 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.12 3.38 -0.00 1.61 1.02 -0.58 -4.77 119.74 120.29 1gkq s LYS 202 Ca 0.00 -0.95 0.09 0.00 0.02 0.00 0.00 55.97 55.12 1gkq s LYS 202 Cb 0.00 -4.71 -0.11 0.00 -0.52 0.00 0.00 37.83 32.49 1gkq s LYS 202 CO 0.00 -2.02 0.30 0.25 -0.92 0.00 0.00 175.35 172.96 1gkq n THR 203 N 6.26 0.00 -0.90 2.17 -2.24 -1.26 -3.85 114.28 114.46 1gkq n THR 203 Ca 0.15 -0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.38 1gkq n THR 203 Cb 0.49 0.74 0.19 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 -1.44 107.32 107.94 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 0.36 0.55 2.21 -2.55 0.00 0.00 0.00 173.10 173.67 1gkq h PRO 205 N -2.01 0.00 0.00 2.90 0.11 -1.93 -2.69 132.00 128.38 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 0.51 0.04 0.00 -0.85 -0.21 0.00 0.00 178.00 177.49 1gkq n GLU 206 N -3.52 0.21 0.00 1.05 0.00 -1.19 -2.29 120.64 114.89 1gkq n GLU 206 Ca -0.02 0.15 0.11 0.00 0.00 0.00 0.00 57.16 57.40 1gkq n GLU 206 Cb 0.14 -1.50 0.09 0.00 0.00 0.00 0.00 31.44 30.18 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 -1.27 0.00 0.13 -1.84 7.02 -1.01 -4.46 117.44 116.00 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 4.48 -0.26 -0.00 -5.99 2.76 -1.66 -2.30 115.15 112.20 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 0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.98 1gkq h HIS 208 CO 0.00 -0.05 -0.07 1.49 -1.30 0.00 0.00 177.93 178.00 1gkq h GLU 209 N -0.41 -0.12 -0.01 5.26 4.22 -1.80 -2.17 114.58 119.54 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 0.32 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 0.02 -1.35 -2.18 0.00 0.00 179.01 175.47 1gkq h PRO 210 N -0.12 0.00 0.00 0.92 0.11 -1.80 -1.13 132.00 129.98 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 0.66 -0.21 0.00 0.00 178.00 178.38 1gkq h SER 211 N 0.00 0.00 -1.14 -2.05 4.64 -0.79 -3.34 113.55 110.88 1gkq h SER 211 Ca 0.01 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.92 1gkq h SER 211 Cb 0.05 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.86 1gkq h SER 211 CO -0.00 0.00 -0.84 -2.11 -0.87 0.00 0.00 176.83 173.01 1gkq n ARG 212 N -2.36 0.75 -0.70 4.77 1.85 -0.45 -4.53 116.66 115.99 1gkq n ARG 212 Ca 0.04 -2.59 -0.29 0.00 -1.00 0.00 0.00 57.85 54.01 1gkq n ARG 212 Cb 0.34 -1.33 0.22 0.00 -1.05 0.00 0.00 32.46 30.64 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 -0.42 -0.35 0.39 2.89 0.04 -1.07 -4.80 135.00 131.68 1gkq s PRO 213 Ca 0.34 0.88 0.13 0.00 0.04 0.00 0.00 61.00 62.39 1gkq s PRO 213 Cb 0.20 -1.62 0.96 0.00 0.04 0.00 0.00 34.50 34.09 1gkq s PRO 213 CO -0.16 -3.35 1.85 0.93 0.04 0.00 0.00 177.00 176.30 1gkq h GLU 214 N -2.36 0.52 -0.40 4.56 5.08 -1.97 -0.47 114.58 119.54 1gkq h GLU 214 Ca -0.57 -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 0.51 0.34 0.27 0.00 -1.00 0.00 0.00 179.01 179.13 1gkq h ALA 215 N 1.61 2.05 -0.13 3.43 0.00 -1.99 -1.03 119.26 123.20 1gkq h ALA 215 Ca 0.48 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.25 1gkq h ALA 215 Cb 1.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1gkq h ALA 215 CO -0.21 -0.13 -0.41 0.28 0.00 0.00 0.00 179.25 178.77 1gkq h VAL 216 N 0.26 1.36 -0.51 0.00 2.07 -1.41 -1.81 116.25 116.22 1gkq h VAL 216 Ca 0.18 -1.71 -0.06 0.00 0.82 0.00 0.00 66.70 65.93 1gkq h VAL 216 Cb 0.39 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1gkq h VAL 216 CO -0.04 0.51 0.07 -0.08 0.02 0.00 0.00 177.57 178.05 1gkq h GLU 217 N 0.11 0.80 -0.58 1.57 4.81 -1.42 -1.60 114.58 118.27 1gkq h GLU 217 Ca -0.02 -0.19 -0.05 0.00 -0.13 0.00 0.00 59.36 58.98 1gkq h GLU 217 Cb 1.04 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 1gkq h GLU 217 CO 0.09 0.77 0.16 0.00 -0.73 0.00 0.00 179.01 179.30 1gkq h ALA 218 N 1.31 0.77 -0.04 2.92 0.00 -1.16 -0.34 119.26 122.72 1gkq h ALA 218 Ca 0.16 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1gkq h ALA 218 Cb 0.37 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1gkq h ALA 218 CO 0.01 0.45 0.02 1.49 0.00 0.00 0.00 179.25 181.22 1gkq h GLU 219 N 0.83 0.06 -0.68 0.00 4.22 -0.93 -1.28 114.58 116.80 1gkq h GLU 219 Ca 0.19 -0.01 -0.05 0.00 0.08 0.00 0.00 59.36 59.57 1gkq h GLU 219 Cb 0.31 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1gkq h GLU 219 CO -0.00 0.15 0.24 0.78 -2.18 0.00 0.00 179.01 178.00 1gkq h GLY 220 N -0.05 1.10 0.98 1.92 0.00 -1.17 -0.02 103.07 105.81 1gkq h GLY 220 Ca 0.01 -0.60 -0.06 0.00 0.00 0.00 0.00 47.33 46.68 1gkq h GLY 220 CO -0.00 0.57 0.08 -0.84 0.00 0.00 0.00 176.54 176.35 1gkq h THR 221 N 0.99 1.25 -0.37 4.70 2.02 -0.89 -1.03 112.91 119.58 1gkq h THR 221 Ca 0.23 -0.91 -0.14 0.00 0.77 0.00 0.00 66.41 66.35 1gkq h THR 221 Cb 0.24 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1gkq h THR 221 CO -0.01 0.32 -0.35 0.00 0.37 0.00 0.00 175.52 175.85 1gkq h ALA 222 N 0.97 0.70 -0.10 6.16 0.00 -0.98 -2.06 119.26 123.94 1gkq h ALA 222 Ca 0.15 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1gkq h ALA 222 Cb 0.38 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1gkq h ALA 222 CO 0.01 0.67 0.06 -0.09 0.00 0.00 0.00 179.25 179.89 1gkq h ARG 223 N 0.70 0.14 -0.50 0.00 2.43 -0.83 -1.16 114.38 115.15 1gkq h ARG 223 Ca 0.07 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.29 1gkq h ARG 223 Cb 0.91 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.37 1gkq h ARG 223 CO 0.08 0.17 0.19 0.35 -1.51 0.00 0.00 179.97 179.25 1gkq h PHE 224 N 0.07 0.34 -0.89 2.20 3.57 -1.12 -1.44 116.94 119.67 1gkq h PHE 224 Ca 0.04 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.58 1gkq h PHE 224 Cb 0.07 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 1gkq h PHE 224 CO -0.05 0.12 0.59 0.00 -2.23 0.00 0.00 178.31 176.74 1gkq h ALA 225 N 1.32 1.39 -0.69 2.41 0.00 -1.05 -1.51 119.26 121.12 1gkq h ALA 225 Ca 0.24 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1gkq h ALA 225 Cb 0.24 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1gkq h ALA 225 CO -0.23 0.55 0.16 1.15 0.00 0.00 0.00 179.25 180.88 1gkq h THR 226 N 1.18 1.26 -0.07 0.00 2.02 -0.21 -0.88 112.91 116.21 1gkq h THR 226 Ca 0.34 -0.99 -0.12 0.00 0.77 0.00 0.00 66.41 66.41 1gkq h THR 226 Cb -0.09 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1gkq h THR 226 CO -0.08 0.38 -0.52 -0.26 0.37 0.00 0.00 175.52 175.41 1gkq h PHE 227 N 1.06 0.22 -0.05 3.16 -1.00 -0.79 -1.12 116.94 118.41 1gkq h PHE 227 Ca 0.22 -0.07 -0.01 0.00 2.81 0.00 0.00 57.97 60.91 1gkq h PHE 227 Cb 0.39 -0.04 -0.00 0.00 3.61 0.00 0.00 35.95 39.90 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 0.14 0.10 -1.48 1.54 3.38 -1.01 -0.98 115.31 117.01 1gkq h LEU 228 Ca 0.00 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.61 1gkq h LEU 228 Cb 0.96 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 1gkq h LEU 228 CO 0.08 0.48 0.39 -0.08 0.09 0.00 0.00 178.44 179.39 1gkq h GLU 229 N -0.27 0.67 0.00 1.13 4.81 -1.04 0.14 114.58 120.01 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 0.43 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1gkq h GLU 229 CO 0.01 0.44 -0.85 1.15 -0.73 0.00 0.00 179.01 179.03 1gkq h THR 230 N 0.69 1.29 0.00 0.32 2.02 -1.10 -3.35 112.91 112.78 1gkq h THR 230 Ca 0.23 -2.86 -0.02 0.00 0.77 0.00 0.00 66.41 64.54 1gkq h THR 230 Cb 0.08 2.63 -0.00 0.00 -1.74 0.00 0.00 68.15 69.12 1gkq h THR 230 CO -0.06 0.74 -1.81 0.35 0.37 0.00 0.00 175.52 175.10 1gkq n THR 231 N -3.27 0.19 -0.64 3.16 -2.24 -0.38 -4.98 114.28 106.11 1gkq n THR 231 Ca -0.00 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1gkq n THR 231 Cb 0.86 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 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 1.26 0.71 3.87 3.38 0.00 0.45 -4.88 105.19 109.98 1gkq n GLY 232 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.28 3.31 -0.09 4.61 0.00 -1.19 -4.95 121.76 121.18 1gkq s ALA 233 Ca 0.00 -0.17 -0.16 0.00 0.00 0.00 0.00 51.96 51.64 1gkq s ALA 233 Cb 0.00 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.31 1gkq s ALA 233 CO 0.00 -0.08 0.40 0.99 0.00 0.00 0.00 175.76 177.07 1gkq s THR 234 N -2.44 5.18 0.35 0.00 2.01 -1.26 -4.71 115.64 114.77 1gkq s THR 234 Ca 0.52 0.79 0.05 0.00 0.31 0.00 0.00 61.69 63.36 1gkq s THR 234 Cb -0.10 -3.73 -0.07 0.00 0.01 0.00 0.00 72.50 68.61 1gkq s THR 234 CO 0.33 0.43 0.04 -0.83 -0.69 