#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dgv s GLN 2 N 0.00 3.43 0.04 -1.08 -0.21 -1.26 -4.99 119.66 115.58 3dgv s GLN 2 Ca 0.00 0.81 0.05 0.00 0.02 0.00 0.00 55.36 56.24 3dgv s GLN 2 Cb 0.00 -2.06 -0.02 0.00 1.00 0.00 0.00 33.01 31.93 3dgv s GLN 2 CO 0.00 -0.71 -0.13 1.03 -2.12 0.00 0.00 175.29 173.36 3dgv s ARG 3 N -5.11 0.90 0.00 2.91 0.52 -1.26 -3.13 118.95 113.78 3dgv s ARG 3 Ca 0.56 -0.74 0.00 0.00 -0.52 0.00 0.00 55.73 55.03 3dgv s ARG 3 Cb -0.12 -0.89 0.00 0.00 0.52 0.00 0.00 34.95 34.46 3dgv s ARG 3 CO 0.54 0.22 0.00 0.41 0.02 0.00 0.00 175.30 176.49 3dgv n GLY 4 N 1.91 -0.27 3.18 -3.53 0.00 -1.26 0.02 105.19 105.24 3dgv n GLY 4 Ca -0.18 -1.31 -0.14 0.00 0.00 0.00 0.00 46.02 44.40 3dgv n GLY 4 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dgv s GLN 5 N -2.00 0.86 -0.18 1.61 -0.21 -0.80 -1.72 119.66 117.22 3dgv s GLN 5 Ca 0.00 -1.21 -0.07 0.00 0.02 0.00 0.00 55.36 54.10 3dgv s GLN 5 Cb 0.00 -0.48 -0.04 0.00 1.00 0.00 0.00 33.01 33.49 3dgv s GLN 5 CO 0.00 0.06 0.06 0.08 -2.12 0.00 0.00 175.29 173.37 3dgv s VAL 6 N -2.70 4.74 0.32 1.09 1.01 -0.91 -0.48 120.40 123.46 3dgv s VAL 6 Ca 0.07 -0.05 0.10 0.00 0.00 0.00 0.00 61.98 62.10 3dgv s VAL 6 Cb -0.01 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 3dgv s VAL 6 CO -0.01 0.47 -0.04 -0.76 0.00 0.00 0.00 175.10 174.76 3dgv s LEU 7 N 0.30 2.91 -0.04 3.92 1.43 -0.21 -0.59 118.68 126.42 3dgv s LEU 7 Ca 0.03 -0.96 0.04 0.00 -1.03 0.00 0.00 54.13 52.21 3dgv s LEU 7 Cb -0.12 -1.33 -0.00 0.00 0.03 0.00 0.00 46.19 44.76 3dgv s LEU 7 CO 0.00 -0.14 -0.17 -0.55 0.23 0.00 0.00 176.35 175.73 3dgv s SER 8 N -3.66 2.08 -0.00 2.29 0.15 0.11 -1.57 113.70 113.11 3dgv s SER 8 Ca 0.33 -0.34 0.06 0.00 0.70 0.00 0.00 55.95 56.70 3dgv s SER 8 Cb -0.02 -0.53 -0.02 0.00 -1.71 0.00 0.00 66.02 63.74 3dgv s SER 8 CO 0.18 0.16 -0.18 0.00 1.20 0.00 0.00 173.24 174.60 3dgv s ALA 9 N -0.01 1.47 -0.69 5.45 0.00 -0.49 -0.42 121.76 127.07 3dgv s ALA 9 Ca -0.02 -0.80 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 3dgv s ALA 9 Cb -0.11 -0.35 0.18 0.00 0.00 0.00 0.00 23.12 22.84 3dgv s ALA 9 CO 0.02 0.35 0.52 -1.17 0.00 0.00 0.00 175.76 175.48 3dgv s LEU 10 N -0.57 5.47 0.04 0.00 2.96 0.05 -1.50 118.68 125.13 3dgv s LEU 10 Ca 0.06 -2.95 -0.30 0.00 -0.22 0.00 0.00 54.13 50.72 3dgv s LEU 10 Cb -0.07 -1.91 -0.08 0.00 0.50 0.00 0.00 46.19 44.63 3dgv s LEU 10 CO -0.00 -0.37 1.71 -2.16 -1.32 0.00 0.00 176.35 174.21 3dgv s PRO 11 N -0.21 4.18 -0.05 0.98 0.04 -1.26 -4.17 135.00 134.51 3dgv s PRO 11 Ca 0.18 2.36 0.20 0.00 0.04 0.00 0.00 61.00 63.79 3dgv s PRO 11 Cb -0.17 -3.77 -0.31 0.00 0.04 0.00 0.00 34.50 30.28 3dgv s PRO 11 CO -0.05 -0.80 0.41 0.54 0.04 0.00 0.00 177.00 177.14 3dgv n ARG 12 N 6.25 0.66 -4.45 4.56 1.74 -1.26 -0.67 116.66 123.49 3dgv n ARG 12 Ca 0.17 -0.17 -0.22 0.00 -0.77 0.00 0.00 57.85 56.86 3dgv n ARG 12 Cb 0.41 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 30.25 3dgv n ARG 12 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3dgv s THR 13 N -3.32 1.64 0.28 0.55 -4.23 -1.26 -4.66 115.64 104.64 3dgv s THR 13 Ca -0.08 -2.11 -0.01 0.00 -1.18 0.00 0.00 61.69 58.31 3dgv s THR 13 Cb 0.12 -2.53 0.15 0.00 1.34 0.00 0.00 72.50 71.58 3dgv s THR 13 CO 0.85 -0.24 1.82 0.28 -0.54 0.00 0.00 174.62 176.79 3dgv h SER 14 N 2.22 0.76 -0.79 3.99 0.02 -2.00 -1.14 113.55 116.60 3dgv h SER 14 Ca -0.40 -0.14 0.02 0.00 -0.84 0.00 0.00 61.79 60.43 3dgv h SER 14 Cb 1.24 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.53 3dgv h SER 14 CO 0.68 0.76 0.52 -0.09 -1.14 0.00 0.00 176.83 177.56 3dgv h ARG 15 N 0.78 1.00 0.00 3.45 2.43 -2.01 -2.89 114.38 117.14 3dgv h ARG 15 Ca 0.17 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 3dgv h ARG 15 Cb 0.31 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3dgv h ARG 15 CO 0.00 0.66 -0.36 1.96 -1.51 0.00 0.00 179.97 180.72 3dgv h GLN 16 N 1.03 0.00 0.01 0.20 4.20 -1.62 -2.55 115.11 116.39 3dgv h GLN 16 Ca 0.30 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.77 3dgv h GLN 16 Cb -0.06 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.73 3dgv h GLN 16 CO -0.09 0.36 -1.00 -0.39 -0.67 0.00 0.00 178.83 177.05 3dgv h VAL 17 N 0.00 1.37 -0.33 -0.54 -1.51 -1.12 -2.12 116.25 112.01 3dgv h VAL 17 Ca -0.00 -2.44 -0.04 0.00 -1.23 0.00 0.00 66.70 62.99 3dgv h VAL 17 Cb 0.86 2.46 -0.01 0.00 -2.13 0.00 0.00 31.29 32.46 3dgv h VAL 17 CO 0.05 0.73 0.07 1.56 -1.23 0.00 0.00 177.57 178.75 3dgv h GLN 18 N 0.26 0.54 -0.78 5.19 4.20 -1.38 0.26 115.11 123.40 3dgv h GLN 18 Ca -0.10 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.47 3dgv h GLN 18 Cb 1.65 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 29.32 3dgv h GLN 18 CO 0.18 0.61 0.50 0.82 -0.67 0.00 0.00 178.83 180.27 3dgv h ILE 19 N 0.39 1.21 -0.18 2.54 2.04 -1.50 0.19 117.51 122.20 3dgv h ILE 19 Ca 0.10 -0.41 -0.13 0.00 1.00 0.00 0.00 64.86 65.42 3dgv h ILE 19 Cb 0.32 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 3dgv h ILE 19 CO 0.00 0.21 -0.41 0.25 0.00 0.00 0.00 178.15 178.21 3dgv h LEU 20 N 1.07 0.67 -0.30 1.44 6.46 -0.97 -1.19 115.31 122.49 3dgv h LEU 20 Ca 0.28 -0.56 0.01 0.00 -0.12 0.00 0.00 57.88 57.49 3dgv h LEU 20 Cb -0.09 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.63 3dgv h LEU 20 CO -0.06 1.11 0.19 1.56 -0.62 0.00 0.00 178.44 180.62 3dgv h GLN 21 N 0.25 0.37 -0.98 1.25 4.20 -0.19 -1.26 115.11 118.76 3dgv h GLN 21 Ca 0.00 -0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.77 3dgv h GLN 21 Cb 1.01 -0.08 -0.07 0.00 0.30 0.00 0.00 27.48 28.63 3dgv h GLN 21 CO 0.09 0.25 0.62 -0.91 -0.67 0.00 0.00 178.83 178.21 3dgv h ASN 22 N 0.39 0.96 -0.31 1.46 2.35 -0.49 -2.39 115.58 117.55 3dgv h ASN 22 Ca 0.11 0.02 -0.15 0.00 -0.55 0.00 0.00 56.30 55.74 3dgv h ASN 22 Cb -0.03 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 3dgv h ASN 22 CO -0.04 0.58 -0.36 0.58 -1.65 0.00 0.00 177.43 176.55 3dgv h VAL 23 N 1.08 1.28 0.00 2.81 2.07 -0.54 -2.09 116.25 120.86 3dgv h VAL 23 Ca 0.44 -1.53 0.00 0.00 0.82 0.00 0.00 66.70 66.44 3dgv h VAL 23 Cb 0.28 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3dgv h VAL 23 CO -0.21 0.51 0.00 0.71 0.02 0.00 0.00 177.57 178.60 3dgv h THR 24 N 0.70 0.00 0.00 2.57 1.35 -0.73 -2.55 112.91 114.25 3dgv h THR 24 Ca 0.06 -0.25 -0.36 0.00 -0.55 0.00 0.00 66.41 65.31 3dgv h THR 24 Cb 0.93 1.11 -0.07 0.00 -1.73 0.00 0.00 68.15 68.39 3dgv h THR 24 CO 0.09 0.00 -2.37 0.35 -0.25 0.00 0.00 175.52 173.34 3dgv n THR 25 N -2.77 1.37 0.07 6.82 -2.24 -1.07 -4.44 114.28 112.02 3dgv n THR 25 Ca -0.00 -0.78 -0.02 0.00 -2.27 0.00 0.00 64.05 60.98 3dgv n THR 25 Cb 0.19 -0.66 -0.07 0.00 -2.10 0.00 0.00 70.33 67.70 3dgv n THR 25 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3dgv h THR 26 N 0.00 0.98 -1.46 4.28 1.35 -1.22 -3.46 112.91 113.38 3dgv h THR 26 Ca -0.54 -2.55 -0.46 0.00 -0.55 0.00 0.00 66.41 62.32 3dgv h THR 26 Cb 2.15 2.43 0.04 0.00 -1.73 0.00 0.00 68.15 71.03 3dgv h THR 26 CO 0.01 0.56 -0.09 -0.31 -0.25 0.00 0.00 175.52 175.44 3dgv s TYR 27 N -2.83 2.00 -1.16 4.73 2.02 -0.98 -5.00 117.35 116.13 3dgv s TYR 27 Ca 0.00 -0.46 -0.19 0.00 -0.37 0.00 0.00 57.07 56.05 3dgv s TYR 27 Cb 0.09 -2.48 0.08 0.00 -0.40 0.00 0.00 41.96 39.24 3dgv s TYR 27 CO 0.79 -1.04 1.55 0.15 -1.57 0.00 0.00 175.55 175.43 3dgv s LYS 28 N -4.70 3.83 0.00 -0.62 -0.14 -1.26 -4.90 119.74 111.95 3dgv s LYS 28 Ca 0.60 -1.73 0.03 0.00 -1.36 0.00 0.00 55.97 53.51 3dgv s LYS 28 Cb -0.07 -5.37 -0.01 0.00 -1.68 0.00 0.00 37.83 30.70 3dgv s LYS 28 CO 0.38 -2.15 -0.11 0.42 -0.76 0.00 0.00 175.35 173.14 3dgv s ILE 29 N 4.07 0.85 -0.18 2.17 1.01 -1.26 -1.99 121.20 125.86 3dgv s ILE 29 Ca 0.48 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.58 3dgv s ILE 29 Cb 0.01 -0.73 0.01 0.00 0.01 0.00 0.00 42.46 41.76 3dgv s ILE 29 CO -0.01 0.17 -0.17 -0.69 0.00 0.00 0.00 174.94 174.24 3dgv s VAL 30 N -0.39 2.37 0.36 2.92 1.01 -0.69 -4.92 120.40 121.06 3dgv s VAL 30 Ca 0.03 -0.84 -0.28 0.00 0.00 0.00 0.00 61.98 60.89 3dgv s VAL 30 Cb -0.05 -2.01 -0.10 0.00 0.00 0.00 0.00 36.38 34.22 3dgv s VAL 30 CO -0.00 0.52 1.33 -0.76 0.00 0.00 0.00 175.10 176.19 3dgv s LEU 31 N 1.20 4.36 -0.20 3.92 1.43 -1.26 -0.58 118.68 127.56 3dgv s LEU 31 Ca 0.02 2.74 -0.06 0.00 -1.03 0.00 0.00 54.13 55.80 3dgv s LEU 31 Cb -0.14 -3.71 -0.10 0.00 0.03 0.00 0.00 46.19 42.27 3dgv s LEU 31 CO -0.08 -0.66 -0.22 0.79 0.23 0.00 0.00 176.35 176.41 3dgv n TRP 32 N 0.59 0.00 -3.56 0.29 7.02 0.81 -4.86 117.44 117.73 3dgv n TRP 32 Ca 0.01 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.39 3dgv n TRP 32 Cb 0.42 -0.72 -0.10 0.00 -2.42 0.00 0.00 31.31 28.49 3dgv n TRP 32 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 3dgv s GLN 33 N -2.37 0.30 1.13 -0.99 0.74 -0.74 -4.26 119.66 113.48 3dgv s GLN 33 Ca -0.27 0.83 -0.19 0.00 0.05 0.00 0.00 55.36 55.78 3dgv s GLN 33 Cb 0.09 0.01 0.28 0.00 1.10 0.00 0.00 33.01 34.49 3dgv s GLN 33 CO 0.38 -0.38 1.07 -0.35 -0.55 0.00 0.00 175.29 175.47 3dgv n PRO 34 N 5.38 -2.77 0.22 1.67 -0.04 -1.26 -0.12 135.00 138.07 3dgv n PRO 34 Ca -0.07 -1.71 