0.00 0.00 174.62 173.89 1gkq s GLY 235 N 0.02 2.21 -0.16 4.40 0.00 -0.49 -1.44 107.32 111.86 1gkq s GLY 235 Ca 0.22 -2.14 -0.06 0.00 0.00 0.00 0.00 44.72 42.75 1gkq s GLY 235 CO 0.09 -1.91 0.33 -0.47 0.00 0.00 0.00 173.10 171.14 1gkq s TYR 236 N -3.10 -0.58 -0.31 1.90 6.14 0.02 -1.19 117.35 120.24 1gkq s TYR 236 Ca 0.36 1.21 -0.21 0.00 0.64 0.00 0.00 57.07 59.06 1gkq s TYR 236 Cb 0.09 0.11 -0.01 0.00 0.42 0.00 0.00 41.96 42.58 1gkq s TYR 236 CO 0.16 -0.41 0.68 0.08 0.64 0.00 0.00 175.55 176.71 1gkq s VAL 237 N 2.45 4.89 0.47 3.14 1.01 0.60 -0.63 120.40 132.32 1gkq s VAL 237 Ca -0.00 0.96 -0.17 0.00 0.00 0.00 0.00 61.98 62.77 1gkq s VAL 237 Cb -0.12 -4.05 -0.09 0.00 0.00 0.00 0.00 36.38 32.13 1gkq s VAL 237 CO -0.10 -0.18 0.93 0.68 0.00 0.00 0.00 175.10 176.43 1gkq s VAL 238 N 2.73 4.54 -0.36 2.92 -7.23 -0.79 -1.12 120.40 121.08 1gkq s VAL 238 Ca 0.28 1.19 -0.05 0.00 -1.81 0.00 0.00 61.98 61.59 1gkq s VAL 238 Cb -0.15 -3.68 0.01 0.00 0.56 0.00 0.00 36.38 33.12 1gkq s VAL 238 CO 0.12 -0.54 0.23 0.00 -0.31 0.00 0.00 175.10 174.60 1gkq n HIS 239 N -1.23 -0.67 -2.57 2.82 1.44 -1.11 -4.71 115.22 109.20 1gkq n HIS 239 Ca 0.06 0.21 -0.42 0.00 -2.01 0.00 0.00 57.72 55.55 1gkq n HIS 239 Cb 0.54 -1.03 -0.03 0.00 0.12 0.00 0.00 29.99 29.60 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 -4.10 4.30 -0.00 2.39 0.20 0.33 -4.70 118.68 117.11 1gkq s LEU 240 Ca 0.06 1.74 0.08 0.00 0.69 0.00 0.00 54.13 56.70 1gkq s LEU 240 Cb -0.04 -3.56 -0.09 0.00 -0.43 0.00 0.00 46.19 42.07 1gkq s LEU 240 CO 0.35 -0.46 0.29 -1.54 -0.29 0.00 0.00 176.35 174.69 1gkq n SER 241 N 4.67 0.93 -4.07 3.68 3.41 -1.26 -4.62 113.62 116.37 1gkq n SER 241 Ca 0.09 -0.54 -0.09 0.00 -0.26 0.00 0.00 58.87 58.07 1gkq n SER 241 Cb 0.48 1.07 -0.09 0.00 -0.26 0.00 0.00 64.21 65.41 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 2.80 0.02 -0.94 0.00 3.64 -1.97 -0.92 116.57 119.21 1gkq h LYS 243 Ca -0.34 -0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.18 1gkq h LYS 243 Cb 1.20 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.92 1gkq h LYS 243 CO 0.57 0.02 0.56 -1.35 -2.27 0.00 0.00 179.45 176.98 1gkq h PRO 244 N 0.02 0.82 -0.22 1.90 0.11 -1.98 0.29 132.00 132.95 1gkq h PRO 244 Ca 0.14 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.08 1gkq h PRO 244 Cb 0.20 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 1gkq h PRO 244 CO -0.27 0.54 -0.31 0.00 -0.21 0.00 0.00 178.00 177.75 1gkq h ALA 245 N 1.55 0.33 -0.74 -0.75 0.00 -1.75 -2.55 119.26 115.35 1gkq h ALA 245 Ca 0.49 -0.41 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1gkq h ALA 245 Cb 0.59 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1gkq h ALA 245 CO -0.31 0.36 0.46 1.25 0.00 0.00 0.00 179.25 181.02 1gkq h LEU 246 N 0.29 0.74 -0.59 0.00 5.85 -0.06 -0.61 115.31 120.93 1gkq h LEU 246 Ca 0.02 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.78 1gkq h LEU 246 Cb 0.89 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 1gkq h LEU 246 CO 0.07 0.50 0.35 0.44 -0.34 0.00 0.00 178.44 179.46 1gkq h ASP 247 N 0.88 0.56 -0.42 1.25 3.32 -0.39 0.24 116.42 121.85 1gkq h ASP 247 Ca 0.31 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 1gkq h ASP 247 Cb 0.07 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1gkq h ASP 247 CO -0.13 0.39 0.17 0.00 -1.72 0.00 0.00 179.24 177.95 1gkq h ALA 248 N 1.27 0.55 -0.32 3.45 0.00 -0.95 -1.05 119.26 122.21 1gkq h ALA 248 Ca 0.24 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1gkq h ALA 248 Cb 0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1gkq h ALA 248 CO -0.11 0.15 -0.35 0.00 0.00 0.00 0.00 179.25 178.94 1gkq h ALA 249 N 1.01 0.79 -0.61 0.00 0.00 -0.77 -2.74 119.26 116.94 1gkq h ALA 249 Ca 0.14 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1gkq h ALA 249 Cb 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1gkq h ALA 249 CO -0.01 0.65 0.08 0.52 0.00 0.00 0.00 179.25 180.49 1gkq h MET 250 N 0.60 1.02 -0.92 0.00 2.07 -0.39 -1.45 114.93 115.86 1gkq h MET 250 Ca 0.06 -0.28 0.02 0.00 -2.07 0.00 0.00 59.70 57.43 1gkq h MET 250 Cb 0.87 -0.11 -0.05 0.00 -1.87 0.00 0.00 31.60 30.44 1gkq h MET 250 CO 0.08 0.97 0.61 0.00 1.07 0.00 0.00 176.91 179.63 1gkq h ALA 251 N 1.01 1.19 -0.37 6.32 0.00 -1.11 0.83 119.26 127.14 1gkq h ALA 251 Ca 0.18 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1gkq h ALA 251 Cb 0.45 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1gkq h ALA 251 CO 0.02 0.53 0.02 0.00 0.00 0.00 0.00 179.25 179.81 1gkq h ALA 252 N 1.35 0.50 -0.43 0.00 0.00 -1.18 -2.15 119.26 117.35 1gkq h ALA 252 Ca 0.35 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1gkq h ALA 252 Cb -0.09 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1gkq h ALA 252 CO -0.09 0.25 0.27 0.87 0.00 0.00 0.00 179.25 180.55 1gkq h LYS 253 N 0.47 0.53 -0.54 0.00 1.57 -0.60 -1.44 116.57 116.57 1gkq h LYS 253 Ca 0.11 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1gkq h LYS 253 Cb 0.44 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1gkq h LYS 253 CO 0.02 0.35 0.34 0.00 -0.57 0.00 0.00 179.45 179.59 1gkq h ALA 254 N 1.18 1.58 -0.34 3.86 0.00 -0.69 -1.97 119.26 122.88 1gkq h ALA 254 Ca 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1gkq h ALA 254 Cb -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1gkq h ALA 254 CO -0.06 0.38 0.00 2.89 0.00 0.00 0.00 179.25 182.46 1gkq n ARG 255 N -4.44 1.97 -0.15 0.00 1.85 -0.82 -4.92 116.66 110.15 1gkq n ARG 255 Ca 0.05 -1.30 0.00 0.00 -1.00 0.00 0.00 57.85 55.60 1gkq n ARG 255 Cb 0.06 -1.36 0.00 0.00 -1.05 0.00 0.00 32.46 30.11 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 0.95 0.62 3.72 2.89 0.00 -0.74 -5.07 105.19 107.57 1gkq n GLY 256 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.26 3.39 -1.20 1.61 1.01 -0.57 -4.91 120.40 117.48 1gkq s VAL 257 Ca 0.00 1.02 -0.20 0.00 0.00 0.00 0.00 61.98 62.81 1gkq s VAL 257 Cb 0.00 -3.66 0.06 0.00 0.00 0.00 0.00 36.38 32.78 1gkq s VAL 257 CO 0.00 0.09 1.65 -2.16 0.00 0.00 0.00 175.10 174.69 1gkq s PRO 258 N 0.85 3.79 0.03 2.72 0.04 -1.26 -4.40 135.00 136.77 1gkq s PRO 258 Ca 0.62 -1.66 0.05 0.00 0.04 0.00 0.00 61.00 60.05 1gkq s PRO 258 Cb -0.36 -5.47 -0.02 0.00 0.04 0.00 0.00 34.50 28.70 1gkq s PRO 258 CO 0.32 -2.31 -0.16 -1.50 0.04 0.00 0.00 177.00 173.39 1gkq s ILE 259 N 4.76 1.24 0.19 0.56 2.07 -1.26 -1.40 121.20 127.36 1gkq s ILE 259 Ca 0.52 -0.96 0.09 0.00 -1.41 0.00 0.00 60.65 58.89 1gkq s ILE 259 Cb 0.02 -1.09 -0.04 0.00 0.13 0.00 0.00 42.46 41.48 1gkq s ILE 259 CO 0.02 0.12 -0.19 -0.31 -1.91 0.00 0.00 174.94 172.66 1gkq s TYR 260 N -0.73 1.96 -0.05 3.50 2.02 -0.33 -4.87 117.35 118.85 1gkq s TYR 260 Ca 0.04 -0.44 0.05 0.00 -0.37 0.00 0.00 57.07 56.35 1gkq s TYR 260 Cb -0.08 -0.96 -0.02 0.00 -0.40 0.00 0.00 41.96 40.51 1gkq s TYR 260 CO 0.01 0.41 -0.21 0.42 -1.57 0.00 0.00 175.55 174.61 1gkq s ILE 261 N -2.09 2.44 0.01 2.71 1.01 -1.26 -0.29 121.20 123.73 1gkq s ILE 261 Ca 0.19 -0.94 0.06 0.00 0.00 0.00 0.00 60.65 59.96 1gkq s ILE 261 Cb -0.06 -1.92 -0.02 0.00 0.01 0.00 0.00 42.46 40.48 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 -0.38 1.44 0.06 2.79 2.12 -0.28 -0.76 118.70 123.70 1gkq s GLU 262 Ca 0.03 -0.77 0.04 0.00 0.36 0.00 0.00 54.97 54.63 1gkq s GLU 262 Cb -0.12 -1.45 -0.03 0.00 0.26 0.00 0.00 34.13 32.79 1gkq s GLU 262 CO 0.02 0.39 -0.12 -1.12 -0.54 0.00 0.00 175.26 173.88 1gkq s SER 263 N -0.75 1.46 0.00 -1.70 0.01 -0.87 -0.52 113.70 111.34 1gkq s SER 263 Ca 0.07 -0.58 0.03 0.00 1.31 0.00 0.00 55.95 56.78 1gkq s SER 263 Cb -0.08 -0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.08 1gkq s SER 263 CO 0.00 -0.10 -0.05 0.68 0.41 0.00 0.00 173.24 174.18 1gkq s VAL 264 N -1.25 3.75 0.34 3.43 -7.23 -1.26 -1.45 120.40 116.72 1gkq s VAL 264 Ca -0.04 -0.75 0.12 0.00 -1.81 0.00 0.00 61.98 59.51 1gkq s VAL 264 Cb -0.10 -2.64 0.36 0.00 0.56 0.00 0.00 36.38 34.56 1gkq s VAL 264 CO 0.02 0.39 1.60 -0.29 -0.31 0.00 0.00 175.10 176.50 1gkq h ILE 265 N 3.70 0.10 -0.01 -0.62 6.09 -1.50 -1.04 117.51 124.23 1gkq h ILE 265 Ca -0.48 -0.03 0.00 0.00 -1.37 0.00 0.00 64.86 62.98 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 0.54 0.01 0.00 1.55 -3.07 0.00 0.00 178.15 177.19 1gkq h PRO 266 N 0.08 0.00 0.00 2.19 0.13 -1.87 -1.36 132.00 131.17 1gkq h PRO 266 Ca 0.72 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.85 1gkq h PRO 266 Cb 1.