0.11 0.00 -0.04 0.00 0.00 63.50 61.79 3dgv n PRO 34 Cb 0.50 -1.52 0.31 0.00 -0.04 0.00 0.00 33.50 32.75 3dgv n PRO 34 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 3dgv h VAL 35 N -2.53 0.30 -3.12 0.52 3.04 -1.89 -3.45 116.25 109.12 3dgv h VAL 35 Ca -0.39 -1.18 -0.15 0.00 -1.01 0.00 0.00 66.70 63.97 3dgv h VAL 35 Cb 1.18 1.94 -0.24 0.00 -2.01 0.00 0.00 31.29 32.16 3dgv h VAL 35 CO 0.26 0.15 -0.39 0.00 -1.01 0.00 0.00 177.57 176.58 3dgv s ALA 36 N -3.35 -0.65 0.52 3.17 0.00 -1.26 -4.76 121.76 115.42 3dgv s ALA 36 Ca 0.04 0.60 0.42 0.00 0.00 0.00 0.00 51.96 53.02 3dgv s ALA 36 Cb 0.07 -0.31 2.19 0.00 0.00 0.00 0.00 23.12 25.07 3dgv s ALA 36 CO 0.65 -0.16 2.27 0.00 0.00 0.00 0.00 175.76 178.53 3dgv h ALA 37 N 5.29 1.00 0.00 0.00 0.00 -1.96 -1.19 119.26 122.40 3dgv h ALA 37 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3dgv h ALA 37 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3dgv h ALA 37 CO 0.35 0.00 0.00 0.93 0.00 0.00 0.00 179.25 180.53 3dgv h GLU 38 N 0.00 0.00 -0.10 0.00 5.08 -1.98 -2.87 114.58 114.70 3dgv h GLU 38 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dgv h GLU 38 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3dgv h GLU 38 CO 0.00 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.67 3dgv n TYR 39 N -2.42 0.13 -1.75 4.33 0.53 -0.45 -4.97 117.16 112.56 3dgv n TYR 39 Ca -0.00 -0.21 -0.42 0.00 -1.02 0.00 0.00 57.90 56.25 3dgv n TYR 39 Cb 0.13 -0.01 -0.03 0.00 -1.03 0.00 0.00 39.34 38.40 3dgv n TYR 39 CO 0.00 0.00 0.00 0.42 -1.02 0.00 0.00 176.86 176.26 3dgv s ILE 40 N -0.78 2.08 0.08 -0.72 1.01 -1.09 -4.89 121.20 116.89 3dgv s ILE 40 Ca 0.12 0.06 0.07 0.00 0.00 0.00 0.00 60.65 60.90 3dgv s ILE 40 Cb 0.07 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.47 3dgv s ILE 40 CO 0.10 0.00 -0.19 -0.69 0.00 0.00 0.00 174.94 174.16 3dgv s VAL 41 N 1.17 1.57 0.42 2.92 1.01 -1.26 -5.08 120.40 121.16 3dgv s VAL 41 Ca 0.74 -1.37 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 3dgv s VAL 41 Cb -0.49 -1.42 -0.08 0.00 0.00 0.00 0.00 36.38 34.39 3dgv s VAL 41 CO 0.32 0.00 1.19 -1.59 0.00 0.00 0.00 175.10 175.02 3dgv s LYS 42 N -1.61 3.94 0.00 2.72 -2.85 -1.26 -2.76 119.74 117.92 3dgv s LYS 42 Ca 0.05 1.87 0.00 0.00 -1.00 0.00 0.00 55.97 56.90 3dgv s LYS 42 Cb -0.09 -2.60 0.00 0.00 -2.06 0.00 0.00 37.83 33.07 3dgv s LYS 42 CO 0.03 -0.43 0.00 0.41 0.10 0.00 0.00 175.35 175.46 3dgv n GLY 43 N 0.59 1.13 3.25 0.59 0.00 0.15 -5.01 105.19 105.89 3dgv n GLY 43 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 3dgv n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dgv s TYR 44 N -2.72 2.19 0.63 1.61 1.51 -1.11 -5.02 117.35 114.45 3dgv s TYR 44 Ca 0.00 -0.55 -0.18 0.00 -1.01 0.00 0.00 57.07 55.33 3dgv s TYR 44 Cb 0.00 -1.43 -0.02 0.00 -0.11 0.00 0.00 41.96 40.40 3dgv s TYR 44 CO 0.00 -0.13 1.22 -1.21 -1.11 0.00 0.00 175.55 174.32 3dgv s GLU 45 N -0.30 2.74 -0.14 -0.62 2.02 -1.26 -4.45 118.70 116.68 3dgv s GLU 45 Ca 0.02 1.83 0.00 0.00 0.02 0.00 0.00 54.97 56.84 3dgv s GLU 45 Cb -0.11 -1.90 0.02 0.00 0.10 0.00 0.00 34.13 32.24 3dgv s GLU 45 CO 0.01 -1.39 -0.13 0.08 0.02 0.00 0.00 175.26 173.86 3dgv s VAL 46 N -1.67 1.46 -0.12 2.63 1.01 -0.56 -4.59 120.40 118.56 3dgv s VAL 46 Ca 0.77 -0.57 -0.10 0.00 0.00 0.00 0.00 61.98 62.09 3dgv s VAL 46 Cb -0.31 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.63 3dgv s VAL 46 CO 0.37 0.44 0.20 -1.00 0.00 0.00 0.00 175.10 175.10 3dgv s HIS 47 N 1.53 3.56 -0.13 5.22 0.09 0.83 -1.40 115.29 125.00 3dgv s HIS 47 Ca 0.05 0.56 -0.27 0.00 -0.00 0.00 0.00 55.06 55.40 3dgv s HIS 47 Cb -0.13 -2.09 0.07 0.00 -0.00 0.00 0.00 32.58 30.43 3dgv s HIS 47 CO -0.10 0.57 0.66 -0.59 -0.00 0.00 0.00 174.74 175.28 3dgv s PHE 48 N -0.56 -0.67 0.18 1.40 -0.12 -0.61 -0.14 117.98 117.47 3dgv s PHE 48 Ca 0.15 1.34 -0.25 0.00 -0.05 0.00 0.00 56.93 58.12 3dgv s PHE 48 Cb -0.13 0.33 -0.08 0.00 -0.63 0.00 0.00 43.02 42.52 3dgv s PHE 48 CO 0.04 -0.50 0.78 0.12 -0.05 0.00 0.00 175.22 175.61 3dgv s PHE 49 N -0.62 3.88 -0.09 3.49 5.36 0.25 -1.04 117.98 129.22 3dgv s PHE 49 Ca -0.07 1.63 0.02 0.00 -0.96 0.00 0.00 56.93 57.54 3dgv s PHE 49 Cb -0.02 -2.77 0.01 0.00 -0.34 0.00 0.00 43.02 39.91 3dgv s PHE 49 CO 0.06 0.49 -0.13 0.08 -1.46 0.00 0.00 175.22 174.26 3dgv s VAL 50 N -1.19 1.29 0.44 3.12 1.01 0.36 -1.70 120.40 123.73 3dgv s VAL 50 Ca 0.37 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.56 3dgv s VAL 50 Cb -0.23 -1.20 -0.08 0.00 0.00 0.00 0.00 36.38 34.88 3dgv s VAL 50 CO 0.26 0.40 1.35 0.21 0.00 0.00 0.00 175.10 177.32 3dgv s ASN 51 N 0.92 6.01 0.29 3.32 2.47 -0.84 -1.91 114.94 125.21 3dgv s ASN 51 Ca -0.09 2.75 0.02 0.00 0.42 0.00 0.00 52.86 55.96 3dgv s ASN 51 Cb -0.15 -2.64 0.72 0.00 -1.45 0.00 0.00 41.25 37.73 3dgv s ASN 51 CO 0.00 -1.06 1.62 0.00 -3.72 0.00 0.00 177.10 173.94 3dgv h ALA 52 N 2.36 1.25 0.00 1.71 0.00 -0.75 0.75 119.26 124.58 3dgv h ALA 52 Ca -0.50 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3dgv h ALA 52 Cb 1.26 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.44 3dgv h ALA 52 CO 0.61 -0.51 0.00 -1.13 0.00 0.00 0.00 179.25 178.22 3dgv n SER 53 N -5.30 0.00 0.00 0.00 3.41 -1.26 -2.94 113.62 107.53 3dgv n SER 53 Ca 0.22 0.40 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 3dgv n SER 53 Cb 0.71 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 3dgv n SER 53 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3dgv n ASP 54 N -1.42 0.33 -0.24 4.04 9.92 0.25 -4.83 116.55 124.60 3dgv n ASP 54 Ca 0.01 -0.65 -0.07 0.00 -0.53 0.00 0.00 54.79 53.55 3dgv n ASP 54 Cb 0.04 0.55 0.04 0.00 -0.64 0.00 0.00 41.12 41.11 3dgv n ASP 54 CO 0.00 0.00 0.00 -0.37 0.13 0.00 0.00 177.20 176.96 3dgv h VAL 55 N 0.05 1.25 -0.77 2.53 -1.51 -1.53 -0.10 116.25 116.16 3dgv h VAL 55 Ca 0.00 -0.87 -0.05 0.00 -1.23 0.00 0.00 66.70 64.55 3dgv h VAL 55 Cb 0.02 0.55 -0.03 0.00 -2.13 0.00 0.00 31.29 29.70 3dgv h VAL 55 CO 0.00 0.33 0.27 0.28 -1.23 0.00 0.00 177.57 177.22 3dgv h SER 56 N 0.97 1.10 -0.42 4.19 0.02 -1.88 0.10 113.55 117.64 3dgv h SER 56 Ca 0.22 -0.20 -0.12 0.00 -0.84 0.00 0.00 61.79 60.85 3dgv h SER 56 Cb 0.30 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 3dgv h SER 56 CO -0.01 1.00 -0.18 0.78 -1.14 0.00 0.00 176.83 177.28 3dgv h ASN 57 N 1.14 0.92 -0.08 3.07 4.21 -1.79 -1.22 115.58 121.83 3dgv h ASN 57 Ca 0.25 -0.33 -0.02 0.00 1.21 0.00 0.00 56.30 57.42 3dgv h ASN 57 Cb 0.27 -0.25 -0.00 0.00 -1.12 0.00 0.00 38.32 37.22 3dgv h ASN 57 CO -0.01 1.09 -0.02 0.58 -1.29 0.00 0.00 177.43 177.77 3dgv h VAL 58 N 0.80 1.29 -0.31 2.81 2.07 -0.54 -0.92 116.25 121.46 3dgv h VAL 58 Ca 0.11 -0.95 0.01 0.00 0.82 0.00 0.00 66.70 66.70 3dgv h VAL 58 Cb 0.73 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 3dgv h VAL 58 CO 0.06 0.27 0.18 0.11 0.02 0.00 0.00 177.57 178.20 3dgv h LYS 59 N -0.17 0.35 -0.99 1.57 1.57 -0.82 0.38 116.57 118.46 3dgv h LYS 59 Ca 0.02 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.84 3dgv h LYS 59 Cb 0.43 -0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.59 3dgv h LYS 59 CO 0.01 0.23 0.64 0.00 -0.57 0.00 0.00 179.45 179.77 3dgv h ALA 60 N 1.14 1.42 -0.02 3.86 0.00 -1.19 0.16 119.26 124.62 3dgv h ALA 60 Ca 0.12 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 3dgv h ALA 60 Cb 0.00 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.50 3dgv h ALA 60 CO -0.06 0.44 -0.56 1.25 0.00 0.00 0.00 179.25 180.32 3dgv h HIS 61 N 1.16 0.61 -1.01 0.00 -0.00 0.00 0.22 115.15 116.13 3dgv h HIS 61 Ca 0.43 -0.32 0.02 0.00 -0.00 0.00 0.00 60.37 60.50 3dgv h HIS 61 Cb 0.17 -0.07 -0.05 0.00 -0.00 0.00 0.00 27.41 27.45 3dgv h HIS 61 CO -0.00 1.12 0.67 -0.07 -0.00 0.00 0.00 177.93 179.65 3dgv h LEU 62 N -0.08 1.14 0.71 0.26 3.38 -0.07 -2.11 115.31 118.53 3dgv h LEU 62 Ca -0.06 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 3dgv h LEU 62 Cb 1.26 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.74 3dgv h LEU 62 CO 0.11 0.82 -0.34 -1.13 0.09 0.00 0.00 178.44 177.99 3dgv h ASN 63 N 1.34 -0.80 -0.01 -0.43 -1.24 -0.53 -0.49 115.58 113.42 3dgv h ASN 63 Ca 0.38 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.39 3dgv h ASN 63 Cb -0.12 0.21 -0.00 0.00 0.73 0.00 0.00 38.32 39.14 3dgv h ASN 63 CO -0.09 -0.46 0.26 0.00 -1.29 0.00 0.00 177.43 175.85 3dgv h ALA 64 N -1.04 1.28 -0.03 1.57 0.00 -0.93 -0.38 119.26 119.73 3dgv h ALA 64 Ca -0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3dgv h ALA 64 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3dgv h ALA 64 CO 0.16 -0.26 -0.06 0.45 0.00 0.00 0.00 179.25 179.53 3dgv n SER 65 N -2.96 2.67 -2.84 0.00 2.88 -0.80 -4.99 113.62 107.59 3dgv n SER 65 Ca -0.02 -1.84 -0.13 0.00 -1.33 0.00 0.00 58.87 55.55 3dgv n SER 65 Cb 0.31 0.07 0.07 0.00 -0.75 0.00 0.00 64.21 63.91 3dgv n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3dgv n ARG 66 N 1.03 -4.94 -4.03 -1.46 1.74 -0.15 -4.96 116.66 103.88 3dgv n ARG 66 Ca 0.12 0.64 -0.33 0.00 -0.77 0.00 0.00 57.85 57.51 3dgv n ARG 66 Cb 0.53 -5.04 -0.15 0.00 -1.02 0.00 0.00 32.46 26.77 3dgv n ARG 66 