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.83 1gkq h PRO 266 CO -0.77 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 177.72 1gkq n HIS 267 N -4.33 0.02 -0.01 1.56 8.25 -0.39 -0.89 115.22 119.42 1gkq n HIS 267 Ca -0.03 0.01 -0.05 0.00 -0.26 0.00 0.00 57.72 57.39 1gkq n HIS 267 Cb 0.09 -0.51 -0.12 0.00 1.12 0.00 0.00 29.99 30.57 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 -1.52 0.82 -0.00 4.41 3.01 -0.53 -4.62 117.46 119.03 1gkq n PHE 268 Ca 0.06 0.29 0.02 0.00 1.01 0.00 0.00 57.45 58.82 1gkq n PHE 268 Cb 0.27 -1.10 -0.03 0.00 -0.01 0.00 0.00 39.48 38.61 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 -2.92 0.00 -4.73 4.37 4.77 -1.15 -4.86 117.00 112.48 1gkq n LEU 269 Ca -0.16 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.59 1gkq n LEU 269 Cb 0.98 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 42.01 1gkq n LEU 269 CO 0.44 0.00 -0.23 -0.76 -1.33 0.00 0.00 177.39 175.51 1gkq s LEU 270 N -3.26 3.35 0.22 2.23 1.43 -0.07 -5.11 118.68 117.47 1gkq s LEU 270 Ca -0.01 -0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 52.44 1gkq s LEU 270 Cb 0.02 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.35 1gkq s LEU 270 CO 0.15 -0.16 0.19 1.51 0.23 0.00 0.00 176.35 178.27 1gkq s ASP 271 N -3.80 0.28 0.50 2.29 1.47 -1.26 -4.64 116.67 111.51 1gkq s ASP 271 Ca 0.35 -1.37 0.29 0.00 1.18 0.00 0.00 52.55 52.99 1gkq s ASP 271 Cb -0.05 0.43 1.38 0.00 -0.34 0.00 0.00 42.92 44.34 1gkq s ASP 271 CO 0.22 -0.91 1.85 0.07 0.68 0.00 0.00 175.17 177.08 1gkq h LYS 272 N 2.52 0.12 -0.04 2.11 2.10 -0.88 -1.94 116.57 120.56 1gkq h LYS 272 Ca -0.34 -0.01 0.01 0.00 -2.00 0.00 0.00 60.65 58.32 1gkq h LYS 272 Cb 1.25 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.55 1gkq h LYS 272 CO 0.49 0.08 0.03 1.79 -2.00 0.00 0.00 179.45 179.84 1gkq h THR 273 N 0.13 0.89 -0.38 0.07 1.35 -1.92 -0.61 112.91 112.44 1gkq h THR 273 Ca 0.49 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.36 1gkq h THR 273 Cb 1.73 0.98 -0.02 0.00 -1.73 0.00 0.00 68.15 69.10 1gkq h THR 273 CO -0.08 0.00 0.25 1.88 -0.25 0.00 0.00 175.52 177.32 1gkq h TYR 274 N 0.00 0.49 -0.15 4.73 -1.99 -1.76 0.14 116.97 118.43 1gkq h TYR 274 Ca 0.02 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1gkq h TYR 274 Cb 0.09 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 38.65 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 2.53 -0.54 3.88 0.00 -0.24 -3.36 120.51 120.29 1gkq n ALA 275 Ca 0.03 -0.41 0.06 0.00 0.00 0.00 0.00 53.44 53.12 1gkq n ALA 275 Cb 0.06 -1.11 0.17 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 0.04 2.72 0.05 0.00 1.02 0.03 -3.19 120.64 121.31 1gkq n GLU 276 Ca 0.14 -2.31 0.13 0.00 -0.02 0.00 0.00 57.16 55.10 1gkq n GLU 276 Cb 0.24 -1.46 0.48 0.00 -0.02 0.00 0.00 31.44 30.68 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 -0.22 0.13 -0.27 3.49 1.74 -1.19 -4.99 116.66 115.35 1gkq n ARG 277 Ca 0.14 0.10 0.01 0.00 -0.77 0.00 0.00 57.85 57.32 1gkq n ARG 277 Cb 0.59 -1.64 -0.00 0.00 -1.02 0.00 0.00 32.46 30.38 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 1.41 -2.94 7.00 -0.13 0.00 -1.26 -4.76 105.19 104.51 1gkq n GLY 278 Ca 0.06 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.81 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 -1.90 -0.49 0.25 -0.02 0.00 -1.26 -3.04 105.19 98.73 1gkq n GLY 279 Ca -0.00 -1.09 0.11 0.00 0.00 0.00 0.00 46.02 45.03 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 0.68 -0.68 1.61 3.04 -1.98 -2.48 116.25 116.45 1gkq h VAL 280 Ca 0.00 -0.65 -0.01 0.00 -1.01 0.00 0.00 66.70 65.03 1gkq h VAL 280 Cb 0.00 1.41 -0.03 0.00 -2.01 0.00 0.00 31.29 30.65 1gkq h VAL 280 CO 0.00 0.15 0.37 -0.08 -1.01 0.00 0.00 177.57 177.00 1gkq h GLU 281 N 0.00 0.94 -0.10 4.17 4.57 -1.93 -2.53 114.58 119.70 1gkq h GLU 281 Ca -0.00 -0.11 -0.19 0.00 -1.18 0.00 0.00 59.36 57.88 1gkq h GLU 281 Cb 0.39 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1gkq h GLU 281 CO 0.02 0.71 -0.72 0.00 -1.18 0.00 0.00 179.01 177.84 1gkq h ALA 282 N 1.18 0.57 0.00 2.92 0.00 -1.37 -3.12 119.26 119.45 1gkq h ALA 282 Ca 0.24 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1gkq h ALA 282 Cb 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1gkq h ALA 282 CO -0.04 0.75 -0.03 0.52 0.00 0.00 0.00 179.25 180.44 1gkq h MET 283 N 0.32 0.00 0.00 0.00 2.86 -1.11 -1.19 114.93 115.81 1gkq h MET 283 Ca -0.03 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 1gkq h MET 283 Cb 1.29 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.95 1gkq h MET 283 CO 0.13 0.03 -0.08 0.87 1.06 0.00 0.00 176.91 178.92 1gkq h LYS 284 N 0.00 0.00 -0.42 1.72 1.57 -1.39 -2.91 116.57 115.14 1gkq h LYS 284 Ca -0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1gkq h LYS 284 Cb 0.11 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 1gkq h LYS 284 CO 0.00 0.08 0.05 0.66 -0.57 0.00 0.00 179.45 179.67 1gkq n TYR 285 N -3.31 1.46 -3.22 -1.35 4.01 -0.45 -4.75 117.16 109.55 1gkq n TYR 285 Ca -0.01 -1.00 -0.40 0.00 -0.16 0.00 0.00 57.90 56.33 1gkq n TYR 285 Cb 0.27 -0.45 -0.07 0.00 -0.31 0.00 0.00 39.34 38.78 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 -2.91 5.05 0.31 -0.72 -1.09 -1.10 -4.66 121.20 116.08 1gkq s ILE 286 Ca 0.47 0.86 -0.08 0.00 -2.23 0.00 0.00 60.65 59.67 1gkq s ILE 286 Cb 0.38 -3.85 0.00 0.00 -1.58 0.00 0.00 42.46 37.41 1gkq s ILE 286 CO 0.10 0.05 0.50 0.00 -1.23 0.00 0.00 174.94 174.36 1gkq s MET 287 N 2.35 1.79 -0.05 2.79 0.23 -1.26 -0.63 119.30 124.52 1gkq s MET 287 Ca 0.22 -1.53 0.00 0.00 -1.03 0.00 0.00 55.69 53.35 1gkq s MET 287 Cb -0.16 0.47 0.02 0.00 -1.53 0.00 0.00 34.83 33.64 1gkq s MET 287 CO 0.10 -0.75 -0.02 -1.12 -2.03 0.00 0.00 175.02 171.19 1gkq s SER 288 N -3.13 1.00 0.65 -1.18 0.01 -1.26 -2.55 113.70 107.24 1gkq s SER 288 Ca 0.26 -0.09 -0.17 0.00 1.31 0.00 0.00 55.95 57.26 1gkq s SER 288 Cb -0.01 -0.39 -0.01 0.00 0.21 0.00 0.00 66.02 65.83 1gkq s SER 288 CO 0.15 -0.10 1.22 -2.84 0.41 0.00 0.00 173.24 172.07 1gkq s PRO 289 N 1.23 2.61 0.98 12.44 0.02 -1.26 -5.04 135.00 145.98 1gkq s PRO 289 Ca -0.06 1.83 -0.11 0.00 0.02 0.00 0.00 61.00 62.68 1gkq s PRO 289 Cb -0.14 -1.88 0.17 0.00 0.02 0.00 0.00 34.50 32.67 1gkq s PRO 289 CO -0.02 -1.49 1.07 -2.30 -0.33 0.00 0.00 177.00 173.94 1gkq n PRO 290 N -2.06 -0.89 -2.21 5.54 -0.02 -1.06 -4.95 135.00 129.36 1gkq n PRO 290 Ca 0.14 -0.20 -0.39 0.00 -2.02 0.00 0.00 63.50 61.03 1gkq n PRO 290 Cb 0.50 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 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 -6.41 4.26 0.00 2.45 1.43 -1.26 -5.01 118.68 114.14 1gkq s LEU 291 Ca 0.67 2.48 0.05 0.00 -1.03 0.00 0.00 54.13 56.30 1gkq s LEU 291 Cb -0.23 -3.91 0.05 0.00 0.03 0.00 0.00 46.19 42.14 1gkq s LEU 291 CO 0.60 -0.67 0.45 0.54 0.23 0.00 0.00 176.35 177.50 1gkq n ARG 292 N 0.27 0.69 -1.82 1.70 5.12 -1.26 -3.83 116.66 117.52 1gkq n ARG 292 Ca 0.03 -3.32 -0.41 0.00 -1.93 0.00 0.00 57.85 52.22 1gkq n ARG 292 Cb 0.45 0.28 -0.01 0.00 -1.16 0.00 0.00 32.46 32.02 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 -4.20 6.40 0.41 0.55 -1.08 -1.26 -0.48 116.67 117.01 1gkq s ASP 293 Ca 0.34 2.95 0.25 0.00 -0.52 0.00 0.00 52.55 55.57 1gkq s ASP 293 Cb -0.03 -2.65 1.33 0.00 -1.46 0.00 0.00 42.92 40.12 1gkq s ASP 293 CO 0.22 -0.87 1.73 0.07 0.52 0.00 0.00 175.17 176.84 1gkq h LYS 294 N 4.13 0.00 -0.01 4.34 2.10 -1.95 -1.93 116.57 123.25 1gkq h LYS 294 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1gkq h LYS 294 Cb 1.23 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1gkq h LYS 294 CO 0.73 0.00 0.02 0.07 -2.00 0.00 0.00 179.45 178.27 1gkq h ARG 295 N 0.00 0.00 0.00 0.07 0.11 -2.00 -1.37 114.38 111.19 1gkq h ARG 295 Ca 0.00 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.06 1gkq h ARG 295 Cb 0.18 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.25 1gkq h ARG 295 CO 0.00 0.00 -0.10 -0.91 0.10 0.00 0.00 179.97 179.06 1gkq h ASN 296 N 0.00 0.00 -0.64 0.08 2.35 -1.71 -3.31 115.58 112.35 1gkq h ASN 296 Ca 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1gkq h ASN 296 Cb 0.04 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 1gkq h ASN 296 CO -0.00 0.10 0.29 1.56 -1.65 0.00 0.00 177.43 177.73 1gkq h GLN 297 N 0.00 0.93 -0.58 0.81 4.20 -1.46 -1.46 115.11 117.55 1gkq h GLN 297 Ca -0.00 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.53 1gkq h GLN 297 Cb 0.88 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.47 1gkq h GLN 297 CO 0.01 0.76 0.27 -0.22 -0.67 0.00 0.00 178.83 178.98 1gkq h LYS 298 N 0.89 0.85 -0.30 1.46 3.64 -1.73 -0.37 116.57 121.01 1gkq h LYS 298 Ca 0.22 -0.14 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1gkq h LYS 298 Cb 0.15 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1gkq h LYS 298 CO -0.02 0.71 0.06 0.28 -2.27 0.00 0.00 179.45 178.21 1gkq h VAL 299 N 0.80 0.86 -0.34 2.00 2.07 -1.61 0.60 116.25 120.63 1gkq h VAL 299 Ca 0.20 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.62 1gkq h VAL 299 Cb 0.15 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1gkq h VAL 299 CO -0.02 0.03 0.04 -0.07 0.02 0.00 0.00 177.57 177.57 1gkq h LEU 300 N 0.17 0.56 -0.29 2.57 3.38 -1.01 -1.45 115.31 119.24 1gkq h LEU 300 Ca 0.14 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1gkq h LEU 300 Cb 0.15 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1gkq h LEU 300 CO -0.18 0.69 0.17 -0.50 0.09 0.00 0.00 178.44 178.71 1gkq h TRP 301 N 0.40 0.33 -0.64 1.13 4.06 -0.71 -0.08 115.95 120.43 1gkq h TRP 301 Ca 0.10 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.06 1gkq h TRP 301 Cb 0.38 -0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 28.40 1gkq h TRP 301 CO 0.03 0.20 0.39 -0.44 -3.56 0.00 0.00 178.44 175.05 1gkq h ASP 302 N 0.36 0.77 -0.37 -3.49 3.32 -0.82 -1.33 116.42 114.85 1gkq h ASP 302 Ca 0.11 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 1gkq h ASP 302 Cb -0.01 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1gkq h ASP 302 CO -0.05 0.60 0.09 0.00 -1.72 0.00 0.00 179.24 178.16 1gkq h ALA 303 N 1.20 1.32 -0.27 3.45 0.00 -0.91 -2.49 119.26 121.57 1gkq h ALA 303 Ca 0.23 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1gkq h ALA 303 Cb -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1gkq h ALA 303 CO -0.04 0.48 -0.12 1.25 0.00 0.00 0.00 179.25 180.81 1gkq h LEU 304 N 0.66 0.57 -1.54 0.00 5.85 -0.48 0.25 115.31 120.62 1gkq h LEU 304 Ca 0.15 -0.41 0.01 0.00 0.84 0.00 0.00 57.88 58.48 1gkq h LEU 304 Cb 0.28 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1gkq h LEU 304 CO 0.00 0.85 0.33 0.00 -0.34 0.00 0.00 178.44 179.27 1gkq h ALA 305 N 0.74 1.69 -0.05 1.25 0.00 -0.98 -1.79 119.26 120.12 1gkq h ALA 305 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1gkq h ALA 305 Cb 0.63 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1gkq h ALA 305 CO 0.04 0.28 0.00 1.04 0.00 0.00 0.00 179.25 180.60 1gkq n GLN 306 N -4.47 1.75 -0.94 0.00 1.13 -0.96 -4.90 117.38 108.99 1gkq n GLN 306 Ca 0.05 -1.09 0.00 0.00 -1.94 0.00 0.00 57.00 54.02 1gkq n GLN 306 Cb 0.08 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 28.97 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 1.19 0.53 0.24 1.08 0.00 -0.68 -4.92 105.19 102.63 1gkq n GLY 307 Ca 0.18 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 0.78 -3.51 1.61 0.04 -0.75 -3.39 116.94 111.72 1gkq h PHE 308 Ca 0.00 -0.21 -0.61 0.00 2.80 0.00 0.00 57.97 59.95 1gkq h PHE 308 Cb 0.00 -0.17 -0.12 0.00 2.20 0.00 0.00 35.95 37.86 1gkq h PHE 308 CO 0.00 0.93 -0.21 0.42 -0.60 0.00 0.00 178.31 178.85 1gkq s ILE 309 N -4.35 5.20 -0.11 -0.55 1.01 -1.10 -4.65 121.20 116.65 1gkq s ILE 309 Ca -0.08 0.68 -0.28 0.00 0.00 0.00 0.00 60.65 60.97 1gkq s ILE 309 Cb 0.12 -3.72 -0.26 0.00 0.01 0.00 0.00 42.46 38.62 1gkq s ILE 309 CO 0.83 0.24 0.86 0.44 0.00 0.00 0.00 174.94 177.32 1gkq h ASP 310 N 7.49 0.06 -3.63 3.58 5.19 -1.15 -3.43 116.42 124.52 1gkq h ASP 310 Ca -0.35 -0.91 -0.39 0.00 -0.62 0.00 0.00 57.03 54.75 1gkq h ASP 310 Cb 1.16 -0.02 -0.14 0.00 0.18 0.00 0.00 39.33 40.51 1gkq h ASP 310 CO 0.71 0.97 -0.70 0.42 -3.12 0.00 0.00 179.24 177.52 1gkq s THR 311 N -2.56 1.34 -0.13 0.35 -4.23 -0.96 -4.38 115.64 105.06 1gkq s THR 311 Ca -0.18 -2.10 0.01 0.00 -1.18 0.00 0.00 61.69 58.24 1gkq s THR 311 Cb -0.02 -2.08 0.02 0.00 1.34 0.00 0.00 72.50 71.76 1gkq s THR 311 CO 0.71 -0.56 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.40 1gkq s VAL 312 N -3.22 1.46 0.00 2.29 1.01 -0.28 -2.04 120.40 119.61 1gkq s VAL 312 Ca 0.22 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1gkq s VAL 312 Cb 0.03 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 35.03 1gkq s VAL 312 CO 0.05 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.20 1gkq n GLY 313 N 4.62 6.60 0.00 4.51 0.00 -0.53 -4.73 105.19 115.66 1gkq n GLY 313 Ca -0.17 -2.05 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 -3.37 2.61 -2.24 -1.25 -1.42 114.28 108.61 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 -0.65 0.07 0.00 -2.10 0.00 0.00 70.33 67.65 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 -2.11 -4.83 -4.60 3.42 2.03 0.59 -4.64 116.55 106.41 1gkq n ASP 315 Ca 0.00 -0.47 -0.50 0.00 0.52 0.00 0.00 54.79 54.34 1gkq n ASP 315 Cb 0.44 -4.34 -0.06 0.00 -0.72 0.00 0.00 41.12 36.44 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 -4.38 2.00 -3.27 -0.67 -0.00 -1.20 -4.58 115.22 103.12 1gkq n HIS 316 Ca -0.05 0.15 -0.19 0.00 -0.00 0.00 0.00 57.72 57.62 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 0.75 4.55 0.02 0.00 0.04 -1.26 -2.62 135.00 136.48 1gkq s PRO 318 Ca 0.26 1.70 -0.02 0.00 0.04 0.00 0.00 61.00 62.98 1gkq s PRO 318 Cb -0.06 -3.31 -0.02 0.00 0.04 0.00 0.00 34.50 31.15 1gkq s PRO 318 CO -0.09 -0.02 0.00 -0.06 0.04 0.00 0.00 177.00 176.87 1gkq s PHE 319 N 0.23 0.24 0.37 0.56 0.08 -1.26 -1.02 117.98 117.19 1gkq s PHE 319 Ca 0.52 -0.51 -0.14 0.00 0.12 0.00 0.00 56.93 56.93 1gkq s PHE 319 Cb -0.29 -0.18 -0.08 0.00 -0.57 0.00 0.00 43.02 41.90 1gkq s PHE 319 CO 0.33 -0.23 0.78 -0.51 -0.10 0.00 0.00 175.22 175.48 1gkq s ASP 320 N -1.61 6.67 0.46 1.36 1.01 -1.26 -4.56 116.67 118.74 1gkq s ASP 320 Ca -0.13 1.26 0.18 0.00 0.71 0.00 0.00 52.55 54.57 1gkq s ASP 320 Cb -0.08 -2.37 1.16 0.00 1.01 0.00 0.00 42.92 42.64 1gkq s ASP 320 CO -0.02 -0.32 1.96 0.71 0.21 0.00 0.00 175.17 177.72 1gkq h THR 321 N 1.53 0.81 -0.60 -1.27 1.35 -1.98 0.13 112.91 112.88 1gkq h THR 321 Ca -0.48 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1gkq h THR 321 Cb 1.18 0.51 -0.03 0.00 -1.73 0.00 0.00 68.15 68.08 1gkq h THR 321 CO 0.64 0.05 0.38 -0.08 -0.25 0.00 0.00 175.52 176.26 1gkq h GLU 322 N 0.28 0.81 -0.30 4.72 4.81 -2.00 -1.21 114.58 121.68 1gkq h GLU 322 Ca 0.30 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.34 1gkq h GLU 322 Cb 0.80 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 1gkq h GLU 322 CO -0.07 0.56 -0.35 1.96 -0.73 0.00 0.00 179.01 180.39 1gkq h GLN 323 N 0.82 0.67 -0.65 1.92 4.20 -1.18 -2.75 115.11 118.14 1gkq h GLN 323 Ca 0.22 -0.32 0.01 0.00 0.06 0.00 0.00 58.65 58.62 1gkq h GLN 323 Cb -0.05 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.69 1gkq h GLN 323 CO -0.04 0.92 0.43 0.87 -0.67 0.00 0.00 178.83 180.34 1gkq h LYS 324 N 0.57 0.82 0.00 1.46 1.79 -0.56 -1.07 116.57 119.58 1gkq h LYS 324 Ca 0.06 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1gkq h LYS 324 Cb 0.86 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 1gkq h LYS 324 CO 0.07 0.54 0.00 1.28 -1.08 0.00 0.00 179.45 180.27 1gkq n LEU 325 N -4.44 0.00 0.16 2.94 4.77 -0.51 -2.43 117.00 117.49 1gkq n LEU 325 Ca 0.07 0.37 0.11 0.00 -0.03 0.00 0.00 56.01 56.53 1gkq n LEU 325 Cb 0.06 -0.37 0.57 0.00 -2.33 0.00 0.00 43.42 41.36 1gkq n LEU 325 CO 0.36 -0.26 0.83 0.18 -1.33 0.00 0.00 177.39 177.17 1gkq n LEU 326 N -1.37 0.58 -1.30 2.23 4.77 -0.40 -1.71 117.00 119.79 1gkq n LEU 326 Ca 0.03 0.75 -0.09 0.00 -0.03 0.00 0.00 56.01 56.67 1gkq n LEU 326 Cb 0.08 -0.80 0.14 0.00 -2.33 0.00 0.00 43.42 40.50 1gkq n LEU 326 CO 0.07 -0.90 0.43 0.61 -1.33 0.00 0.00 177.39 176.26 1gkq n GLY 327 N -1.12 5.57 0.28 -0.72 0.00 -1.02 -4.68 105.19 103.50 1gkq n GLY 327 Ca -0.01 -1.81 0.17 0.00 0.00 0.00 0.00 46.02 44.37 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 1.46 0.00 0.16 1.61 2.10 -1.55 -3.07 116.57 117.27 1gkq h LYS 328 Ca 0.21 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.52 1gkq h LYS 328 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1gkq h LYS 328 CO 0.43 0.03 -1.75 0.93 -2.00 0.00 0.00 179.45 177.08 1gkq h GLU 329 N 0.00 0.34 -3.24 0.07 4.39 -1.84 -3.47 114.58 110.82 1gkq h GLU 329 Ca -0.00 -0.58 -0.23 0.00 0.34 0.00 0.00 59.36 58.89 1gkq h