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3dgv s ILE 67 N -3.27 2.42 0.29 0.55 1.01 -0.29 -4.88 121.20 117.02 3dgv s ILE 67 Ca 0.01 -1.29 -0.30 0.00 0.00 0.00 0.00 60.65 59.08 3dgv s ILE 67 Cb -0.00 -2.28 -0.10 0.00 0.01 0.00 0.00 42.46 40.09 3dgv s ILE 67 CO 0.55 0.15 1.46 -2.84 0.00 0.00 0.00 174.94 174.26 3dgv s PRO 68 N 1.22 4.23 0.12 2.79 0.02 -1.26 -4.46 135.00 137.66 3dgv s PRO 68 Ca -0.03 2.38 -0.05 0.00 0.02 0.00 0.00 61.00 63.33 3dgv s PRO 68 Cb -0.17 -3.07 -0.02 0.00 0.02 0.00 0.00 34.50 31.26 3dgv s PRO 68 CO -0.06 -0.44 0.13 -0.59 -0.33 0.00 0.00 177.00 175.71 3dgv s PHE 69 N -0.34 0.53 0.18 6.54 -0.12 -1.26 -0.77 117.98 122.73 3dgv s PHE 69 Ca 0.58 -0.94 -0.08 0.00 -0.05 0.00 0.00 56.93 56.43 3dgv s PHE 69 Cb -0.43 -0.26 -0.01 0.00 -0.63 0.00 0.00 43.02 41.68 3dgv s PHE 69 CO 0.49 -0.56 0.28 -0.98 -0.05 0.00 0.00 175.22 174.39 3dgv s ARG 70 N -3.97 1.19 -0.31 1.99 1.70 0.45 -4.97 118.95 115.04 3dgv s ARG 70 Ca 0.15 -1.25 -0.12 0.00 -0.47 0.00 0.00 55.73 54.04 3dgv s ARG 70 Cb 0.06 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.77 3dgv s ARG 70 CO -0.03 -0.44 0.23 0.08 -1.08 0.00 0.00 175.30 174.06 3dgv s VAL 71 N -4.00 5.29 -0.15 4.99 1.01 -1.26 -0.71 120.40 125.57 3dgv s VAL 71 Ca 0.21 0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.99 3dgv s VAL 71 Cb 0.03 -3.63 -0.21 0.00 0.00 0.00 0.00 36.38 32.58 3dgv s VAL 71 CO 0.03 0.13 0.56 -0.07 0.00 0.00 0.00 175.10 175.74 3dgv h LEU 72 N 8.45 0.00 -7.91 3.92 3.38 -1.15 -3.45 115.31 118.55 3dgv h LEU 72 Ca -0.33 -0.77 -0.60 0.00 0.09 0.00 0.00 57.88 56.26 3dgv h LEU 72 Cb 1.17 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 41.57 3dgv h LEU 72 CO 0.59 1.01 -0.83 -0.69 0.09 0.00 0.00 178.44 178.61 3dgv s VAL 73 N -2.16 1.59 0.18 1.22 1.01 -0.86 -4.81 120.40 116.56 3dgv s VAL 73 Ca -0.18 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 3dgv s VAL 73 Cb -0.01 -1.48 -0.08 0.00 0.00 0.00 0.00 36.38 34.81 3dgv s VAL 73 CO 0.58 0.46 1.47 -0.33 0.00 0.00 0.00 175.10 177.28 3dgv h GLU 74 N 8.00 0.53 -2.56 2.72 4.39 -1.87 -2.42 114.58 123.36 3dgv h GLU 74 Ca -0.38 -0.37 -0.43 0.00 0.34 0.00 0.00 59.36 58.52 3dgv h GLU 74 Cb 1.14 0.06 -0.37 0.00 -0.10 0.00 0.00 28.75 29.47 3dgv h GLU 74 CO 0.53 0.98 -0.71 1.21 -1.16 0.00 0.00 179.01 179.86 3dgv s ASN 75 N -6.95 2.57 0.14 1.42 3.04 -1.26 -4.63 114.94 109.28 3dgv s ASN 75 Ca -0.07 -0.94 -0.13 0.00 0.04 0.00 0.00 52.86 51.76 3dgv s ASN 75 Cb 0.11 0.04 0.01 0.00 -1.54 0.00 0.00 41.25 39.86 3dgv s ASN 75 CO 0.85 -0.40 1.59 0.58 -3.04 0.00 0.00 177.10 176.67 3dgv h VAL 76 N 6.35 1.26 -0.64 -5.21 2.07 -1.60 -3.16 116.25 115.32 3dgv h VAL 76 Ca -0.17 -1.05 0.09 0.00 0.82 0.00 0.00 66.70 66.38 3dgv h VAL 76 Cb 1.06 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 31.78 3dgv h VAL 76 CO 0.38 0.37 0.28 -0.08 0.02 0.00 0.00 177.57 178.54 3dgv h GLU 77 N 0.68 0.49 0.11 1.57 4.81 -1.80 0.25 114.58 120.68 3dgv h GLU 77 Ca 0.13 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 3dgv h GLU 77 Cb 0.50 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 3dgv h GLU 77 CO 0.02 0.32 -0.28 -0.44 -0.73 0.00 0.00 179.01 177.91 3dgv h ASP 78 N 0.50 -0.80 -0.25 1.04 3.32 -1.88 0.21 116.42 118.57 3dgv h ASP 78 Ca 0.32 0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.49 3dgv h ASP 78 Cb 0.35 0.31 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 3dgv h ASP 78 CO -0.27 -0.37 0.05 -0.07 -1.72 0.00 0.00 179.24 176.86 3dgv h LEU 79 N -0.49 0.02 -0.51 1.55 4.07 -1.33 0.92 115.31 119.54 3dgv h LEU 79 Ca 0.03 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 58.01 3dgv h LEU 79 Cb 0.52 0.05 -0.02 0.00 1.08 0.00 0.00 40.66 42.28 3dgv h LEU 79 CO -0.17 0.05 0.22 0.40 -1.08 0.00 0.00 178.44 177.85 3dgv h ILE 80 N 0.15 1.21 -0.44 1.22 2.04 -0.79 -0.63 117.51 120.27 3dgv h ILE 80 Ca 0.11 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 3dgv h ILE 80 Cb 0.11 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 3dgv h ILE 80 CO -0.14 0.24 0.18 -0.09 0.00 0.00 0.00 178.15 178.34 3dgv h ARG 81 N 0.69 0.66 -0.25 2.37 2.43 -0.65 -2.74 114.38 116.88 3dgv h ARG 81 Ca 0.17 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3dgv h ARG 81 Cb 0.17 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3dgv h ARG 81 CO -0.02 0.60 0.16 1.96 -1.51 0.00 0.00 179.97 181.16 3dgv h GLN 82 N 0.57 0.34 0.00 0.20 4.20 -0.55 -3.14 115.11 116.72 3dgv h GLN 82 Ca 0.15 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3dgv h GLN 82 Cb 0.18 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.89 3dgv h GLN 82 CO -0.01 0.25 0.00 1.04 -0.67 0.00 0.00 178.83 179.43 3dgv n GLN 83 N -4.90 0.37 -0.01 1.46 6.02 -0.27 -3.10 117.38 116.95 3dgv n GLN 83 Ca -0.02 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.02 3dgv n GLN 83 Cb 0.04 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 29.85 3dgv n GLN 83 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 3dgv n THR 84 N -1.31 0.06 1.05 5.09 5.66 -1.05 -4.52 114.28 119.26 3dgv n THR 84 Ca 0.13 -0.53 0.12 0.00 -3.05 0.00 0.00 64.05 60.72 3dgv n THR 84 Cb 0.25 1.17 0.09 0.00 -1.55 0.00 0.00 70.33 70.29 3dgv n THR 84 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 3dgv n SER 85 N 0.57 2.29 -0.84 1.09 3.41 -1.18 -4.21 113.62 114.74 3dgv n SER 85 Ca 0.06 -1.65 0.01 0.00 -0.26 0.00 0.00 58.87 57.04 3dgv n SER 85 Cb 0.27 0.25 0.20 0.00 -0.26 0.00 0.00 64.21 64.67 3dgv n SER 85 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3dgv n ASN 86 N 0.45 2.06 -0.07 4.04 4.13 -1.26 -4.78 115.26 119.83 3dgv n ASN 86 Ca 0.12 -3.87 0.02 0.00 1.68 0.00 0.00 54.58 52.53 3dgv n ASN 86 Cb 0.50 -0.57 0.33 0.00 -1.54 0.00 0.00 39.78 38.51 3dgv n ASN 86 CO 0.00 0.00 0.00 -0.78 0.28 0.00 0.00 177.26 176.76 3dgv h ASP 87 N 1.03 0.61 -0.00 6.41 -0.00 -1.73 -3.30 116.42 119.43 3dgv h ASP 87 Ca 0.09 -0.04 -0.18 0.00 -0.00 0.00 0.00 57.03 56.90 3dgv h ASP 87 Cb 1.25 -0.15 -0.39 0.00 -0.00 0.00 0.00 39.33 40.03 3dgv h ASP 87 CO 0.16 0.49 -1.04 0.35 -0.00 0.00 0.00 179.24 179.20 3dgv n THR 88 N -4.41 0.01 0.05 2.25 -2.24 -1.26 -4.81 114.28 103.87 3dgv n THR 88 Ca 0.04 -1.02 -0.14 0.00 -2.27 0.00 0.00 64.05 60.66 3dgv n THR 88 Cb 0.10 1.00 -0.14 0.00 -2.10 0.00 0.00 70.33 69.19 3dgv n THR 88 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 3dgv h ILE 89 N 6.98 1.19 -2.04 2.28 2.10 -1.88 -3.47 117.51 122.68 3dgv h ILE 89 Ca -0.23 -2.87 -0.45 0.00 1.08 0.00 0.00 64.86 62.39 3dgv h ILE 89 Cb 1.89 2.72 0.00 0.00 -1.09 0.00 0.00 36.82 40.35 3dgv h ILE 89 CO 0.10 0.80 -0.33 -0.44 -1.08 0.00 0.00 178.15 177.19 3dgv s SER 90 N -6.82 6.07 0.58 2.19 0.01 -1.26 -5.09 113.70 109.38 3dgv s SER 90 Ca -0.07 -0.05 -0.20 0.00 1.31 0.00 0.00 55.95 56.95 3dgv s SER 90 Cb 0.07 -1.46 -0.04 0.00 0.21 0.00 0.00 66.02 64.80 3dgv s SER 90 CO 0.84 -0.36 1.19 -2.65 0.41 0.00 0.00 173.24 172.68 3dgv n PRO 91 N -1.63 1.26 0.18 12.44 -0.02 -1.26 -4.90 135.00 141.07 3dgv n PRO 91 Ca -0.03 0.47 0.14 0.00 -2.02 0.00 0.00 63.50 62.07 3dgv n PRO 91 Cb 0.58 -2.40 0.59 0.00 -0.02 0.00 0.00 33.50 32.25 3dgv n PRO 91 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3dgv h ARG 92 N 0.89 0.00 -0.04 -0.52 9.65 -1.98 -2.69 114.38 119.68 3dgv h ARG 92 Ca -0.50 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.20 3dgv h ARG 92 Cb 1.34 0.00 -0.36 0.00 -1.39 0.00 0.00 29.97 29.56 3dgv h ARG 92 CO 0.54 0.00 -0.95 0.00 2.80 0.00 0.00 179.97 182.36 3dgv n ALA 4 N -1.86 2.56 -1.16 2.80 0.00 -1.26 -4.93 120.51 116.65 3dgv n ALA 4 Ca 0.01 -2.17 -0.32 0.00 0.00 0.00 0.00 53.44 50.96 3dgv n ALA 4 Cb 0.21 -0.71 0.11 0.00 0.00 0.00 0.00 19.45 19.06 3dgv n ALA 4 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3dgv s SER 5 N -2.05 4.10 0.40 0.00 0.15 -1.02 -4.93 113.70 110.35 3dgv s SER 5 Ca 0.29 2.06 0.09 0.00 0.70 0.00 0.00 55.95 59.09 3dgv s SER 5 Cb 0.34 -2.55 0.84 0.00 -1.71 0.00 0.00 66.02 62.93 3dgv s SER 5 CO -0.14 -2.31 1.97 0.77 1.20 0.00 0.00 173.24 174.73 3dgv h SER 6 N -0.97 0.28 1.81 5.45 4.64 -1.99 -1.12 113.55 121.64 3dgv h SER 6 Ca -0.45 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3dgv h SER 6 Cb 1.26 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3dgv h SER 6 CO 0.49 0.35 0.00 0.77 -0.87 0.00 0.00 176.83 177.56 3dgv h SER 7 N 0.30 0.00 -0.71 4.97 4.64 -1.94 -3.03 113.55 117.79 3dgv h SER 7 Ca 0.07 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.53 3dgv h SER 7 Cb 0.23 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.22 3dgv h SER 7 CO 0.01 0.00 0.23 0.22 -0.87 0.00 0.00 176.83 176.41 3dgv h TYR 8 N 0.00 0.37 0.00 4.77 5.03 -1.45 -0.77 116.97 124.92 3dgv h TYR 8 Ca 0.00 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.35 3dgv h TYR 8 Cb 0.91 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 39.13 3dgv h TYR 8 CO 0.00 0.00 0.00 0.66 -1.32 0.00 0.00 178.16 177.50 3dgv n TYR 9 N -5.07 0.00 -0.90 -3.82 4.01 -1.14 -2.67 117.16 107.56 3dgv n TYR 9 Ca 0.13 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.95 3dgv n TYR 9 Cb 0.40 -0.12 0.32 0.00 -0.31 0.00 0.00 39.34 39.63 3dgv n TYR 9 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3dgv n GLU 10 N -1.12 3.74 -4.15 -0.72 1.02 -0.29 -4.83 120.64 114.28 3dgv n GLU 10 Ca 0.16 -2.94 -0.10 0.00 -0.02 0.00 0.00 57.16 54.27 3dgv n GLU 10 Cb 0.13 -1.98 -0.10 0.00 -0.02 0.00 0.00 31.44 29.47 3dgv n GLU 10 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 3dgv s GLN 11 N -2.65 0.86 0.19 3.49 -2.07 -1.09 -4.67 119.66 113.72 3dgv s GLN 11 Ca 0.47 -1.39 -0.17 0.00 -1.82 0.00 0.00 55.36 52.45 3dgv s GLN 11 Cb 0.36 0.12 -0.08 0.00 -1.09 0.00 0.00 33.01 32.32 3dgv s GLN 11 CO 0.13 -0.18 0.63 0.71 -1.32 0.00 0.00 175.29 175.26 3dgv s TYR 12 N -3.92 3.62 0.07 9.60 2.02 -1.26 -5.02 117.35 122.46 3dgv s TYR 12 Ca 0.18 1.21 0.07 0.00 -0.37 0.00 0.00 57.07 58.16 3dgv s TYR 12 Cb 0.07 -2.48 -0.03 0.00 -0.40 0.00 0.00 41.96 39.12 3dgv s TYR 12 CO -0.02 0.38 -0.19 -1.01 -1.57 0.00 0.00 175.55 173.14 3dgv s HIS 13 N -1.51 1.62 0.91 2.71 3.76 -1.26 -4.18 115.29 117.34 3dgv s HIS 13 Ca 0.41 -0.40 -0.12 0.00 -0.15 0.00 0.00 55.06 54.80 3dgv s HIS 13 Cb -0.16 -0.93 0.14 0.00 1.11 0.00 0.00 32.58 32.75 3dgv s HIS 13 CO 0.20 0.12 1.14 -1.54 -0.85 0.00 0.00 174.74 173.81 3dgv s SER 14 N -1.53 3.49 0.15 1.40 1.04 -1.26 -4.79 113.70 112.21 3dgv s SER 14 Ca 0.05 0.96 -0.17 0.00 0.48 0.00 0.00 55.95 57.27 3dgv s SER 14 Cb -0.09 -1.54 0.04 0.00 0.10 0.00 0.00 66.02 64.53 3dgv s SER 14 CO 0.03 -2.56 1.74 0.25 0.98 0.00 0.00 173.24 173.68 3dgv h LEU 15 N -1.50 0.07 -1.07 2.42 6.46 -1.95 -0.76 115.31 118.98 3dgv h LEU 15 Ca -0.51 0.04 -0.09 0.00 -0.12 0.00 0.00 57.88 57.20 3dgv h LEU 15 Cb 1.33 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 41.30 3dgv h LEU 15 CO 0.62 0.07 -0.38 -1.13 -0.62 0.00 0.00 178.44 177.01 3dgv h ASN 16 N 0.22 0.17 -0.03 1.25 -0.73 -2.00 -1.38 115.58 113.08 3dgv h ASN 16 Ca 0.15 -0.06 -0.19 0.00 1.87 0.00 0.00 56.30 58.07 3dgv h ASN 16 Cb 0.14 -0.05 -0.00 0.00 0.27 0.00 0.00 38.32 38.69 3dgv h ASN 16 CO -0.17 0.54 -0.65 -0.08 -0.37 0.00 0.00 177.43 176.70 3dgv h GLU 17 N 0.14 0.65 -0.09 6.67 4.57 -1.79 -2.86 114.58 121.86 3dgv h GLU 17 Ca 0.02 -0.46 -0.05 0.00 -1.18 0.00 0.00 59.36 57.69 3dgv h GLU 17 Cb 0.73 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.39 3dgv h GLU 17 CO 0.06 1.08 -0.16 0.82 -1.18 0.00 0.00 179.01 179.63 3dgv h ILE 18 N 0.47 1.16 -0.07 2.32 2.04 -0.53 -1.71 117.51 121.19 3dgv h ILE 18 Ca -0.01 -0.73 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 3dgv h ILE 18 Cb 1.23 1.27 -0.00 0.00 -0.74 0.00 0.00 36.82 38.58 3dgv h ILE 18 CO 0.13 0.22 0.04 1.88 0.00 0.00 0.00 178.15 180.41 3dgv h TYR 19 N 0.13 0.10 -0.86 1.37 0.05 -1.10 -0.68 116.97 115.98 3dgv h TYR 19 Ca 0.03 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.82 3dgv h TYR 19 Cb 0.36 -0.03 -0.05 0.00 1.01 0.00 0.00 36.73 38.02 3dgv h TYR 19 CO 0.00 0.16 0.57 0.77 -1.05 0.00 0.00 178.16 178.61 3dgv h SER 20 N 0.01 0.95 -0.02 3.88 0.02 -1.28 -1.74 113.55 115.37 3dgv h SER 20 Ca 0.02 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.87 3dgv h SER 20 Cb 0.10 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3dgv h SER 20 CO -0.00 0.67 -0.23 -0.25 -1.14 0.00 0.00 176.83 175.88 3dgv h TRP 21 N 1.12 0.46 -0.60 3.45 7.01 -1.06 -0.57 115.95 125.77 3dgv h TRP 21 Ca 0.33 -0.09 -0.09 0.00 2.11 0.00 0.00 58.89 61.14 3dgv h TRP 21 Cb -0.06 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 26.87 3dgv h TRP 21 CO -0.00 0.62 0.00 0.82 -2.79 0.00 0.00 178.44 177.09 3dgv h ILE 22 N 0.37 1.27 -0.44 2.65 2.04 -0.24 -1.94 117.51 121.21 3dgv h ILE 22 Ca 0.06 -1.14 -0.10 0.00 1.00 0.00 0.00 64.86 64.67 3dgv h ILE 22 Cb 0.61 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 3dgv h ILE 22 CO 0.04 0.41 -0.14 -0.33 0.00 0.00 0.00 178.15 178.14 3dgv h GLU 23 N 0.95 0.82 -0.76 2.37 4.39 -0.98 -2.68 114.58 118.69 3dgv h GLU 23 Ca 0.17 -0.29 -0.06 0.00 0.34 0.00 0.00 59.36 59.52 3dgv h GLU 23 Cb 0.55 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.11 3dgv h GLU 23 CO 0.03 0.91 0.26 0.28 -1.16 0.00 0.00 179.01 179.33 3dgv h VAL 24 N 0.74 1.26 -0.09 3.13 2.07 -0.87 -2.68 116.25 119.81 3dgv h VAL 24 Ca 0.12 -0.89 -0.15 0.00 0.82 0.00 0.00 66.70 66.60 3dgv h VAL 24 Cb 0.64 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 3dgv h VAL 24 CO 0.04 0.35 -0.61 0.24 0.02 0.00 0.00 177.57 177.61 3dgv h MET 25 N 1.12 0.30 0.00 1.57 2.86 -1.22 -2.23 114.93 117.33 3dgv h MET 25 Ca 0.25 -0.21 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 3dgv h MET 25 Cb 0.28 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 3dgv h MET 25 CO -0.01 0.82 -0.21 1.79 1.06 0.00 0.00 176.91 180.36 3dgv h THR 26 N 0.22 0.38 0.00 2.22 1.35 -1.35 0.61 112.91 116.34 3dgv h THR 26 Ca -0.01 -1.45 0.00 0.00 -0.55 0.00 0.00 66.41 64.41 3dgv h THR 26 Cb 1.13 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.66 3dgv h THR 26 CO 0.10 0.21 -0.85 -1.84 -0.25 0.00 0.00 175.52 172.89 3dgv n GLU 27 N -3.18 0.13 -0.09 4.72 0.28 -1.02 -3.39 120.64 118.09 3dgv n GLU 27 Ca 0.03 -0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.90 3dgv n GLU 27 Cb 0.58 -1.54 -0.15 0.00 1.43 0.00 0.00 31.44 31.77 3dgv n GLU 27 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 3dgv n ARG 28 N -1.70 0.68 -3.00 3.44 0.63 -0.84 -4.60 116.66 111.26 3dgv n ARG 28 Ca 0.04 0.10 -0.24 0.00 -0.92 0.00 0.00 57.85 56.83 3dgv n ARG 28 Cb 0.38 -1.58 -0.03 0.00 0.45 0.00 0.00 32.46 31.68 3dgv n ARG 28 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3dgv n TYR 29 N -2.97 2.65 0.25 -0.14 4.01 0.19 -4.93 117.16 116.22 3dgv n TYR 29 Ca -0.33 -3.88 0.14 0.00 -0.16 0.00 0.00 57.90 53.67 3dgv n TYR 29 Cb 1.10 -0.45 0.73 0.00 -0.31 0.00 0.00 39.34 40.40 3dgv n TYR 29 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3dgv h PRO 30 N 2.97 0.00 0.00 -0.72 0.13 -1.77 0.15 132.00 132.77 3dgv h PRO 30 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3dgv h PRO 30 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 3dgv h PRO 30 CO 0.70 0.00 -1.08 -0.25 -0.23 0.00 0.00 178.00 177.14 3dgv n ASP 31 N -2.50 0.90 -0.04 1.44 8.00 -1.26 -4.54 116.55 118.55 3dgv n ASP 31 Ca -0.01 -0.89 -0.04 0.00 0.71 0.00 0.00 54.79 54.56 3dgv n ASP 31 Cb 0.09 1.08 -0.07 0.00 -0.02 0.00 0.00 41.12 42.19 3dgv n ASP 31 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3dgv n MET 32 N -1.57 2.33 -4.27 -1.24 2.81 -0.08 -4.51 117.12 110.58 3dgv n MET 32 Ca 0.03 -0.01 -0.27 0.00 -1.81 0.00 0.00 57.70 55.65 3dgv n MET 32 Cb 0.35 -1.24 -0.17 0.00 -0.71 0.00 0.00 33.22 31.45 3dgv n MET 32 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 3dgv s VAL 33 N -2.26 1.20 -0.08 2.03 -7.23 -0.49 -1.49 120.40 112.09 3dgv s VAL 33 Ca -0.05 -0.45 -0.02 0.00 -1.81 0.00 0.00 61.98 59.65 3dgv s VAL 33 Cb 0.03 -1.14 -0.03 0.00 0.56 0.00 0.00 36.38 35.80 3dgv s VAL 33 CO 0.39 0.38 0.03 -1.61 -0.31 0.00 0.00 175.10 173.98 3dgv s GLU 34 N 1.16 3.03 -0.18 4.82 2.02 -0.77 -4.65 118.70 124.13 3dgv s GLU 34 Ca -0.05 -0.39 -0.23 0.00 0.02 0.00 0.00 54.97 54.32 3dgv s GLU 34 Cb -0.14 -2.84 -0.02 0.00 0.10 0.00 0.00 34.13 31.23 3dgv s GLU 34 CO -0.03 0.70 0.73 0.21 0.02 0.00 0.00 175.26 176.89 3dgv s LYS 35 N -1.04 4.25 -0.19 1.61 2.20 -1.26 -1.72 119.74 123.58 3dgv s LYS 35 Ca 0.15 0.81 -0.01 0.00 -0.36 0.00 0.00 55.97 56.55 3dgv s LYS 35 Cb -0.11 -3.58 0.01 0.00 -1.51 0.00 0.00 37.83 32.63 3dgv s LYS 35 CO 0.04 -0.28 -0.13 0.42 -0.36 0.00 0.00 175.35 175.04 3dgv s ILE 36 N 2.03 2.70 -0.18 5.43 1.01 0.67 -5.00 121.20 127.86 3dgv s ILE 36 Ca 0.33 -0.73 -0.29 0.00 0.00 0.00 0.00 60.65 59.96 3dgv s ILE 36 Cb -0.16 -2.18 0.00 0.00 0.01 0.00 0.00 42.46 40.13 3dgv s ILE 36 CO 0.11 0.49 1.03 -2.28 0.00 0.00 0.00 174.94 174.29 3dgv s HIS 37 N 1.31 3.40 -0.14 3.97 5.65 -1.26 -1.15 115.29 127.07 3dgv s HIS 37 Ca 0.04 1.51 0.02 0.00 0.25 0.00 0.00 55.06 56.88 3dgv s HIS 37 Cb -0.14 -3.24 -0.00 0.00 -1.18 0.00 0.00 32.58 28.02 3dgv s HIS 37 CO -0.07 -0.39 0.31 0.44 -0.65 0.00 0.00 174.74 174.38 3dgv n ILE 38 N 5.04 0.00 -3.82 0.89 -5.35 -0.50 -4.99 119.36 110.62 3dgv n ILE 38 Ca 0.11 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 3dgv n ILE 38 Cb 0.47 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.39 3dgv n ILE 38 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dgv n GLY 39 N 0.56 -0.85 2.97 3.28 0.00 -1.24 -4.76 105.19 105.16 3dgv n GLY 39 Ca 0.01 -1.08 -0.14 0.00 0.00 0.00 0.00 46.02 44.81 3dgv n GLY 39 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dgv s SER 40 N -4.00 0.53 1.13 1.61 0.01 -1.26 -0.77 113.70 110.95 3dgv s SER 40 Ca 0.00 -0.25 -0.18 0.00 1.31 0.00 0.00 55.95 56.82 3dgv s SER 40 Cb 0.00 -0.01 0.26 0.00 0.21 0.00 0.00 66.02 66.49 3dgv s SER 40 CO 0.00 -0.07 1.18 -0.94 0.41 0.00 0.00 173.24 173.82 3dgv s SER 41 N -0.67 1.55 0.43 2.44 1.04 -0.25 -4.41 113.70 113.83 3dgv s SER 41 Ca -0.04 0.51 0.12 0.00 0.48 0.00 0.00 55.95 57.02 3dgv s SER 41 Cb -0.05 -0.68 0.95 0.00 0.10 0.00 0.00 66.02 66.34 3dgv s SER 41 CO -0.00 -3.72 1.99 0.22 0.98 0.00 0.00 173.24 172.71 3dgv h TYR 42 N -2.31 0.14 -0.41 5.02 3.20 -1.93 -1.26 116.97 