GLU 329 Cb 0.48 0.22 -0.31 0.00 -0.10 0.00 0.00 28.75 29.04 1gkq h GLU 329 CO 0.00 1.28 -0.57 0.00 -1.16 0.00 0.00 179.01 178.56 1gkq s ALA 330 N -2.55 -0.32 0.59 3.43 0.00 -1.16 -4.83 121.76 116.92 1gkq s ALA 330 Ca -0.18 0.68 0.29 0.00 0.00 0.00 0.00 51.96 52.75 1gkq s ALA 330 Cb 0.05 -0.45 1.66 0.00 0.00 0.00 0.00 23.12 24.39 1gkq s ALA 330 CO 0.82 -0.15 2.11 0.27 0.00 0.00 0.00 175.76 178.80 1gkq h PHE 331 N 7.03 0.00 0.00 0.00 -0.00 -1.37 -0.05 116.94 122.55 1gkq h PHE 331 Ca -0.40 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.57 1gkq h PHE 331 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.10 1gkq h PHE 331 CO 0.42 0.00 0.00 0.25 -0.00 0.00 0.00 178.31 178.98 1gkq n THR 332 N -3.80 0.92 0.89 0.88 -2.24 -1.26 -2.05 114.28 107.61 1gkq n THR 332 Ca 0.01 0.41 0.11 0.00 -2.27 0.00 0.00 64.05 62.32 1gkq n THR 332 Cb 0.32 -1.37 0.10 0.00 -2.10 0.00 0.00 70.33 67.28 1gkq n THR 332 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gkq n ALA 333 N -1.77 2.46 -2.56 6.98 0.00 -0.03 -4.90 120.51 120.69 1gkq n ALA 333 Ca 0.01 -0.70 -0.43 0.00 0.00 0.00 0.00 53.44 52.32 1gkq n ALA 333 Cb 0.16 -0.76 -0.02 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.84 4.49 0.06 0.00 1.01 -0.87 -3.61 121.20 120.45 1gkq s ILE 334 Ca 0.27 1.79 -0.30 0.00 0.00 0.00 0.00 60.65 62.41 1gkq s ILE 334 Cb 0.19 -4.19 -0.09 0.00 0.01 0.00 0.00 42.46 38.37 1gkq s ILE 334 CO 0.28 -0.20 1.91 -2.16 0.00 0.00 0.00 174.94 174.78 1gkq s PRO 335 N 3.39 4.14 0.12 2.79 0.04 -1.26 -4.92 135.00 139.30 1gkq s PRO 335 Ca 0.49 2.59 -0.30 0.00 0.04 0.00 0.00 61.00 63.82 1gkq s PRO 335 Cb -0.17 -3.98 -0.07 0.00 0.04 0.00 0.00 34.50 30.32 1gkq s PRO 335 CO 0.11 -0.92 1.19 -0.80 0.04 0.00 0.00 177.00 176.62 1gkq s ASN 336 N 3.87 7.10 0.00 6.66 0.02 -1.26 -4.92 114.94 126.42 1gkq s ASN 336 Ca 0.86 2.10 0.00 0.00 -1.02 0.00 0.00 52.86 54.80 1gkq s ASN 336 Cb -0.43 -2.59 0.00 0.00 0.02 0.00 0.00 41.25 38.24 1gkq s ASN 336 CO 0.40 -0.40 0.00 0.61 0.02 0.00 0.00 177.10 177.72 1gkq n GLY 337 N 2.71 4.15 2.97 0.66 0.00 0.20 -4.89 105.19 110.99 1gkq n GLY 337 Ca 0.07 -0.83 -0.15 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 -1.87 0.39 0.30 -0.61 1.01 -1.08 -4.65 121.20 114.69 1gkq s ILE 338 Ca 0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 60.65 60.15 1gkq s ILE 338 Cb 0.00 -0.36 -0.09 0.00 0.01 0.00 0.00 42.46 42.02 1gkq s ILE 338 CO 0.00 0.03 0.76 -2.16 0.00 0.00 0.00 174.94 173.58 1gkq s PRO 339 N -0.32 4.13 0.00 2.79 0.04 -1.26 -1.90 135.00 138.48 1gkq s PRO 339 Ca 0.00 0.81 0.00 0.00 0.04 0.00 0.00 61.00 61.85 1gkq s PRO 339 Cb -0.03 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 31.95 1gkq s PRO 339 CO -0.00 0.22 0.00 0.00 0.04 0.00 0.00 177.00 177.26 1gkq n ALA 340 N -0.01 0.00 -0.13 8.56 0.00 -1.26 -4.42 120.51 123.25 1gkq n ALA 340 Ca 0.02 0.00 0.27 0.00 0.00 0.00 0.00 53.44 53.73 1gkq n ALA 340 Cb 0.52 0.00 0.72 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 0.37 0.56 0.00 0.00 2.10 -1.93 -1.25 117.51 117.36 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 0.18 0.59 -0.01 0.00 -1.09 0.00 0.00 36.82 36.49 1gkq h ILE 341 CO 0.00 0.00 -1.02 -0.08 -1.08 0.00 0.00 178.15 175.97 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 0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 1gkq h GLU 342 Cb 1.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.93 1gkq h GLU 342 CO -0.00 0.17 -0.96 -0.25 -0.73 0.00 0.00 179.01 177.24 1gkq n ASP 343 N -2.86 0.84 -0.18 1.04 8.00 -0.52 -4.12 116.55 118.75 1gkq n ASP 343 Ca -0.03 -0.82 -0.12 0.00 0.71 0.00 0.00 54.79 54.52 1gkq n ASP 343 Cb 0.68 1.09 -0.09 0.00 -0.02 0.00 0.00 41.12 42.78 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 -0.29 0.01 -1.24 2.43 -1.62 0.44 114.38 114.12 1gkq h ARG 344 Ca 0.00 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1gkq h ARG 344 Cb 0.47 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 1gkq h ARG 344 CO 0.00 -0.19 -0.09 0.28 -1.51 0.00 0.00 179.97 178.46 1gkq h VAL 345 N -0.30 0.77 -0.80 0.20 2.07 -1.84 0.96 116.25 117.31 1gkq h VAL 345 Ca 0.08 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.58 1gkq h VAL 345 Cb 0.52 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1gkq h VAL 345 CO -0.62 0.00 0.41 0.78 0.02 0.00 0.00 177.57 178.16 1gkq h ASN 346 N -0.16 1.02 -0.26 0.57 2.35 -1.74 0.95 115.58 118.31 1gkq h ASN 346 Ca 0.03 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.62 1gkq h ASN 346 Cb 0.20 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1gkq h ASN 346 CO -0.08 0.84 -0.07 -0.07 -1.65 0.00 0.00 177.43 176.40 1gkq h LEU 347 N 1.13 0.52 -0.46 1.61 3.38 -0.61 -0.91 115.31 119.97 1gkq h LEU 347 Ca 0.28 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1gkq h LEU 347 Cb 0.07 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1gkq h LEU 347 CO -0.04 0.77 0.09 0.25 0.09 0.00 0.00 178.44 179.61 1gkq h LEU 348 N 0.26 0.72 -0.22 1.67 5.85 -0.56 -1.40 115.31 121.63 1gkq h LEU 348 Ca 0.07 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1gkq h LEU 348 Cb 0.55 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1gkq h LEU 348 CO 0.03 0.78 0.10 0.22 -0.34 0.00 0.00 178.44 179.23 1gkq h TYR 349 N 0.63 0.31 0.83 1.25 3.20 -0.79 0.40 116.97 122.79 1gkq h TYR 349 Ca 0.14 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 1gkq h TYR 349 Cb 0.35 -0.10 0.01 0.00 1.54 0.00 0.00 36.73 38.54 1gkq h TYR 349 CO 0.02 0.31 -0.40 1.15 -1.64 0.00 0.00 178.16 177.61 1gkq h THR 350 N 0.22 0.05 0.00 1.81 2.02 -1.02 0.36 112.91 116.35 1gkq h THR 350 Ca 0.07 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1gkq h THR 350 Cb 0.12 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.59 1gkq h THR 350 CO -0.01 0.00 -0.07 -1.22 0.37 0.00 0.00 175.52 174.59 1gkq n TYR 351 N -5.52 0.40 -0.09 3.16 4.01 -0.54 -0.28 117.16 118.29 1gkq n TYR 351 Ca -0.14 0.12 -0.11 0.00 -0.16 0.00 0.00 57.90 57.60 1gkq n TYR 351 Cb 0.44 -0.67 -0.04 0.00 -0.31 0.00 0.00 39.34 38.77 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 1.42 -0.54 0.06 2.72 0.00 0.13 -3.36 105.19 105.61 1gkq n GLY 352 Ca 0.06 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.00 0.02 -0.43 1.61 2.07 -1.17 -0.49 116.25 116.87 1gkq h VAL 353 Ca -0.07 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.43 1gkq h VAL 353 Cb 1.05 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1gkq h VAL 353 CO -0.04 0.01 0.28 -1.28 0.02 0.00 0.00 177.57 176.56 1gkq h SER 354 N -1.00 0.50 -0.09 0.57 0.87 -0.93 -3.30 113.55 110.18 1gkq h SER 354 Ca -0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1gkq h SER 354 Cb 0.18 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1gkq h SER 354 CO -0.00 0.37 0.00 0.54 -0.53 0.00 0.00 176.83 177.21 1gkq n ARG 355 N -4.78 1.73 -0.02 2.24 1.74 0.61 -5.03 116.66 113.15 1gkq n ARG 355 Ca 0.01 -1.37 0.00 0.00 -0.77 0.00 0.00 57.85 55.72 1gkq n ARG 355 Cb 0.03 -1.10 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 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 0.03 7.55 1.00 -0.13 0.00 -1.02 -4.90 105.19 107.72 1gkq n GLY 356 Ca 0.04 -1.97 0.09 0.00 0.00 0.00 0.00 46.02 44.18 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 2.67 -2.40 1.61 1.74 -1.12 -4.73 116.66 114.42 1gkq n ARG 357 Ca 0.00 -2.30 -0.43 0.00 -0.77 0.00 0.00 57.85 54.35 1gkq n ARG 357 Cb 0.00 -1.42 -0.02 0.00 -1.02 0.00 0.00 32.46 30.00 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 -1.05 4.15 0.38 0.55 2.96 -0.22 -4.98 118.68 120.47 1gkq s LEU 358 Ca 0.36 1.66 -0.27 0.00 -0.22 0.00 0.00 54.13 55.65 1gkq s LEU 358 Cb 0.19 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 43.25 1gkq s LEU 358 CO 0.25 -0.81 1.35 -0.62 -1.32 0.00 0.00 176.35 175.20 1gkq s ASP 359 N 2.15 6.42 0.50 3.68 -1.08 -1.26 -3.99 116.67 123.09 1gkq s ASP 359 Ca 0.56 2.77 0.20 0.00 -0.52 0.00 0.00 52.55 55.56 1gkq s ASP 359 Cb -0.22 -2.65 1.30 0.00 -1.46 0.00 0.00 42.92 39.89 1gkq s ASP 359 CO 0.16 -0.79 2.09 -0.29 0.52 0.00 0.00 175.17 176.86 1gkq h ILE 360 N 2.73 0.87 0.04 4.11 2.10 -1.94 -1.41 117.51 124.01 1gkq h ILE 360 Ca -0.50 -0.38 -0.23 0.00 1.08 0.00 0.00 64.86 64.83 1gkq h ILE 360 Cb 1.24 1.22 -0.00 0.00 -1.09 0.00 0.00 36.82 38.18 1gkq h ILE 360 CO 0.64 0.10 -1.02 0.45 -1.08 0.00 0.00 178.15 177.24 1gkq h HIS 361 N 0.00 0.41 -0.04 2.19 3.86 -1.87 -2.70 