119.41 3dgv h TYR 42 Ca -0.45 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.42 3dgv h TYR 42 Cb 1.27 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.50 3dgv h TYR 42 CO -1.89 0.24 0.00 0.39 -1.64 0.00 0.00 178.16 175.26 3dgv n GLU 43 N -4.35 2.14 -1.59 1.82 1.02 -1.26 -4.93 120.64 113.48 3dgv n GLU 43 Ca -0.01 -1.75 -0.03 0.00 -0.02 0.00 0.00 57.16 55.35 3dgv n GLU 43 Cb 0.21 -1.42 -0.01 0.00 -0.02 0.00 0.00 31.44 30.21 3dgv n GLU 43 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3dgv n LYS 44 N 0.93 -0.19 -3.01 3.49 4.76 -0.47 -5.04 118.16 118.63 3dgv n LYS 44 Ca 0.17 0.34 -0.33 0.00 -2.87 0.00 0.00 58.31 55.62 3dgv n LYS 44 Cb 0.44 -3.96 -0.06 0.00 -1.84 0.00 0.00 35.03 29.60 3dgv n LYS 44 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3dgv s TYR 45 N -2.11 3.36 0.29 2.13 1.51 -1.26 -4.77 117.35 116.49 3dgv s TYR 45 Ca 0.00 1.38 -0.29 0.00 -1.01 0.00 0.00 57.07 57.15 3dgv s TYR 45 Cb 0.00 -2.67 -0.10 0.00 -0.11 0.00 0.00 41.96 39.09 3dgv s TYR 45 CO 0.00 0.02 1.21 -1.25 -1.11 0.00 0.00 175.55 174.42 3dgv s PRO 46 N -3.03 4.49 -0.27 -1.71 0.04 -1.26 -1.09 135.00 132.17 3dgv s PRO 46 Ca 0.57 2.00 -0.14 0.00 0.04 0.00 0.00 61.00 63.47 3dgv s PRO 46 Cb -0.10 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 3dgv s PRO 46 CO 0.16 -0.01 0.33 -0.51 0.04 0.00 0.00 177.00 177.00 3dgv s LEU 47 N -1.38 4.05 -0.03 -3.56 1.02 0.05 -4.86 118.68 113.97 3dgv s LEU 47 Ca 0.48 0.24 0.05 0.00 0.02 0.00 0.00 54.13 54.92 3dgv s LEU 47 Cb -0.36 -2.36 -0.03 0.00 0.02 0.00 0.00 46.19 43.47 3dgv s LEU 47 CO 0.45 -0.14 -0.18 -0.31 0.02 0.00 0.00 176.35 176.20 3dgv s TYR 48 N 1.91 2.59 -0.04 0.29 2.02 -1.26 -1.41 117.35 121.44 3dgv s TYR 48 Ca 0.13 -0.24 0.04 0.00 -0.37 0.00 0.00 57.07 56.63 3dgv s TYR 48 Cb -0.16 -1.58 -0.03 0.00 -0.40 0.00 0.00 41.96 39.80 3dgv s TYR 48 CO 0.10 0.14 -0.15 0.08 -1.57 0.00 0.00 175.55 174.14 3dgv s VAL 49 N -0.72 2.99 -0.29 0.71 1.01 -0.30 -4.43 120.40 119.36 3dgv s VAL 49 Ca 0.11 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 3dgv s VAL 49 Cb -0.10 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 3dgv s VAL 49 CO 0.01 0.58 0.12 -0.76 0.00 0.00 0.00 175.10 175.05 3dgv s LEU 50 N -0.75 3.91 -0.11 3.92 1.43 0.37 -0.24 118.68 127.21 3dgv s LEU 50 Ca 0.12 -0.50 -0.27 0.00 -1.03 0.00 0.00 54.13 52.45 3dgv s LEU 50 Cb -0.11 -1.96 -0.02 0.00 0.03 0.00 0.00 46.19 44.14 3dgv s LEU 50 CO 0.01 -0.16 0.89 -0.75 0.23 0.00 0.00 176.35 176.56 3dgv s LYS 51 N 1.59 4.40 -0.19 1.70 2.20 -0.70 -0.55 119.74 128.18 3dgv s LYS 51 Ca 0.04 1.17 0.01 0.00 -0.36 0.00 0.00 55.97 56.84 3dgv s LYS 51 Cb -0.17 -3.53 0.03 0.00 -1.51 0.00 0.00 37.83 32.65 3dgv s LYS 51 CO 0.05 -0.22 -0.18 0.08 -0.36 0.00 0.00 175.35 174.71 3dgv s VAL 52 N 1.74 2.04 -0.10 4.02 1.01 0.24 -1.85 120.40 127.50 3dgv s VAL 52 Ca 0.43 -1.04 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 3dgv s VAL 52 Cb -0.18 -1.90 0.07 0.00 0.00 0.00 0.00 36.38 34.36 3dgv s VAL 52 CO 0.17 0.43 0.66 -0.94 0.00 0.00 0.00 175.10 175.43 3dgv s SER 53 N 1.27 -0.65 -0.33 3.32 1.04 -0.55 -0.43 113.70 117.37 3dgv s SER 53 Ca 0.03 0.86 -0.15 0.00 0.48 0.00 0.00 55.95 57.16 3dgv s SER 53 Cb -0.14 0.75 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 3dgv s SER 53 CO -0.11 -0.51 0.35 -0.75 0.98 0.00 0.00 173.24 173.20 3dgv s LYS 54 N -0.80 3.63 -0.05 4.02 2.36 -1.26 -4.26 119.74 123.39 3dgv s LYS 54 Ca -0.08 -0.37 -0.30 0.00 -2.55 0.00 0.00 55.97 52.67 3dgv s LYS 54 Cb -0.02 -3.78 -0.04 0.00 -1.05 0.00 0.00 37.83 32.94 3dgv s LYS 54 CO 0.07 -0.48 1.33 0.21 1.55 0.00 0.00 175.35 178.04 3dgv s LYS 55 N 2.00 4.29 0.00 4.03 2.47 -1.26 -4.99 119.74 126.28 3dgv s LYS 55 Ca 0.12 1.84 0.00 0.00 -1.56 0.00 0.00 55.97 56.36 3dgv s LYS 55 Cb -0.16 -3.62 0.00 0.00 -1.46 0.00 0.00 37.83 32.58 3dgv s LYS 55 CO 0.11 -0.57 0.00 0.39 0.16 0.00 0.00 175.35 175.44 3dgv n GLU 56 N 5.62 2.06 -3.60 4.03 4.71 -1.26 -5.12 120.64 127.08 3dgv n GLU 56 Ca 0.13 0.00 -0.40 0.00 -0.01 0.00 0.00 57.16 56.88 3dgv n GLU 56 Cb 0.45 0.00 -0.11 0.00 -1.01 0.00 0.00 31.44 30.76 3dgv n GLU 56 CO 0.00 0.00 0.00 -1.14 0.09 0.00 0.00 177.13 176.08 3dgv s GLN 57 N 0.87 3.31 0.21 3.49 0.74 -1.26 -5.03 119.66 121.99 3dgv s GLN 57 Ca 0.00 -0.75 0.00 0.00 0.05 0.00 0.00 55.36 54.66 3dgv s GLN 57 Cb 0.00 -3.68 0.00 0.00 1.10 0.00 0.00 33.01 30.43 3dgv s GLN 57 CO 0.00 -0.48 0.00 -2.13 -0.55 0.00 0.00 175.29 172.13 3dgv n ARG 57 N 5.03 -1.24 -3.21 1.67 3.00 -1.26 -4.96 116.66 115.70 3dgv n ARG 57 Ca -0.13 0.97 -0.15 0.00 -0.00 0.00 0.00 57.85 58.55 3dgv n ARG 57 Cb 0.49 -1.46 0.07 0.00 0.00 0.00 0.00 32.46 31.56 3dgv n ARG 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3dgv n ALA 58 N -2.86 -2.20 -3.95 5.13 0.00 -1.26 -5.02 120.51 110.35 3dgv n ALA 58 Ca -0.03 0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.19 3dgv n ALA 58 Cb 0.26 -4.36 -0.17 0.00 0.00 0.00 0.00 19.45 15.18 3dgv n ALA 58 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3dgv s LYS 59 N -4.65 1.81 0.59 0.00 2.47 -1.26 -5.05 119.74 113.65 3dgv s LYS 59 Ca 0.28 -0.50 -0.09 0.00 -1.56 0.00 0.00 55.97 54.10 3dgv s LYS 59 Cb -0.04 -1.97 -0.03 0.00 -1.46 0.00 0.00 37.83 34.33 3dgv s LYS 59 CO 0.69 -0.32 0.96 -0.80 0.16 0.00 0.00 175.35 176.04 3dgv s ASN 60 N 1.58 6.11 0.09 1.43 0.02 -1.26 -4.74 114.94 118.17 3dgv s ASN 60 Ca 0.03 1.21 0.08 0.00 -1.02 0.00 0.00 52.86 53.16 3dgv s ASN 60 Cb -0.14 -2.30 -0.04 0.00 0.02 0.00 0.00 41.25 38.79 3dgv s ASN 60 CO -0.09 -0.85 -0.16 0.00 0.02 0.00 0.00 177.10 176.02 3dgv s ALA 61 N -3.07 2.74 -0.09 0.60 0.00 0.16 -0.57 121.76 121.53 3dgv s ALA 61 Ca 0.53 -1.27 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 3dgv s ALA 61 Cb -0.11 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.23 3dgv s ALA 61 CO 0.51 0.60 -0.05 1.41 0.00 0.00 0.00 175.76 178.23 3dgv s MET 62 N -1.95 3.00 -0.20 0.00 1.75 0.12 -1.09 119.30 120.93 3dgv s MET 62 Ca 0.18 -0.52 -0.09 0.00 -1.25 0.00 0.00 55.69 54.01 3dgv s MET 62 Cb -0.11 -2.69 -0.05 0.00 2.84 0.00 0.00 34.83 34.82 3dgv s MET 62 CO 0.10 0.57 0.10 -0.46 -0.65 0.00 0.00 175.02 174.68 3dgv s TRP 63 N -0.55 3.33 -0.16 4.11 -0.11 -0.13 -0.72 118.94 124.71 3dgv s TRP 63 Ca 0.08 0.19 0.00 0.00 1.22 0.00 0.00 56.10 57.60 3dgv s TRP 63 Cb -0.12 -2.14 0.03 0.00 -1.50 0.00 0.00 33.47 29.75 3dgv s TRP 63 CO 0.02 0.20 -0.10 0.42 -4.62 0.00 0.00 176.95 172.87 3dgv s ILE 64 N 0.46 1.38 0.02 5.86 1.01 -0.40 -0.79 121.20 128.74 3dgv s ILE 64 Ca 0.06 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 60.08 3dgv s ILE 64 Cb -0.12 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 3dgv s ILE 64 CO -0.00 0.30 0.01 1.51 0.00 0.00 0.00 174.94 176.75 3dgv s ASP 65 N 1.54 5.13 0.18 3.58 1.47 -0.76 -1.41 116.67 126.40 3dgv s ASP 65 Ca 0.03 -0.04 0.08 0.00 1.18 0.00 0.00 52.55 53.79 3dgv s ASP 65 Cb -0.14 -1.32 -0.04 0.00 -0.34 0.00 0.00 42.92 41.08 3dgv s ASP 65 CO -0.09 0.25 -0.16 0.00 0.68 0.00 0.00 175.17 175.85 3dgv n GLY 67 N -0.04 0.41 0.24 0.00 0.00 -1.26 -2.26 105.19 102.29 3dgv n GLY 67 Ca -0.11 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 44.91 3dgv n GLY 67 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dgv h ILE 68 N 0.00 1.29 -3.68 -0.61 2.04 -1.91 -1.35 117.51 113.29 3dgv h ILE 68 Ca 0.00 -1.49 -0.65 0.00 1.00 0.00 0.00 64.86 63.73 3dgv h ILE 68 Cb 0.69 1.42 -0.21 0.00 -0.74 0.00 0.00 36.82 37.98 3dgv h ILE 68 CO 0.00 0.48 -0.60 -1.00 0.00 0.00 0.00 178.15 177.03 3dgv s HIS 69 N -4.38 3.12 0.26 1.37 3.76 -1.26 -4.47 115.29 113.70 3dgv s HIS 69 Ca -0.08 -0.27 -0.01 0.00 -0.15 0.00 0.00 55.06 54.55 3dgv s HIS 69 Cb 0.12 -2.26 0.55 0.00 1.11 0.00 0.00 32.58 32.10 3dgv s HIS 69 CO 0.83 -0.28 1.75 0.00 -0.85 0.00 0.00 174.74 176.19 3dgv h ALA 70 N 8.17 1.28 -0.00 -1.40 0.00 -1.65 -2.38 119.26 123.27 3dgv h ALA 70 Ca -0.37 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3dgv h ALA 70 Cb 1.