115.15 117.00 1gkq h HIS 361 Ca -0.00 -0.26 -0.10 0.00 -1.16 0.00 0.00 60.37 58.86 1gkq h HIS 361 Cb 0.21 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 1gkq h HIS 361 CO 0.00 1.12 -0.43 -0.09 0.86 0.00 0.00 177.93 179.39 1gkq h ARG 362 N 0.12 0.09 -0.29 2.45 9.65 -1.73 -2.11 114.38 122.57 1gkq h ARG 362 Ca -0.08 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.73 1gkq h ARG 362 Cb 1.70 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 30.26 1gkq h ARG 362 CO 0.16 0.51 0.08 0.35 2.80 0.00 0.00 179.97 183.87 1gkq h PHE 363 N 0.08 0.47 -0.61 2.20 3.57 -1.12 0.81 116.94 122.33 1gkq h PHE 363 Ca 0.00 -0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.36 1gkq h PHE 363 Cb 0.79 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 1gkq h PHE 363 CO 0.01 0.50 0.00 0.28 -2.23 0.00 0.00 178.31 176.87 1gkq h VAL 364 N 0.30 1.27 -0.28 1.41 2.07 -1.28 -1.24 116.25 118.50 1gkq h VAL 364 Ca 0.09 -1.16 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 1gkq h VAL 364 Cb 0.26 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1gkq h VAL 364 CO -0.00 0.42 0.02 -0.78 0.02 0.00 0.00 177.57 177.25 1gkq h ASP 365 N 0.98 0.47 0.82 0.57 3.58 -1.22 0.00 116.42 121.62 1gkq h ASP 365 Ca 0.17 -0.28 -0.07 0.00 0.42 0.00 0.00 57.03 57.27 1gkq h ASP 365 Cb 0.56 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.48 1gkq h ASP 365 CO 0.03 0.64 -0.35 0.00 -2.88 0.00 0.00 179.24 176.68 1gkq h ALA 366 N 0.85 1.02 -0.01 -0.78 0.00 -0.75 -0.70 119.26 118.89 1gkq h ALA 366 Ca 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1gkq h ALA 366 Cb 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1gkq h ALA 366 CO 0.01 0.44 -0.36 0.00 0.00 0.00 0.00 179.25 179.34 1gkq n ALA 367 N -2.29 3.25 0.02 0.00 0.00 -0.48 -1.13 120.51 119.88 1gkq n ALA 367 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1gkq n ALA 367 Cb 0.49 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.28 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 0.03 -0.17 -0.07 0.00 2.88 -0.04 -1.63 113.62 114.62 1gkq n SER 368 Ca 0.08 0.06 -0.08 0.00 -1.33 0.00 0.00 58.87 57.61 1gkq n SER 368 Cb 0.40 0.35 -0.01 0.00 -0.75 0.00 0.00 64.21 64.20 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 0.90 -0.49 2.46 2.02 -1.50 -2.67 112.91 113.63 1gkq h THR 369 Ca 0.00 -0.07 0.04 0.00 0.77 0.00 0.00 66.41 67.16 1gkq h THR 369 Cb 0.00 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 1gkq h THR 369 CO 0.00 0.04 0.25 0.50 0.37 0.00 0.00 175.52 176.67 1gkq h LYS 370 N 0.19 0.47 -0.71 6.66 1.63 -1.39 -0.79 116.57 122.63 1gkq h LYS 370 Ca 0.13 -0.03 -0.06 0.00 -0.85 0.00 0.00 60.65 59.84 1gkq h LYS 370 Cb 0.11 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 1gkq h LYS 370 CO -0.15 0.31 0.23 0.00 -3.45 0.00 0.00 179.45 176.39 1gkq h ALA 371 N 1.26 1.06 -0.76 5.00 0.00 -1.75 -0.32 119.26 123.75 1gkq h ALA 371 Ca 0.21 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1gkq h ALA 371 Cb 0.12 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1gkq h ALA 371 CO -0.15 0.64 0.32 0.00 0.00 0.00 0.00 179.25 180.07 1gkq h ALA 372 N 1.19 1.13 0.07 0.00 0.00 -1.05 -1.85 119.26 118.75 1gkq h ALA 372 Ca 0.23 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1gkq h ALA 372 Cb 0.29 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1gkq h ALA 372 CO -0.01 0.63 -0.03 0.87 0.00 0.00 0.00 179.25 180.71 1gkq h LYS 373 N 1.10 -0.09 -0.89 0.00 1.57 -0.59 0.27 116.57 117.94 1gkq h LYS 373 Ca 0.26 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.08 1gkq h LYS 373 Cb 0.18 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 1gkq h LYS 373 CO -0.03 0.30 0.58 -0.07 -0.57 0.00 0.00 179.45 179.67 1gkq h LEU 374 N -0.51 0.96 -3.56 2.94 3.38 -0.99 -3.01 115.31 114.52 1gkq h LEU 374 Ca -0.01 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1gkq h LEU 374 Cb 0.43 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 1gkq h LEU 374 CO 0.02 0.66 0.10 0.49 0.09 0.00 0.00 178.44 179.80 1gkq n PHE 375 N -4.44 1.95 -1.89 1.13 3.72 -0.70 -4.96 117.46 112.27 1gkq n PHE 375 Ca 0.12 -0.99 -0.14 0.00 -0.05 0.00 0.00 57.45 56.39 1gkq n PHE 375 Cb 0.10 -0.54 -0.03 0.00 -0.94 0.00 0.00 39.48 38.07 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 0.55 0.05 1.37 0.00 -1.09 -4.89 105.19 101.19 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 0.57 -4.82 0.99 4.77 0.84 -4.69 117.00 112.78 1gkq n LEU 377 Ca -0.16 0.06 -0.35 0.00 -0.03 0.00 0.00 56.01 55.53 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 -0.01 0.45 0.12 -1.33 0.00 0.00 177.39 176.83 1gkq s PHE 378 N -3.29 3.59 -2.28 -1.77 2.19 -0.51 -0.10 117.98 115.82 1gkq s PHE 378 Ca 0.01 1.41 0.24 0.00 0.33 0.00 0.00 56.93 58.91 1gkq s PHE 378 Cb 0.13 -2.64 1.02 0.00 -1.31 0.00 0.00 43.02 40.22 1gkq s PHE 378 CO 0.82 0.26 1.71 -0.35 1.83 0.00 0.00 175.22 179.48 1gkq n PRO 379 N 0.45 1.53 -0.17 10.12 -0.04 -1.26 -4.85 135.00 140.77 1gkq n PRO 379 Ca -0.00 -0.78 -0.02 0.00 -0.04 0.00 0.00 63.50 62.66 1gkq n PRO 379 Cb 0.51 -1.42 0.08 0.00 -0.04 0.00 0.00 33.50 32.63 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 1.70 0.30 -5.48 0.54 2.43 -1.80 -3.43 114.38 108.64 1gkq h ARG 380 Ca 0.00 -0.02 -0.63 0.00 -0.81 0.00 0.00 59.98 58.52 1gkq h ARG 380 Cb 0.37 -0.07 -0.13 0.00 -0.42 0.00 0.00 29.97 29.72 1gkq h ARG 380 CO 0.00 0.20 -0.57 0.15 -1.51 0.00 0.00 179.97 178.23 1gkq s LYS 381 N -6.12 2.00 0.00 0.20 -0.14 0.86 -1.77 119.74 114.77 1gkq s LYS 381 Ca -0.13 -2.18 0.00 0.00 -1.36 0.00 0.00 55.97 52.30 1gkq s LYS 381 Cb 0.16 -1.52 0.00 0.00 -1.68 0.00 0.00 37.83 34.78 1gkq s LYS 381 CO 0.73 -0.16 0.00 0.41 -0.76 0.00 0.00 175.35 175.57 1gkq n GLY 382 N -1.03 0.84 3.83 -3.33 0.00 -1.26 -4.08 105.19 100.16 1gkq n GLY 382 Ca -0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.02 -0.01 0.00 -1.21 0.00 0.00 61.69 59.44 1gkq s THR 383 Cb 0.00 -2.25 0.05 0.00 -1.51 0.00 0.00 72.50 68.79 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 -3.49 2.92 -0.11 5.08 1.01 -1.26 -4.86 121.20 120.49 1gkq s ILE 384 Ca 0.13 -1.34 -0.30 0.00 0.00 0.00 0.00 60.65 59.14 1gkq s ILE 384 Cb -0.06 -2.65 0.12 0.00 0.01 0.00 0.00 42.46 39.88 1gkq s ILE 384 CO 0.08 -0.05 0.96 0.00 0.00 0.00 0.00 174.94 175.93 1gkq s ALA 385 N 1.26 -1.90 0.18 9.38 0.00 -1.26 -5.05 121.76 124.36 1gkq s ALA 385 Ca -0.05 1.42 -0.33 0.00 0.00 0.00 0.00 51.96 53.00 1gkq s ALA 385 Cb -0.19 -0.36 -0.14 0.00 0.00 0.00 0.00 23.12 22.43 1gkq s ALA 385 CO -0.02 -0.42 1.45 0.28 0.00 0.00 0.00 175.76 177.05 1gkq n VAL 386 N 0.45 0.39 0.00 0.00 0.31 -1.26 -1.30 118.33 116.92 1gkq n VAL 386 Ca -0.10 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 1gkq n VAL 386 Cb 0.59 -1.34 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 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 2.74 2.98 3.83 2.92 0.00 -0.41 -4.98 105.19 112.26 1gkq n GLY 387 Ca 0.15 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 -0.07 5.90 0.39 1.61 0.01 -0.42 -4.70 113.70 116.43 1gkq s SER 388 Ca 0.00 1.65 -0.27 0.00 1.31 0.00 0.00 55.95 58.64 1gkq s SER 388 Cb 0.00 -2.51 -0.10 0.00 0.21 0.00 0.00 66.02 63.63 1gkq s SER 388 CO 0.00 -1.09 1.38 -1.81 0.41 0.00 0.00 173.24 172.13 1gkq s ASP 389 N -3.35 6.33 -1.39 2.44 1.01 -0.73 -0.85 116.67 120.12 1gkq s ASP 389 Ca 0.60 2.82 -0.09 0.00 0.71 0.00 0.00 52.55 56.59 1gkq s ASP 389 Cb -0.13 -2.65 -0.08 0.00 1.01 0.00 0.00 42.92 41.06 1gkq s ASP 389 CO 0.44 -0.86 2.72 0.00 0.21 0.00 0.00 175.17 177.68 1gkq n ALA 390 N 0.29 6.71 -2.95 5.23 0.00 0.94 -4.70 120.51 126.04 1gkq n ALA 390 Ca 0.02 -3.05 -0.45 0.00 0.00 0.00 0.00 53.44 49.97 1gkq n ALA 390 Cb 0.42 -3.25 -0.06 0.00 0.00 0.00 0.00 19.45 16.55 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 2.53 6.18 0.15 0.00 1.11 -1.26 -1.76 116.67 123.62 1gkq s ASP 391 Ca 0.61 -1.31 0.07 0.00 0.18 0.00 0.00 52.55 52.09 1gkq s ASP 391 Cb 0.16 -2.23 -0.04 0.00 1.07 0.00 0.00 42.92 41.88 1gkq s ASP 391 CO -0.05 -0.80 -0.16 -0.76 1.18 0.00 0.00 175.17 174.58 1gkq s LEU 392 N 2.02 2.44 -0.23 1.23 1.43 -1.09 -1.17 118.68 123.29 1gkq s LEU 392 Ca 0.08 -0.86 -0.01 0.00 -1.03 0.00 0.00 54.13 52.30 1gkq s LEU 392 Cb -0.24 -0.66 0.07 0.00 0.03 0.00 0.00 46.19 45.39 1gkq s LEU 392 CO 0.07 -0.11 0.03 -0.69 0.23 0.00 0.00 176.35 175.88 1gkq s VAL 393 N -2.23 0.88 -0.52 -1.59 1.01 -0.63 -1.06 120.40 116.27 1gkq s VAL 393 Ca 0.13 -0.94 -0.26 0.00 0.00 0.00 0.00 61.98 60.91 1gkq s VAL 393 Cb -0.05 -1.39 0.03 0.00 0.00 0.00 0.00 36.38 34.98 1gkq s VAL 393 CO 0.05 -0.30 1.03 -0.69 0.00 0.00 0.00 175.10 175.19 1gkq s VAL 394 N 1.67 4.30 -0.17 2.92 1.01 0.69 -1.20 120.40 129.62 1gkq s VAL 394 Ca 0.00 0.72 -0.10 0.00 0.00 0.00 0.00 61.98 62.61 1gkq s VAL 394 Cb -0.18 -4.56 -0.05 0.00 0.00 0.00 0.00 36.38 31.60 1gkq s VAL 394 CO -0.12 -1.06 0.15 -0.47 0.00 0.00 0.00 175.10 173.60 1gkq s TYR 395 N 4.20 3.47 -0.46 5.22 5.04 0.13 -0.09 117.35 134.87 1gkq s TYR 395 Ca 0.38 0.42 -0.15 0.00 -2.44 0.00 0.00 57.07 55.28 1gkq s TYR 395 Cb -0.10 -2.12 0.06 0.00 0.35 0.00 0.00 41.96 40.15 1gkq s TYR 395 CO 0.25 0.41 0.37 0.34 -1.34 0.00 0.00 175.55 175.58 1gkq s ASP 396 N -0.01 6.14 0.00 4.32 2.15 -0.51 -1.28 116.67 127.48 1gkq s ASP 396 Ca 0.11 -1.23 0.31 0.00 0.43 0.00 0.00 52.55 52.17 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 5.19 0.79 0.03 4.34 -0.04 -1.26 -2.81 135.00 141.23 1gkq n PRO 397 Ca -0.12 -0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.44 1gkq n PRO 397 Cb 0.44 -1.50 0.05 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 -1.10 0.24 -2.11 0.54 1.13 -1.26 -4.72 117.38 110.10 1gkq n GLN 398 Ca 0.20 0.01 -0.39 0.00 -1.94 0.00 0.00 57.00 54.88 1gkq n GLN 398 Cb 0.16 -1.59 -0.01 0.00 0.11 0.00 0.00 30.24 28.92 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 -3.16 2.85 -0.03 1.08 5.04 -1.21 -4.98 117.35 116.94 1gkq s TYR 399 Ca 0.05 1.45 -0.01 0.00 -2.44 0.00 0.00 57.07 56.13 1gkq s TYR 399 Cb 0.15 -3.59 0.03 0.00 0.35 0.00 0.00 41.96 38.90 1gkq s TYR 399 CO 0.79 -1.90 0.06 1.03 -1.34 0.00 0.00 175.55 174.18 1gkq s ARG 400 N -2.33 -0.01 0.00 4.97 1.81 -1.26 -2.76 118.95 119.37 1gkq s ARG 400 Ca 0.58 0.24 0.00 0.00 -1.72 0.00 0.00 55.73 54.84 1gkq s ARG 400 Cb -0.36 -0.24 0.00 0.00 -0.45 0.00 0.00 34.95 33.90 1gkq s ARG 400 CO 0.45 -0.18 0.00 0.41 -0.68 0.00 0.00 175.30 175.31 1gkq n GLY 401 N 4.24 1.63 3.04 -3.53 0.00 -1.08 -5.02 105.19 104.47 1gkq n GLY 401 Ca -0.27 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.60 0.42 0.19 2.61 -4.23 -1.26 -1.49 115.64 109.28 1gkq s THR 402 Ca 0.00 -1.01 -0.27 0.00 -1.18 0.00 0.00 61.69 59.24 1gkq s THR 402 Cb 0.00 -0.51 -0.08 0.00 1.34 0.00 0.00 72.50 73.25 1gkq s THR 402 CO 0.00 -0.40 0.82 -0.63 -0.54 0.00 0.00 174.62 173.87 1gkq s ILE 403 N -1.37 4.29 -0.06 2.99 1.01 0.50 -4.94 121.20 123.62 1gkq s ILE 403 Ca -0.11 1.81 -0.23 0.00 0.00 0.00 0.00 60.65 62.12 1gkq s ILE 403 Cb -0.10 -4.19 0.05 0.00 0.01 0.00 0.00 42.46 38.23 1gkq s ILE 403 CO 0.00 0.52 0.51 -0.55 0.00 0.00 0.00 174.94 175.42 1gkq s SER 404 N -1.15 -0.46 0.47 3.58 0.15 -1.26 -0.44 113.70 114.58 1gkq s SER 404 Ca 0.37 0.55 0.19 0.00 0.70 0.00 0.00 55.95 57.76 1gkq s SER 404 Cb -0.24 0.56 1.16 0.00 -1.71 0.00 0.00 66.02 65.79 1gkq s SER 404 CO 0.28 -0.47 2.02 1.62 1.20 0.00 0.00 173.24 177.89 1gkq h VAL 405 N 3.57 0.94 0.00 4.45 3.04 -1.93 -2.08 116.25 124.24 1gkq h VAL 405 Ca -0.28 -0.60 0.00 0.00 -1.01 0.00 0.00 66.70 64.81 1gkq h VAL 405 Cb 1.16 1.34 0.00 0.00 -2.01 0.00 0.00 31.29 31.78 1gkq h VAL 405 CO 0.35 0.16 0.00 0.11 -1.01 0.00 0.00 177.57 177.18 1gkq h LYS 406 N 0.00 0.00 0.00 4.17 1.57 -1.98 -2.80 116.57 117.53 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 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1gkq h LYS 406 CO 0.02 0.00 -0.01 0.25 -0.57 0.00 0.00 179.45 179.14 1gkq n THR 407 N -3.07 0.86 -2.23 -0.16 -2.24 -0.80 -5.07 114.28 101.56 1gkq n THR 407 Ca -0.02 -0.89 -0.26 0.00 -2.27 0.00 0.00 64.05 60.61 1gkq n THR 407 Cb 0.10 0.54 0.06 0.00 -2.10 0.00 0.00 70.33 68.93 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 -0.93 2.38 0.00 -0.78 -2.07 -1.06 -4.98 119.66 112.22 1gkq s GLN 408 Ca 0.02 -0.17 0.00 0.00 -1.82 0.00 0.00 55.36 53.39 1gkq s GLN 408 Cb 0.02 -2.19 0.00 0.00 -1.09 0.00 0.00 33.01 29.75 1gkq s GLN 408 CO 0.00 -1.11 0.73 0.72 -1.32 0.00 0.00 175.29 174.31 1gkq n HIS 409 N -2.85 0.00 -2.42 9.60 8.25 -1.26 -5.00 115.22 121.54 1gkq n HIS 409 Ca 0.07 -0.23 -0.41 0.00 -0.26 0.00 0.00 57.72 56.89 1gkq n HIS 409 Cb 0.60 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.65 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 -0.45 3.72 0.00 1.59 1.01 -1.26 -4.62 120.40 120.38 1gkq s VAL 410 Ca 0.00 1.42 -0.03 0.00 0.00 0.00 0.00 61.98 63.36 1gkq s VAL 410 Cb 0.00 -3.90 -0.14 0.00 0.00 0.00 0.00 36.38 32.33 1gkq s VAL 410 CO 0.00 0.21 2.31 -3.20 0.00 0.00 0.00 175.10 174.42 1gkq n ASN 411 N 2.69 3.41 -3.70 3.32 5.15 -1.26 -4.81 115.26 120.06 1gkq n ASN 411 Ca 0.05 -2.10 -0.16 0.00 -0.60 0.00 0.00 54.58 51.77 1gkq n ASN 411 Cb 0.45 -0.89 -0.08 0.00 -0.53 0.00 0.00 39.78 38.73 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 2.29 0.96 -0.07 1.20 4.22 -1.26 -4.58 114.94 117.70 1gkq s ASN 412 Ca 0.36 -1.56 0.16 0.00 -2.14 0.00 0.00 52.86 49.67 1gkq s ASN 412 Cb 0.17 0.50 0.58 0.00 1.28 0.00 0.00 41.25 43.78 1gkq s ASN 412 CO 0.00 -1.00 1.47 -0.90 -2.04 0.00 0.00 177.10 174.63 1gkq n ASP 413 N -1.00 3.81 -3.56 3.54 5.75 -1.26 -4.95 116.55 118.88 1gkq n ASP 413 Ca 0.05 -2.28 -0.15 0.00 -0.01 0.00 0.00 54.79 52.40 1gkq n ASP 413 Cb 0.64 -0.49 -0.05 0.00 -1.03 0.00 0.00 41.12 40.18 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 -1.66 -0.48 -0.10 2.11 1.13 -1.26 -4.91 117.35 112.18 1gkq s TYR 414 Ca 0.42 0.61 0.02 0.00 -1.41 0.00 0.00 57.07 56.70 1gkq s TYR 414 Cb 0.26 0.37 -0.02 0.00 -1.10 0.00 0.00 41.96 41.47 1gkq s TYR 414 CO 0.22 -0.64 -0.16 1.21 -2.51 0.00 0.00 175.55 173.67 1gkq s ASN 415 N -1.82 3.82 0.57 -0.18 3.84 -1.26 -4.89 114.94 115.01 1gkq s ASN 415 Ca -0.07 -0.34 0.35 0.00 0.21 0.00 0.00 52.86 53.01 1gkq s ASN 415 Cb -0.01 -1.34 1.57 0.00 -0.55 0.00 0.00 41.25 40.91 1gkq s ASN 415 CO 0.00 0.21 2.06 1.23 -2.79 0.00 0.00 177.10 177.82 1gkq h GLY 416 N 6.34 0.00 -2.42 1.21 0.00 -1.94 -3.03 103.07 103.23 1gkq h GLY 416 Ca -0.30 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 46.75 1gkq h GLY 416 CO 0.53 0.00 -0.24 0.69 0.00 0.00 0.00 176.54 177.51 1gkq n PHE 417 N -3.14 1.46 -1.66 5.60 3.72 -1.26 -5.04 117.46 117.15 1gkq n PHE 417 Ca -0.00 -1.85 -0.52 0.00 -0.05 0.00 0.00 57.45 55.02 1gkq n PHE 417 Cb 0.26 -0.50 -0.06 0.00 -0.94 0.00 0.00 39.48 38.24 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 -1.02 1.48 0.00 -1.08 4.07 -1.15 -1.11 120.64 121.83 1gkq n GLU 418 Ca 0.36 0.54 0.00 0.00 -0.06 0.00 0.00 57.16 58.00 1gkq n GLU 418 Cb 0.93 -2.25 0.00 0.00 -0.06 0.00 0.00 31.44 30.07 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 3.48 2.26 3.76 8.31 0.00 0.41 -5.00 105.19 118.41 1gkq n GLY 419 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.28 2.88 0.32 1.61 0.40 -0.27 -4.66 117.98 115.97 1gkq s PHE 420 Ca 0.00 1.16 -0.13 0.00 -0.60 0.00 0.00 56.93 57.36 1gkq s PHE 420 Cb 0.00 -3.86 -0.08 0.00 0.51 0.00 0.00 43.02 39.59 1gkq s PHE 420 CO 0.00 -2.60 0.70 -1.21 0.70 0.00 0.00 175.22 172.81 1gkq s GLU 421 N -1.31 3.92 -0.01 0.44 2.02 -1.26 -0.37 118.70 122.14 1gkq s GLU 421 Ca 0.55 0.55 0.02 0.00 0.02 0.00 0.00 54.97 56.11 1gkq s GLU 421 Cb -0.43 -2.47 -0.00 0.00 0.10 0.00 0.00 34.13 31.33 1gkq s GLU 421 CO 0.52 0.16 -0.08 0.96 0.02 0.00 0.00 175.26 176.84 1gkq s ILE 422 N -2.01 0.64 -0.48 -1.63 -4.36 -0.55 -4.91 121.20 107.89 1gkq s ILE 422 Ca 0.52 -0.32 0.03 0.00 -0.26 0.00 0.00 60.65 60.62 1gkq s ILE 422 Cb -0.10 -0.55 0.64 0.00 1.25 0.00 0.00 42.46 43.69 1gkq s ILE 422 CO 0.20 0.19 1.93 0.47 0.24 0.00 0.00 174.94 177.98 1gkq n ASP 423 N 3.04 4.31 0.00 4.36 8.00 -1.26 -2.62 116.55 132.38 1gkq n ASP 423 Ca -0.15 -3.64 0.00 0.00 0.71 0.00 0.00 54.79 51.71 1gkq n ASP 423 Cb 0.56 -0.86 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 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 0.57 3.56 0.44 0.00 -1.11 -4.57 105.19 102.96 1gkq n GLY 424 Ca 0.60 -0.92 -0.06 0.00 0.00 0.00 0.00 46.02 45.64 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 0.50 0.19 1.61 1.70 -1.12 -4.89 118.95 114.93 1gkq s ARG 425 Ca 0.00 -0.16 -0.30 0.00 -0.47 0.00 0.00 55.73 54.80 1gkq s ARG 425 Cb 0.00 0.23 -0.08 0.00 -0.57 0.00 0.00 34.95 34.53 1gkq s ARG 425 CO 0.00 -0.21 1.25 -2.14 -1.08 0.00 0.00 175.30 173.11 1gkq s PRO 426 N -2.54 4.44 -0.26 3.89 0.02 -1.26 -1.42 135.00 137.88 1gkq s PRO 426 Ca 0.07 1.95 -0.06 0.00 0.02 0.00 0.00 61.00 62.98 1gkq s PRO 426 Cb -0.01 -3.22 -0.16 0.00 0.02 0.00 0.00 34.50 31.13 1gkq s PRO 426 CO -0.06 -0.16 -0.23 0.45 -0.33 0.00 0.00 177.00 176.67 1gkq n SER 427 N 2.60 1.98 -3.90 2.53 2.88 0.88 -4.49 113.62 116.09 1gkq n SER 427 Ca 0.05 0.09 -0.16 0.00 -1.33 0.00 0.00 58.87 57.52 1gkq n SER 427 Cb 0.44 -0.62 -0.15 0.00 -0.75 0.00 0.00 64.21 63.13 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 0.32 -0.05 2.46 1.01 -1.02 -0.12 120.40 120.48 1gkq s VAL 428 Ca -0.36 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1gkq s VAL 428 Cb 0.11 -0.33 0.02 0.00 0.00 0.00 0.00 36.38 36.18 1gkq s VAL 428 CO 0.57 0.13 -0.08 -0.69 0.00 0.00 0.00 175.10 175.03 1gkq s VAL 429 N 0.37 0.78 0.15 2.92 1.01 -0.45 -0.22 120.40 124.97 1gkq s VAL 429 Ca -0.04 -0.27 0.10 0.00 0.00 0.00 0.00 61.98 61.78 1gkq s VAL 429 Cb -0.07 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 1gkq s VAL 429 CO -0.01 0.28 -0.24 0.42 0.00 0.00 0.00 175.10 175.55 1gkq s THR 430 N 0.81 2.17 -0.21 3.92 -4.23 -0.22 -0.21 115.64 117.67 1gkq s THR 430 Ca -0.13 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 1gkq s THR 430 Cb -0.15 -1.97 0.05 0.00 1.34 0.00 0.00 72.50 71.78 1gkq s THR 430 CO 0.02 -0.05 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.29 1gkq s VAL 431 N -1.40 1.41 -1.41 2.29 1.01 0.13 -2.68 120.40 119.76 1gkq s VAL 431 Ca 0.16 -0.99 -0.00 0.00 0.00 0.00 0.00 61.98 61.14 1gkq s VAL 431 Cb -0.09 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 34.68 1gkq s VAL 431 CO 0.07 0.02 0.40 0.54 0.00 0.00 0.00 175.10 176.14 1gkq n ARG 432 N 4.74 -3.21 -0.40 2.72 1.74 -1.11 -1.72 116.66 119.42 1gkq n ARG 432 Ca -0.13 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.35 1gkq n ARG 432 Cb 0.46 -4.50 0.00 0.00 -1.02 0.00 0.00 32.46 27.40 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 -2.00 1.63 3.42 -0.13 0.00 -0.72 -4.13 105.19 103.25 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 -0.21 3.52 0.06 1.61 2.20 -0.70 -4.74 119.74 121.49 1gkq s LYS 434 Ca 0.00 -0.59 -0.31 0.00 -0.36 0.00 0.00 55.97 54.71 1gkq s LYS 434 Cb 0.00 -2.87 -0.08 0.00 -1.51 0.00 0.00 37.83 33.37 1gkq s LYS 434 CO 0.00 0.12 1.58 0.08 -0.36 0.00 0.00 175.35 176.77 1gkq s VAL 435 N 0.65 3.16 -0.06 4.02 1.01 -1.26 -0.69 120.40 127.23 1gkq s VAL 435 Ca -0.04 0.63 0.09 0.00 0.00 0.00 0.00 61.98 62.67 1gkq s VAL 435 Cb -0.15 -3.41 -0.14 0.00 0.00 0.00 0.00 36.38 32.69 1gkq s VAL 435 CO 0.02 0.00 0.11 0.00 0.00 0.00 0.00 175.10 175.24 1gkq n ALA 436 N 5.38 2.00 -3.72 5.51 0.00 0.71 -4.55 120.51 125.84 1gkq n ALA 436 Ca 0.15 -0.49 -0.21 0.00 0.00 0.00 0.00 53.44 52.89 1gkq n ALA 436 Cb 0.41 -0.11 -0.17 0.00 0.00 0.00 0.00 19.45 19.58 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 -2.42 0.21 -0.15 0.00 1.01 -0.85 -0.61 120.40 117.59 1gkq s VAL 437 Ca -0.04 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1gkq s VAL 437 Cb 0.04 -0.38 0.03 0.00 0.00 0.00 0.00 36.38 36.08 1gkq s VAL 437 CO 0.41 0.21 -0.10 -0.60 0.00 0.00 0.00 175.10 175.02 1gkq s ARG 438 N 1.78 1.86 -1.36 2.72 3.52 -0.35 -1.34 118.95 125.78 1gkq s ARG 438 Ca 0.01 -0.51 -0.03 0.00 -0.13 0.00 0.00 55.73 55.08 1gkq s ARG 438 Cb -0.13 -1.99 -0.00 0.00 -1.56 0.00 0.00 34.95 31.28 1gkq s ARG 438 CO -0.04 -0.32 0.50 -0.25 -0.81 0.00 0.00 175.30 174.39 1gkq n ASP 439 N 4.83 -0.99 0.00 -2.12 8.00 0.83 -0.88 116.55 126.21 1gkq n ASP 439 Ca -0.14 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.37 1gkq n ASP 439 Cb 0.49 -3.23 0.00 0.00 -0.02 0.00 0.00 41.12 38.36 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 -1.89 0.35 3.58 0.44 0.00 -1.24 -4.99 105.19 101.43 1gkq n GLY 440 Ca -0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.78 3.68 -0.26 1.61 -1.52 -0.06 -5.08 119.66 117.25 1gkq s GLN 441 Ca 0.00 -0.43 -0.25 0.00 -1.95 0.00 0.00 55.36 52.73 1gkq s GLN 441 Cb 0.00 -3.01 -0.00 0.00 -0.22 0.00 0.00 33.01 29.78 1gkq s GLN 441 CO 0.00 0.33 0.83 0.12 -0.25 0.00 0.00 175.29 176.32 1gkq s PHE 442 N 0.16 3.27 -0.13 0.91 5.36 -1.26 -1.21 117.98 125.08 1gkq s PHE 442 Ca 0.01 1.06 0.15 0.00 -0.96 0.00 0.00 56.93 57.19 1gkq s PHE 442 Cb -0.13 -3.13 0.37 0.00 -0.34 0.00 0.00 43.02 39.78 1gkq s PHE 442 CO 0.02 -0.47 1.18 1.33 -1.46 0.00 0.00 175.22 175.82 1gkq n VAL 443 N 5.36 1.40 -1.05 3.12 0.24 0.22 -5.00 118.33 122.63 1gkq n VAL 443 Ca 0.05 -2.24 -0.31 0.00 -2.04 0.00 0.00 64.34 59.81 1gkq n VAL 443 Cb 0.48 0.14 0.12 0.00 -1.47 0.00 0.00 33.84 33.11 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 -2.67 1.67 -0.23 7.63 0.00 -0.97 -4.71 107.32 108.04 1gkq s GLY 444 Ca 0.33 0.34 -0.06 0.00 0.00 0.00 0.00 44.72 45.33 1gkq s GLY 444 CO -0.07 0.73 0.02 1.85 0.00 0.00 0.00 173.10 175.63 1gkq s GLU 445 N -4.81 3.58 0.29 2.90 2.12 -1.26 -5.08 118.70 116.43 1gkq s GLU 445 Ca 0.63 -0.52 -0.30 0.00 0.36 0.00 0.00 54.97 55.14 1gkq s GLU 445 Cb -0.19 -3.19 -0.12 0.00 0.26 0.00 0.00 34.13 30.89 1gkq s GLU 445 CO 0.57 -0.14 1.50 1.63 -0.54 0.00 0.00 175.26 178.28 1gkq n LYS 446 N 4.73 2.44 -0.95 4.30 5.02 -1.26 -2.17 118.16 130.27 1gkq n LYS 446 Ca -0.17 0.87 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 1gkq n LYS 446 Cb 0.51 -2.59 0.00 0.00 -0.02 0.00 0.00 35.03 32.94 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 1.90 0.70 0.28 0.72 0.00 -1.20 -4.89 105.19 102.70 1gkq n GLY 447 Ca 0.09 0.00 -0.07 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 0.91 -3.95 1.61 -0.00 -1.39 -3.43 115.95 109.71 1gkq h TRP 448 Ca 0.00 -0.17 -0.54 0.00 -0.00 0.00 0.00 58.89 58.18 1gkq h TRP 448 Cb 0.05 -0.23 0.11 0.00 -0.00 0.00 0.00 29.16 29.09 1gkq h TRP 448 CO 0.03 0.89 0.78 0.20 -0.00 0.00 0.00 178.44 180.34 1gkq s GLY 449 N -3.77 2.94 0.31 2.65 0.00 0.45 -4.89 107.32 105.02 1gkq s GLY 449 Ca -0.10 1.58 0.11 0.00 0.00 0.00 0.00 44.72 46.31 1gkq s GLY 449 CO 0.83 2.26 -0.15 0.54 0.00 0.00 0.00 173.10 176.58 1gkq s LYS 450 N -2.11 1.73 -0.10 2.90 -0.14 -1.26 -4.68 119.74 116.08 1gkq s LYS 450 Ca 0.53 -1.84 -0.26 0.00 -1.36 0.00 0.00 55.97 53.04 1gkq s LYS 450 Cb -0.46 -1.72 -0.02 0.00 -1.68 0.00 0.00 37.83 33.94 1gkq s LYS 450 CO 0.63 0.24 0.83 -1.17 -0.76 0.00 0.00 175.35 175.12 1gkq s LEU 451 N -3.55 4.27 -0.27 3.17 2.96 -1.26 -1.65 118.68 122.35 1gkq s LEU 451 Ca 0.31 1.30 -0.16 0.00 -0.22 0.00 0.00 54.13 55.36 1gkq s LEU 451 Cb -0.01 -3.27 -0.03 0.00 0.50 0.00 0.00 46.19 43.37 1gkq s LEU 451 CO 0.15 -0.28 0.44 -0.76 -1.32 0.00 0.00 176.35 174.58 1gkq s LEU 452 N 1.47 4.04 -0.09 -0.68 1.43 0.91 -4.94 118.68 120.81 1gkq s LEU 452 Ca 0.41 0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 53.79 1gkq s LEU 452 Cb -0.18 -2.53 -0.05 0.00 0.03 0.00 0.00 46.19 43.46 1gkq s LEU 452 CO 0.18 -0.23 0.29 -0.13 0.23 0.00 0.00 176.35 176.69 1gkq s ARG 453 N 2.18 3.91 0.33 1.70 0.52 -1.26 -4.71 118.95 121.61 1gkq s ARG 453 Ca 0.18 0.14 0.09 0.00 -0.52 0.00 0.00 55.73 55.62 1gkq s ARG 453 Cb -0.16 -3.29 -0.05 0.00 0.52 0.00 0.00 34.95 31.98 1gkq s ARG 453 CO 0.10 0.55 0.05 1.03 0.02 0.00 0.00 175.30 177.05 1gkq s ARG 454 N -0.49 2.22 -0.13 3.54 3.00 0.70 -5.02 118.95 122.78 1gkq s ARG 454 Ca 0.19 -1.62 -0.02 0.00 0.00 0.00 0.00 55.73 54.27 1gkq s ARG 454 Cb -0.14 -2.06 -0.03 0.00 0.00 0.00 0.00 34.95 32.72 1gkq s ARG 454 CO 0.07 0.17 -0.04 -1.21 0.00 0.00 0.00 175.30 174.29 1gkq s GLU 455 N -3.75 3.40 0.45 3.54 0.41 -1.26 -4.51 118.70 116.97 1gkq s GLU 455 Ca 0.35 -0.52 -0.24 0.00 -0.41 0.00 0.00 54.97 54.15 1gkq s GLU 455 Cb -0.02 -2.82 -0.08 0.00 -1.78 0.00 0.00 34.13 29.43 1gkq s GLU 455 CO 0.21 0.38 1.32 -2.14 -0.49 0.00 0.00 175.26 174.53 1gkq s PRO 456 N -0.02 3.70 0.00 0.39 0.02 -1.26 -4.87 135.00 132.96 1gkq s PRO 456 Ca 0.01 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.19 1gkq s PRO 456 Cb -0.13 -2.58 0.00 0.00 0.02 0.00 0.00 34.50 31.81 1gkq s PRO 456 CO 0.03 -0.71 0.03 0.00 -0.33 0.00 0.00 177.00 176.01 1gkq n MET 457 N -0.28 0.00 -3.39 5.54 0.00 -0.91 -4.98 117.12 113.11 1gkq n MET 457 Ca 0.06 -0.03 -0.36 0.00 0.00 0.00 0.00 57.70 57.37 1gkq n MET 457 Cb 0.44 -0.46 -0.04 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 3.59 1.61 3.17 4.02 -0.39 -5.05 117.16 124.10 1gkq n TYR 458 Ca 0.00 -3.68 0.14 0.00 -0.01 0.00 0.00 57.90 54.35 1gkq n TYR 458 Cb 0.26 -1.06 0.61 0.00 -0.02 0.00 0.00 39.34 39.14 1gkq n TYR 458 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04