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3dgv h ALA 70 CO 0.58 -0.13 -0.12 2.89 0.00 0.00 0.00 179.25 182.47 3dgv n ARG 71 N -4.90 0.55 -2.01 0.00 1.85 -1.01 -4.42 116.66 106.73 3dgv n ARG 71 Ca 0.17 -0.17 -0.42 0.00 -1.00 0.00 0.00 57.85 56.43 3dgv n ARG 71 Cb 0.46 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.37 3dgv n ARG 71 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3dgv n GLU 72 N -1.07 3.18 0.20 2.89 1.02 -0.90 -4.79 120.64 121.17 3dgv n GLU 72 Ca 0.13 -3.00 0.05 0.00 -0.02 0.00 0.00 57.16 54.32 3dgv n GLU 72 Cb 0.28 -3.14 0.51 0.00 -0.02 0.00 0.00 31.44 29.07 3dgv n GLU 72 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 3dgv h TRP 73 N 5.95 0.06 -0.02 -0.32 4.06 -1.80 -0.37 115.95 123.50 3dgv h TRP 73 Ca 0.49 -0.00 0.01 0.00 2.06 0.00 0.00 58.89 61.45 3dgv h TRP 73 Cb 0.64 -0.02 -0.00 0.00 -1.00 0.00 0.00 29.16 28.78 3dgv h TRP 73 CO 1.37 0.18 0.02 0.97 -3.56 0.00 0.00 178.44 177.42 3dgv h ILE 74 N 0.06 0.67 0.79 1.49 6.09 -1.86 -3.08 117.51 121.66 3dgv h ILE 74 Ca 0.01 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.46 3dgv h ILE 74 Cb 0.25 0.98 0.01 0.00 0.47 0.00 0.00 36.82 38.53 3dgv h ILE 74 CO 0.02 0.00 -0.38 -1.28 -3.07 0.00 0.00 178.15 173.44 3dgv h SER 75 N 0.00 -0.90 -0.49 2.19 0.87 -1.36 -2.68 113.55 111.18 3dgv h SER 75 Ca 0.01 0.03 0.12 0.00 -1.23 0.00 0.00 61.79 60.73 3dgv h SER 75 Cb 0.05 0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 3dgv h SER 75 CO -0.00 -0.57 0.34 -0.65 -0.53 0.00 0.00 176.83 175.43 3dgv h PRO 76 N -1.21 0.09 -0.62 2.24 0.11 -1.69 -1.10 132.00 129.83 3dgv h PRO 76 Ca -0.11 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.95 3dgv h PRO 76 Cb 0.81 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.87 3dgv h PRO 76 CO 0.18 0.06 0.20 0.00 -0.21 0.00 0.00 178.00 178.23 3dgv h ALA 77 N 1.76 1.19 -0.49 -0.75 0.00 -1.45 -2.21 119.26 117.30 3dgv h ALA 77 Ca 0.23 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3dgv h ALA 77 Cb 0.80 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3dgv h ALA 77 CO -0.02 0.57 0.08 0.35 0.00 0.00 0.00 179.25 180.22 3dgv h PHE 78 N 0.90 0.80 -0.26 0.00 3.57 -0.85 0.60 116.94 121.71 3dgv h PHE 78 Ca 0.20 -0.08 -0.16 0.00 3.53 0.00 0.00 57.97 61.46 3dgv h PHE 78 Cb 0.25 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 3dgv h PHE 78 CO 0.02 0.71 -0.49 0.00 -2.23 0.00 0.00 178.31 176.31 3dgv h LEU 80 N 0.55 1.09 0.25 0.00 4.07 -1.20 -2.37 115.31 117.71 3dgv h LEU 80 Ca 0.03 -0.22 -0.01 0.00 0.08 0.00 0.00 57.88 57.76 3dgv h LEU 80 Cb 1.05 -0.29 -0.00 0.00 1.08 0.00 0.00 40.66 42.50 3dgv h LEU 80 CO 0.10 1.02 -0.15 -0.25 -1.08 0.00 0.00 178.44 178.08 3dgv h TRP 81 N 1.11 -0.40 -0.31 1.13 2.91 -0.33 -0.59 115.95 119.46 3dgv h TRP 81 Ca 0.24 -0.00 0.07 0.00 1.13 0.00 0.00 58.89 60.32 3dgv h TRP 81 Cb 0.33 0.14 -0.08 0.00 -0.51 0.00 0.00 29.16 29.04 3dgv h TRP 81 CO 0.03 -0.24 -0.31 0.35 -1.03 0.00 0.00 178.44 177.23 3dgv h PHE 82 N -0.39 -0.86 -0.35 2.65 3.57 -0.67 0.16 116.94 121.05 3dgv h PHE 82 Ca -0.02 0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.42 3dgv h PHE 82 Cb 0.32 0.42 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 3dgv h PHE 82 CO -0.09 -0.38 -0.21 0.28 -2.23 0.00 0.00 178.31 175.68 3dgv h VAL 83 N -0.29 1.27 -0.37 1.41 2.07 -1.27 -2.21 116.25 116.86 3dgv h VAL 83 Ca 0.15 -1.28 -0.12 0.00 0.82 0.00 0.00 66.70 66.27 3dgv h VAL 83 Cb 0.53 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3dgv h VAL 83 CO -0.47 0.42 -0.23 1.23 0.02 0.00 0.00 177.57 178.54 3dgv h GLY 84 N 0.98 0.89 0.62 2.17 0.00 -0.47 -2.87 103.07 104.40 3dgv h GLY 84 Ca 0.09 -0.83 -0.03 0.00 0.00 0.00 0.00 47.33 46.56 3dgv h GLY 84 CO 0.05 0.75 -0.30 1.76 0.00 0.00 0.00 176.54 178.81 3dgv h SER 85 N 0.62 -0.71 0.70 0.19 0.02 -0.51 -2.63 113.55 111.23 3dgv h SER 85 Ca 0.08 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 3dgv h SER 85 Cb 0.79 0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.51 3dgv h SER 85 CO 0.06 -0.40 -0.16 -0.37 -1.14 0.00 0.00 176.83 174.83 3dgv h VAL 86 N -1.05 0.48 -0.10 2.27 -1.51 -1.54 0.24 116.25 115.05 3dgv h VAL 86 Ca -0.09 -0.81 -0.16 0.00 -1.23 0.00 0.00 66.70 64.41 3dgv h VAL 86 Cb 0.64 1.56 -0.01 0.00 -2.13 0.00 0.00 31.29 31.35 3dgv h VAL 86 CO 0.14 0.15 -0.63 0.00 -1.23 0.00 0.00 177.57 176.00 3dgv h THR 87 N 0.00 1.37 0.00 7.19 1.03 -1.53 -2.54 112.91 118.42 3dgv h THR 87 Ca -0.00 -1.98 -0.32 0.00 -0.01 0.00 0.00 66.41 64.10 3dgv h THR 87 Cb 0.55 1.98 -0.06 0.00 -1.07 0.00 0.00 68.15 69.55 3dgv h THR 87 CO 0.02 0.60 -1.92 0.00 -0.01 0.00 0.00 175.52 174.21 3dgv n TYR 88 N -3.88 0.71 0.95 0.00 9.36 -0.49 -4.42 117.16 119.40 3dgv n TYR 88 Ca -0.03 0.25 0.11 0.00 3.32 0.00 0.00 57.90 61.55 3dgv n TYR 88 Cb 0.64 -1.13 0.05 0.00 -0.63 0.00 0.00 39.34 38.27 3dgv n TYR 88 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3dgv n TYR 89 N -2.98 0.00 -1.73 2.98 4.02 0.72 -4.80 117.16 115.38 3dgv n TYR 89 Ca -0.22 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.25 3dgv n TYR 89 Cb 1.08 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 40.38 3dgv n TYR 89 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 3dgv n TYR 90 N 0.66 2.69 -0.87 -0.72 9.36 -0.96 -0.21 117.16 127.11 3dgv n TYR 90 Ca 0.11 0.31 0.00 0.00 3.32 0.00 0.00 57.90 61.65 3dgv n TYR 90 Cb 0.51 -2.56 0.00 0.00 -0.63 0.00 0.00 39.34 36.67 3dgv n TYR 90 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3dgv n GLY 91 N 2.03 0.73 0.67 2.98 0.00 -1.26 -4.78 105.19 105.56 3dgv n GLY 91 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.07 3dgv n GLY 91 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dgv n LYS 92 N -2.00 0.09 -4.37 1.61 5.02 0.71 -5.07 118.16 114.15 3dgv n LYS 92 Ca 0.00 0.03 -0.28 0.00 -2.02 0.00 0.00 58.31 56.05 3dgv n LYS 92 Cb 0.00 -0.75 -0.11 0.00 -0.02 0.00 0.00 35.03 34.15 3dgv n LYS 92 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3dgv s GLU 93 N -2.08 1.64 0.21 1.97 0.41 -0.20 -5.05 118.70 115.60 3dgv s GLU 93 Ca -0.06 -1.39 -0.05 0.00 -0.41 0.00 0.00 54.97 53.06 3dgv s GLU 93 Cb 0.02 -1.96 0.17 0.00 -1.78 0.00 0.00 34.13 30.58 3dgv s GLU 93 CO 0.08 0.43 1.64 -0.22 -0.49 0.00 0.00 175.26 176.70 3dgv h LYS 94 N 3.35 0.86 0.05 1.61 3.64 -1.98 -2.36 116.57 121.74 3dgv h LYS 94 Ca -0.48 -0.31 -0.00 0.00 -1.27 0.00 0.00 60.65 58.58 3dgv h LYS 94 Cb 1.19 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3dgv h LYS 94 CO 0.47 0.95 -0.02 1.98 -2.27 0.00 0.00 179.45 180.56 3dgv h MET 95 N 0.76 -0.06 0.00 1.90 4.05 -1.96 -2.39 114.93 117.23 3dgv h MET 95 Ca 0.12 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.51 3dgv h MET 95 Cb 0.66 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.47 3dgv h MET 95 CO 0.05 0.38 -0.17 0.45 0.23 0.00 0.00 176.91 177.84 3dgv h HIS 96 N -0.52 0.00 0.05 1.39 3.86 -1.85 -1.10 115.15 116.99 3dgv h HIS 96 Ca -0.01 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 58.95 3dgv h HIS 96 Cb 0.46 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.96 3dgv h HIS 96 CO 0.08 0.17 -1.04 1.15 0.86 0.00 0.00 177.93 179.15 3dgv h THR 97 N 0.00 1.31 0.00 2.45 2.02 -1.41 -3.27 112.91 114.01 3dgv h THR 97 Ca -0.00 -2.31 -0.08 0.00 0.77 0.00 0.00 66.41 64.79 3dgv h THR 97 Cb 0.33 2.57 -0.01 0.00 -1.74 0.00 0.00 68.15 69.30 3dgv h THR 97 CO 0.02 0.70 -0.38 0.78 0.37 0.00 0.00 175.52 177.02 3dgv h ASN 98 N 0.24 0.00 0.19 4.18 2.35 -0.99 -1.49 115.58 120.06 3dgv h ASN 98 Ca -0.14 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.61 3dgv h ASN 98 Cb 1.72 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 40.06 3dgv h ASN 98 CO 0.20 0.38 -0.25 -0.07 -1.65 0.00 0.00 177.43 176.04 3dgv h LEU 99 N 0.00 -0.70 -0.69 1.61 3.38 -1.27 -0.56 115.31 117.09 3dgv h LEU 99 Ca -0.00 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3dgv h LEU 99 Cb 0.90 0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 3dgv h LEU 99 CO 0.05 -0.36 -0.02 -0.07 0.09 0.00 0.00 178.44 178.14 3dgv h LEU 100 N -0.50 0.00 -0.19 1.67 4.07 -1.59 -1.96 115.31 116.81 3dgv h LEU 100 Ca 0.01 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.83 3dgv h LEU 100 Cb 0.49 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.23 3dgv h LEU 100 CO -0.10 0.02 -0.43 0.50 -1.08 0.00 0.00 178.44 177.35 3dgv h LYS 101 N 0.00 0.62 0.42 1.13 3.64 -1.09 -3.33 116.57 117.96 3dgv h LYS 101 Ca -0.00 -0.42 -0.02 0.00 -1.27 0.00 0.00 60.65 58.94 3dgv h LYS 101 Cb 0.78 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 3dgv h LYS 101 CO 0.00 1.04 -0.20 0.45 -2.27 0.00 0.00 179.45 178.47 3dgv h HIS 102 N 0.30 -0.53 -4.22 1.91 3.86 -0.95 -3.48 115.15 112.04 3dgv h HIS 102 Ca -0.00 -0.01 -0.13 0.00 -1.16 0.00 0.00 60.37 59.07 3dgv h HIS 102 Cb 1.04 0.17 -0.15 0.00 1.06 0.00 0.00 27.41 29.53 3dgv h HIS 102 CO 0.09 -0.23 -0.64 -1.64 0.86 0.00 0.00 177.93 176.37 3dgv s MET 103 N -5.28 0.69 0.39 2.45 -1.94 -0.75 -4.44 119.30 110.42 3dgv s MET 103 Ca -0.15 -1.23 -0.14 0.00 -1.71 0.00 0.00 55.69 52.46 3dgv s MET 103 Cb 0.03 0.23 -0.08 0.00 2.01 0.00 0.00 34.83 37.02 3dgv s MET 103 CO 0.57 -0.15 0.81 -0.51 -0.01 0.00 0.00 175.02 175.73 3dgv s ASP 104 N -2.93 6.68 -0.03 3.03 1.01 0.26 -4.36 116.67 120.33 3dgv s ASP 104 Ca 0.10 1.32 0.07 0.00 0.71 0.00 0.00 52.55 54.75 3dgv s ASP 104 Cb 0.08 -2.40 -0.02 0.00 1.01 0.00 0.00 42.92 41.59 3dgv s ASP 104 CO -0.08 -0.35 -0.24 -0.36 0.21 0.00 0.00 175.17 174.35 3dgv s PHE 105 N -2.24 2.19 -0.34 4.23 0.08 0.43 -0.71 117.98 121.62 3dgv s PHE 105 Ca 0.55 -0.50 -0.06 0.00 0.12 0.00 0.00 56.93 57.04 3dgv s PHE 105 Cb -0.10 -1.42 0.05 0.00 -0.57 0.00 0.00 43.02 40.97 3dgv s PHE 105 CO 0.24 -0.09 0.10 0.71 -0.10 0.00 0.00 175.22 176.08 3dgv s TYR 106 N -0.41 3.28 -0.21 0.36 2.02 0.10 0.81 117.35 123.29 3dgv s TYR 106 Ca 0.05 -1.54 -0.06 0.00 -0.37 0.00 0.00 57.07 55.14 3dgv s TYR 106 Cb -0.11 -2.34 -0.03 0.00 -0.40 0.00 0.00 41.96 39.08 3dgv s TYR 106 CO 0.01 -0.76 0.04 0.42 -1.57 0.00 0.00 175.55 173.69 3dgv s ILE 107 N 1.37 4.28 -0.47 2.71 1.09 0.29 -1.28 121.20 129.20 3dgv s ILE 107 Ca -0.01 -0.20 -0.10 0.00 -1.10 0.00 0.00 60.65 59.24 3dgv s ILE 107 Cb -0.20 -2.96 0.11 0.00 -1.06 0.00 0.00 42.46 38.35 3dgv s ILE 107 CO 0.02 0.40 0.34 -0.32 -0.10 0.00 0.00 174.94 175.29 3dgv s MET 108 N 1.05 2.56 0.23 2.79 1.75 -0.50 -0.48 119.30 126.70 3dgv s MET 108 Ca 0.03 -1.68 -0.08 0.00 -1.25 0.00 0.00 55.69 52.71 3dgv s MET 108 Cb -0.14 -3.93 0.20 0.00 2.84 0.00 0.00 34.83 33.80 3dgv s MET 108 CO 0.02 -1.15 1.89 -1.00 -0.65 0.00 0.00 175.02 174.13 3dgv h PRO 109 N 8.49 1.18 -3.60 4.11 0.13 -1.84 -1.30 132.00 139.17 3dgv h PRO 109 Ca -0.22 -0.09 -0.39 0.00 -0.87 0.00 0.00 66.00 64.42 3dgv h PRO 109 Cb 1.08 -0.25 -0.37 0.00 0.13 0.00 0.00 31.00 31.58 3dgv h PRO 109 CO 0.86 0.81 -0.75 0.08 -0.23 0.00 0.00 178.00 178.76 3dgv s VAL 110 N -6.04 0.19 -0.19 1.56 1.01 -1.25 -4.21 120.40 111.47 3dgv s VAL 110 Ca -0.13 0.19 -0.17 0.00 0.00 0.00 0.00 61.98 61.88 3dgv s VAL 110 Cb 0.16 -0.35 -0.12 0.00 0.00 0.00 0.00 36.38 36.07 3dgv s VAL 110 CO 0.81 0.21 0.00 0.52 0.00 0.00 0.00 175.10 176.64 3dgv n VAL 111 N 4.88 1.49 -2.04 2.92 0.31 -0.96 -4.52 118.33 120.42 3dgv n VAL 111 Ca -0.12 0.03 -0.42 0.00 -0.01 0.00 0.00 64.34 63.82 3dgv n VAL 111 Cb 0.50 -2.16 0.00 0.00 -0.91 0.00 0.00 33.84 31.27 3dgv n VAL 111 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3dgv n ASN 112 N -4.48 4.40 0.14 4.52 2.85 -0.51 -4.75 115.26 117.43 3dgv n ASN 112 Ca -0.25 -2.94 -0.00 0.00 -0.11 0.00 0.00 54.58 51.27 3dgv n ASN 112 Cb 0.55 -1.60 0.25 0.00 1.24 0.00 0.00 39.78 40.22 3dgv n ASN 112 CO 0.00 0.00 0.00 1.62 -2.11 0.00 0.00 177.26 176.77 3dgv h VAL 113 N 4.05 1.34 -0.00 3.44 3.04 -1.84 -1.56 116.25 124.72 3dgv h VAL 113 Ca 0.49 -1.62 -0.00 0.00 -1.01 0.00 0.00 66.70 64.56 3dgv h VAL 113 Cb 0.66 1.83 0.00 0.00 -2.01 0.00 0.00 31.29 31.77 3dgv h VAL 113 CO 1.75 0.47 -0.01 0.44 -1.01 0.00 0.00 177.57 179.21 3dgv h ASP 114 N 0.08 0.01 0.24 3.17 3.32 -1.96 -2.70 116.42 118.57 3dgv h ASP 114 Ca 0.00 -0.71 -0.06 0.00 0.02 0.00 0.00 57.03 56.28 3dgv h ASP 114 Cb 0.85 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 3dgv h ASP 114 CO 0.06 0.72 -0.27 1.23 -1.72 0.00 0.00 179.24 179.26 3dgv h GLY 115 N -0.70 0.07 0.89 2.75 0.00 -1.76 -1.04 103.07 103.27 3dgv h GLY 115 Ca -0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 3dgv h GLY 115 CO 0.00 0.04 0.06 -1.82 0.00 0.00 0.00 176.54 174.83 3dgv h TYR 116 N 0.06 0.53 -0.68 5.60 3.20 -1.31 -0.90 116.97 123.46 3dgv h TYR 116 Ca 0.01 -0.07 -0.05 0.00 3.14 0.00 0.00 58.73 61.76 3dgv h TYR 116 Cb 0.52 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 3dgv h TYR 116 CO 0.00 0.57 0.22 0.22 -1.64 0.00 0.00 178.16 177.53 3dgv h ASP 117 N 0.33 0.97 -0.93 -2.11 3.58 -1.30 -2.46 116.42 114.49 3dgv h ASP 117 Ca 0.09 -0.17 0.13 0.00 0.42 0.00 0.00 57.03 57.51 3dgv h ASP 117 Cb 0.32 -0.25 -0.09 0.00 1.72 0.00 0.00 39.33 41.03 3dgv h ASP 117 CO 0.00 0.90 0.56 0.22 -2.88 0.00 0.00 179.24 178.04 3dgv h TYR 118 N 1.00 1.00 0.00 0.28 3.20 -0.62 -1.75 116.97 120.08 3dgv h TYR 118 Ca 0.22 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.05 3dgv h TYR 118 Cb 0.27 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 3dgv h TYR 118 CO 0.02 0.35 -0.38 1.79 -1.64 0.00 0.00 178.16 178.30 3dgv h THR 119 N 0.85 0.93 0.00 1.81 1.35 -0.70 -0.29 112.91 116.86 3dgv h THR 119 Ca 0.48 -1.49 -0.10 0.00 -0.55 0.00 0.00 66.41 64.75 3dgv h THR 119 Cb 0.55 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.84 3dgv h THR 119 CO -0.30 0.37 -0.47 -0.50 -0.25 0.00 0.00 175.52 174.38 3dgv h TRP 120 N 0.00 0.00 0.00 4.73 4.06 -1.19 -3.28 115.95 120.27 3dgv h TRP 120 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3dgv h TRP 120 Cb 0.86 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.02 3dgv h TRP 120 CO 0.00 0.47 -0.41 1.63 -3.56 0.00 0.00 178.44 176.57 3dgv n LYS 121 N -3.30 4.41 0.00 0.49 5.02 -0.87 -4.93 118.16 118.98 3dgv n LYS 121 Ca 0.01 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 3dgv n LYS 121 Cb 0.67 -0.74 0.00 0.00 -0.02 0.00 0.00 35.03 34.94 3dgv n LYS 121 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3dgv n LYS 122 N -1.21 0.00 -3.36 1.97 4.76 -0.15 -5.08 118.16 115.08 3dgv n LYS 122 Ca 0.00 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.31 3dgv n LYS 122 Cb 0.05 -0.18 -0.08 0.00 -1.84 0.00 0.00 35.03 32.97 3dgv n LYS 122 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3dgv s ASP 123 N -4.15 1.09 0.56 4.39 -1.08 -1.00 -4.95 116.67 111.53 3dgv s ASP 123 Ca 0.00 -0.56 0.28 0.00 -0.52 0.00 0.00 52.55 51.74 3dgv s ASP 123 Cb 0.00 0.77 1.66 0.00 -1.46 0.00 0.00 42.92 43.89 3dgv s ASP 123 CO 0.00 -0.37 2.19 -0.09 0.52 0.00 0.00 175.17 177.42 3dgv h ARG 124 N 8.22 0.00 -0.05 4.34 9.65 -1.83 -2.64 114.38 132.07 3dgv h ARG 124 Ca -0.12 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.76 3dgv h ARG 124 Cb 1.10 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.68 3dgv h ARG 124 CO 0.30 0.04 0.00 -1.33 2.80 0.00 0.00 179.97 181.78 3dgv n MET 125 N -3.86 1.76 -1.95 0.20 0.00 -1.26 -4.65 117.12 107.37 3dgv n MET 125 Ca -0.03 -1.12 -0.39 0.00 0.00 0.00 0.00 57.70 56.17 3dgv n MET 125 Cb 0.13 -1.47 0.02 0.00 0.00 0.00 0.00 33.22 31.90 3dgv n MET 125 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 175.97 175.51 3dgv s TRP 126 N -1.96 2.56 0.00 2.03 -0.11 -0.99 -4.87 118.94 115.60 3dgv s TRP 126 Ca 0.36 1.40 0.00 0.00 1.22 0.00 0.00 56.10 59.08 3dgv s TRP 126 Cb 0.20 -3.70 0.00 0.00 -1.50 0.00 0.00 33.47 28.47 3dgv s TRP 126 CO 0.32 -2.42 0.00 -2.13 -4.62 0.00 0.00 176.95 168.10 3dgv n ARG 127 N -0.50 0.00 -0.64 5.86 0.63 -1.26 -2.39 116.66 118.36 3dgv n ARG 127 Ca 0.07 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.95 3dgv n ARG 127 Cb 0.45 -0.92 0.03 0.00 0.45 0.00 0.00 32.46 32.46 3dgv n ARG 127 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 3dgv n LYS 128 N -2.43 0.10 -0.23 -0.14 5.02 -1.26 -2.29 118.16 116.92 3dgv n LYS 128 Ca 0.00 -0.43 0.00 0.00 -2.02 0.00 0.00 58.31 55.86 3dgv n LYS 128 Cb 0.45 -0.19 0.00 0.00 -0.02 0.00 0.00 35.03 35.27 3dgv n LYS 128 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3dgv n ASN 129 N -3.07 0.00 -1.60 4.39 6.94 -0.60 -4.41 115.26 116.90 3dgv n ASN 129 Ca 0.03 -0.69 -0.12 0.00 -0.02 0.00 0.00 54.58 53.78 3dgv n ASN 129 Cb 0.11 0.00 0.08 0.00 -2.36 0.00 0.00 39.78 37.61 3dgv n ASN 129 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3dgv n ARG 130 N -0.69 2.75 -2.93 -3.83 5.12 -1.26 -3.97 116.66 111.85 3dgv n ARG 130 Ca 0.00 -3.79 -0.30 0.00 -1.93 0.00 0.00 57.85 51.83 3dgv n ARG 130 Cb 0.00 -1.96 -0.03 0.00 -1.16 0.00 0.00 32.46 29.31 3dgv n ARG 130 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3dgv s SER 131 N -3.45 6.50 -0.08 0.55 1.04 -1.26 -4.76 113.70 112.24 3dgv s SER 131 Ca 0.45 1.05 0.04 0.00 0.48 0.00 0.00 55.95 57.97 3dgv s SER 131 Cb 0.39 -2.29 -0.00 0.00 0.10 0.00 0.00 66.02 64.22 3dgv s SER 131 CO -0.01 -0.37 -0.22 -0.22 0.98 0.00 0.00 173.24 173.40 3dgv s LEU 132 N -3.84 2.00 -0.06 2.42 2.96 -1.26 -1.14 118.68 119.77 3dgv s LEU 132 Ca 0.50 -0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 53.91 3dgv s LEU 132 Cb -0.10 -1.27 -0.03 0.00 0.50 0.00 0.00 46.19 45.29 3dgv s LEU 132 CO 0.32 0.16 0.03 -1.00 -1.32 0.00 0.00 176.35 174.53 3dgv s HIS 133 N 0.26 3.20 0.08 5.38 3.76 -1.26 -5.05 115.29 121.66 3dgv s HIS 133 Ca -0.14 0.20 -0.37 0.00 -0.15 0.00 0.00 55.06 54.60 3dgv s HIS 133 Cb -0.16 -1.77 -0.17 0.00 1.11 0.00 0.00 32.58 31.59 3dgv s HIS 133 CO 0.06 0.50 1.28 -1.91 -0.85 0.00 0.00 174.74 173.83 3dgv n GLU 134 N 1.82 0.94 -1.16 1.40 2.13 -1.26 -1.17 120.64 123.34 3dgv n GLU 134 Ca -0.17 0.34 -0.06 0.00 0.66 0.00 0.00 57.16 57.93 3dgv n GLU 134 Cb 0.53 -1.95 -0.02 0.00 0.27 0.00 0.00 31.44 30.27 3dgv n GLU 134 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3dgv n LYS 135 N 2.29 -0.85 -3.25 5.31 5.02 -1.26 -5.01 118.16 120.41 3dgv n LYS 135 Ca 0.18 0.58 -0.38 0.00 -2.02 0.00 0.00 58.31 56.67 3dgv n LYS 135 Cb 0.17 -4.43 -0.06 0.00 -0.02 0.00 0.00 35.03 30.70 3dgv n LYS 135 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3dgv s ASN 136 N -2.48 6.80 0.22 4.39 0.01 -0.32 -4.98 114.94 118.58 3dgv s ASN 136 Ca 0.00 0.96 -0.08 0.00 -0.71 0.00 0.00 52.86 53.03 3dgv s ASN 136 Cb 0.00 -2.32 0.18 0.00 0.41 0.00 0.00 41.25 39.52 3dgv s ASN 136 CO 0.00 0.02 1.83 0.00 -1.51 0.00 0.00 177.10 177.43 3dgv h ALA 137 N 6.42 1.09 -1.67 0.60 0.00 -1.94 -3.46 119.26 120.29 3dgv h ALA 137 Ca -0.42 -0.15 -0.58 0.00 0.00 0.00 0.00 54.91 53.75 3dgv h ALA 137 Cb 1.19 -0.34 -0.10 0.00 0.00 0.00 0.00 17.79 18.54 3dgv h ALA 137 CO 0.74 0.63 -0.54 0.00 0.00 0.00 0.00 179.25 180.07 3dgv s VAL 139 N -2.61 5.13 0.00 0.00 1.01 -1.26 -4.74 120.40 117.93 3dgv s VAL 139 Ca 0.38 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.86 3dgv s VAL 139 Cb 0.04 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.79 3dgv s VAL 139 CO 0.21 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.31 3dgv n GLY 140 N 1.23 1.61 3.24 4.51 0.00 -0.29 -4.90 105.19 110.59 3dgv n GLY 140 Ca -0.11 -1.53 -0.27 0.00 0.00 0.00 0.00 46.02 44.11 3dgv n GLY 140 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dgv s THR 141 N -1.11 1.69 -0.50 2.61 2.01 -1.26 -4.84 115.64 114.24 3dgv s THR 141 Ca 0.00 -0.98 -0.28 0.00 0.31 0.00 0.00 61.69 60.75 3dgv s THR 141 Cb 0.00 -1.42 -0.00 0.00 0.01 0.00 0.00 72.50 71.09 3dgv s THR 141 CO 0.00 0.42 1.58 -0.62 -0.69 0.00 0.00 174.62 175.31 3dgv s ASP 142 N -0.65 5.94 0.46 3.53 -1.08 -0.39 -1.56 116.67 122.93 3dgv s ASP 142 Ca 0.08 0.58 0.12 0.00 -0.52 0.00 0.00 52.55 52.82 3dgv s ASP 142 Cb -0.08 -2.54 1.08 0.00 -1.46 0.00 0.00 42.92 39.91 3dgv s ASP 142 CO -0.00 -1.80 2.08 -0.07 0.52 0.00 0.00 175.17 175.90 3dgv h LEU 143 N 13.75 0.24 -0.24 -1.34 3.38 -1.87 0.72 115.31 129.96 3dgv h LEU 143 Ca -0.28 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3dgv h LEU 143 Cb 1.12 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3dgv h LEU 143 CO 1.14 0.17 0.00 -3.20 0.09 0.00 0.00 178.44 176.64 3dgv n ASN 144 N -4.50 0.28 0.00 -0.43 5.15 -1.26 -2.11 115.26 112.40 3dgv n ASN 144 Ca 0.02 -2.00 0.00 0.00 -0.60 0.00 0.00 54.58 51.99 3dgv n ASN 144 Cb 0.14 -0.09 0.00 0.00 -0.53 0.00 0.00 39.78 39.30 3dgv n ASN 144 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3dgv n ARG 145 N -0.36 1.15 0.00 1.20 1.74 0.24 -3.25 116.66 117.38 3dgv n ARG 145 Ca 0.01 -0.97 0.10 0.00 -0.77 0.00 0.00 57.85 56.21 3dgv n ARG 145 Cb 0.06 -0.93 -0.03 0.00 -1.02 0.00 0.00 32.46 30.54 3dgv n ARG 145 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3dgv n ASN 146 N -0.25 1.61 -4.82 0.55 4.05 -0.90 -4.47 115.26 111.03 3dgv n ASN 146 Ca 0.00 -1.30 -0.33 0.00 0.45 0.00 0.00 54.58 53.40 3dgv n ASN 146 Cb 0.18 0.63 -0.05 0.00 1.23 0.00 0.00 39.78 41.76 3dgv n ASN 146 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 3dgv s PHE 147 N -2.42 3.32 -0.85 1.20 0.40 0.27 -0.02 117.98 119.88 3dgv s PHE 147 Ca 0.14 1.56 -0.08 0.00 -0.60 0.00 0.00 56.93 57.95 3dgv s PHE 147 Cb 0.16 -2.85 -0.17 0.00 0.51 0.00 0.00 43.02 40.66 3dgv s PHE 147 CO 0.59 -0.27 3.25 0.00 0.70 0.00 0.00 175.22 179.49 3dgv n ALA 148 N -0.99 6.94 -1.90 5.36 0.00 -1.26 -4.33 120.51 124.33 3dgv n ALA 148 Ca 0.07 -2.69 -0.30 0.00 0.00 0.00 0.00 53.44 50.53 3dgv n ALA 148 Cb 0.54 -2.87 0.06 0.00 0.00 0.00 0.00 19.45 17.18 3dgv n ALA 148 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3dgv s SER 149 N 2.12 5.15 0.68 0.00 1.04 -1.26 -4.86 113.70 116.56 3dgv s SER 149 Ca 0.68 0.99 -0.17 0.00 0.48 0.00 0.00 55.95 57.92 3dgv s SER 149 Cb 0.24 -1.70 0.01 0.00 0.10 0.00 0.00 66.02 64.67 3dgv s SER 149 CO -0.03 -1.51 1.28 -0.75 0.98 0.00 0.00 173.24 173.21 3dgv s LYS 150 N -5.41 2.36 -1.51 4.02 2.20 -1.26 -3.20 119.74 116.94 3dgv s LYS 150 Ca 0.59 2.01 0.00 0.00 -0.36 0.00 0.00 55.97 58.21 3dgv s LYS 150 Cb -0.11 -1.83 0.00 0.00 -1.51 0.00 0.00 37.83 34.38 3dgv s LYS 150 CO 0.50 -1.73 0.00 0.72 -0.36 0.00 0.00 175.35 174.48 3dgv n HIS 150 N -2.19 -0.55 -1.68 4.03 8.25 -1.26 -4.49 115.22 117.34 3dgv n HIS 150 Ca 0.15 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.18 3dgv n HIS 150 Cb 0.49 -3.20 -0.02 0.00 1.12 0.00 0.00 29.99 28.38 3dgv n HIS 150 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85 3dgv n TRP 151 N -3.56 2.23 -2.48 4.41 -0.00 -1.19 -0.56 117.44 116.29 3dgv n TRP 151 Ca -0.19 0.46 -0.12 0.00 -0.00 0.00 0.00 57.50 57.66 3dgv n TRP 151 Cb 0.62 -2.45 -0.01 0.00 -0.00 0.00 0.00 31.31 29.47 3dgv n TRP 151 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3dgv n GLY 153 N -0.79 0.74 3.64 0.00 0.00 0.28 -4.83 105.19 104.24 3dgv n GLY 153 Ca -0.13 -1.87 -0.48 0.00 0.00 0.00 0.00 46.02 43.54 3dgv n GLY 153 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3dgv n GLU 154 N -0.15 1.81 0.00 1.61 2.13 -1.26 -1.31 120.64 123.47 3dgv n GLU 154 Ca 0.00 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.47 3dgv n GLU 154 Cb 0.00 -2.38 0.00 0.00 0.27 0.00 0.00 31.44 29.33 3dgv n GLU 154 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dgv n GLY 155 N 3.13 0.52 3.25 8.31 0.00 -1.26 -4.41 105.19 114.74 3dgv n GLY 155 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 3dgv n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dgv s ALA 156 N -2.00 1.00 0.00 4.61 0.00 -0.43 -4.55 121.76 120.40 3dgv s ALA 156 Ca 0.00 -1.60 0.04 0.00 0.00 0.00 0.00 51.96 50.40 3dgv s ALA 156 Cb 0.00 1.35 -0.01 0.00 0.00 0.00 0.00 23.12 24.46 3dgv s ALA 156 CO 0.00 -0.63 -0.13 0.45 0.00 0.00 0.00 175.76 175.45 3dgv s SER 157 N -3.15 1.54 -0.06 0.00 0.15 -0.76 -4.78 113.70 106.64 3dgv s SER 157 Ca 0.37 -0.28 0.17 0.00 0.70 0.00 0.00 55.95 56.90 3dgv s SER 157 Cb 0.06 -0.15 0.58 0.00 -1.71 0.00 0.00 66.02 64.79 3dgv s SER 157 CO 0.12 0.13 1.47 -1.54 1.20 0.00 0.00 173.24 174.62 3dgv n SER 158 N 2.58 3.75 -4.59 5.45 3.41 -1.26 -1.01 113.62 121.95 3dgv n SER 158 Ca -0.15 -2.23 -0.37 0.00 -0.26 0.00 0.00 58.87 55.86 3dgv n SER 158 Cb 0.55 -0.48 -0.11 0.00 -0.26 0.00 0.00 64.21 63.91 3dgv n SER 158 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3dgv s SER 159 N -0.89 5.84 0.24 4.04 0.15 -1.26 -4.97 113.70 116.85 3dgv s SER 159 Ca 0.42 -0.01 0.20 0.00 0.70 0.00 0.00 55.95 57.26 3dgv s SER 159 Cb 0.25 -2.06 0.95 0.00 -1.71 0.00 0.00 66.02 63.44 3dgv s SER 159 CO 0.23 0.00 1.61 -1.54 1.20 0.00 0.00 173.24 174.75 3dgv n SER 160 N 4.69 0.52 -0.40 5.45 3.41 -1.26 -0.90 113.62 125.12 3dgv n SER 160 Ca -0.15 0.68 0.13 0.00 -0.26 0.00 0.00 58.87 59.27 3dgv n SER 160 Cb 0.52 -0.77 0.45 0.00 -0.26 0.00 0.00 64.21 64.15 3dgv n SER 160 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dgv s SER 162 N -2.20 7.14 0.11 0.00 0.15 -0.08 -4.93 113.70 113.89 3dgv s SER 162 Ca 0.32 1.77 0.21 0.00 0.70 0.00 0.00 55.95 58.96 3dgv s SER 162 Cb 0.20 -2.56 0.86 0.00 -1.71 0.00 0.00 66.02 62.81 3dgv s SER 162 CO 0.41 -0.21 1.66 -0.62 1.20 0.00 0.00 173.24 175.67 3dgv n GLU 163 N -0.01 0.09 -1.54 5.44 -0.58 -1.26 -2.49 120.64 120.29 3dgv n GLU 163 Ca 0.04 0.26 -0.14 0.00 -0.42 0.00 0.00 57.16 56.90 3dgv n GLU 163 Cb 0.52 -1.65 0.08 0.00 -0.57 0.00 0.00 31.44 29.82 3dgv n GLU 163 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 3dgv n ILE 164 N -1.82 2.42 -1.94 -3.67 -5.35 -1.26 -4.55 119.36 103.19 3dgv n ILE 164 Ca 0.04 -3.89 -0.42 0.00 -0.27 0.00 0.00 62.75 58.21 3dgv n ILE 164 Cb 0.25 -0.83 -0.03 0.00 -1.74 0.00 0.00 39.64 37.29 3dgv n ILE 164 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 3dgv s TYR 165 N -3.48 2.87 -2.18 4.28 5.04 -1.04 -1.83 117.35 121.02 3dgv s TYR 165 Ca 0.47 0.54 0.27 0.00 -2.44 0.00 0.00 57.07 55.91 3dgv s TYR 165 Cb 0.40 -3.93 0.92 0.00 0.35 0.00 0.00 41.96 39.69 3dgv s TYR 165 CO 0.00 -3.54 1.66 0.00 -1.34 0.00 0.00 175.55 172.34 3dgv n GLY 167 N 1.25 -0.25 0.12 0.00 0.00 -1.26 -4.22 105.19 100.82 3dgv n GLY 167 Ca 0.16 -1.85 -0.00 0.00 0.00 0.00 0.00 46.02 44.33 3dgv n GLY 167 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dgv h THR 168 N 0.00 1.06 -2.35 2.61 1.35 -1.96 -3.48 112.91 110.14 3dgv h THR 168 Ca 0.00 -2.52 0.12 0.00 -0.55 0.00 0.00 66.41 63.47 3dgv h THR 168 Cb 0.00 2.51 -0.12 0.00 -1.73 0.00 0.00 68.15 68.81 3dgv h THR 168 CO 0.00 0.60 0.47 -0.72 -0.25 0.00 0.00 175.52 175.62 3dgv s TYR 169 N -2.89 -0.28 0.00 4.73 1.13 -1.26 -5.04 117.35 113.73 3dgv s TYR 169 Ca 0.03 0.08 -0.35 0.00 -1.41 0.00 0.00 57.07 55.42 3dgv s TYR 169 Cb 0.08 0.58 -0.14 0.00 -1.10 0.00 0.00 41.96 41.38 3dgv s TYR 169 CO 0.77 -0.67 1.65 -2.30 -2.51 0.00 0.00 175.55 172.49 3dgv n PRO 170 N -0.33 1.81 -1.19 -3.49 -0.02 -1.26 -0.37 135.00 130.15 3dgv n PRO 170 Ca -0.08 0.66 -0.07 0.00 -2.02 0.00 0.00 63.50 61.99 3dgv n PRO 170 Cb 0.62 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 3dgv n PRO 170 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dgv n GLU 171 N 4.53 -0.70 0.00 -0.52 1.02 0.98 -4.90 120.64 121.05 3dgv n GLU 171 Ca 0.20 0.66 0.01 0.00 -0.02 0.00 0.00 57.16 58.01 3dgv n GLU 171 Cb 0.25 -4.49 0.04 0.00 -0.02 0.00 0.00 31.44 27.22 3dgv n GLU 171 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3dgv n SER 172 N 0.26 0.00 -4.70 1.62 3.41 0.50 -4.31 113.62 110.40 3dgv n SER 172 Ca -0.07 0.43 -0.35 0.00 -0.26 0.00 0.00 58.87 58.62 3dgv n SER 172 Cb 0.28 -0.44 -0.09 0.00 -0.26 0.00 0.00 64.21 63.70 3dgv n SER 172 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3dgv s GLU 173 N -2.87 3.75 0.38 4.33 0.41 -1.26 -4.95 118.70 118.48 3dgv s GLU 173 Ca 0.01 -0.29 0.12 0.00 -0.41 0.00 0.00 54.97 54.40 3dgv s GLU 173 Cb 0.01 -3.17 0.92 0.00 -1.78 0.00 0.00 34.13 30.11 3dgv s GLU 173 CO 0.03 0.44 1.88 -1.00 -0.49 0.00 0.00 175.26 176.12 3dgv h PRO 174 N 6.11 0.56 -0.22 0.39 0.13 -1.86 0.12 132.00 137.23 3dgv h PRO 174 Ca -0.43 -0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 3dgv h PRO 174 Cb 1.18 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 3dgv h PRO 174 CO 0.66 0.37 -0.33 0.93 -0.23 0.00 0.00 178.00 179.40 3dgv h GLU 175 N 0.57 0.60 -0.30 0.86 3.07 -1.92 -0.93 114.58 116.53 3dgv h GLU 175 Ca 0.43 -0.36 -0.03 0.00 -0.50 0.00 0.00 59.36 58.90 3dgv h GLU 175 Cb 0.83 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.76 3dgv h GLU 175 CO -0.18 0.97 0.08 0.28 -1.40 0.00 0.00 179.01 178.76 3dgv h VAL 176 N 0.29 1.21 -0.66 3.13 2.07 -1.60 -1.86 116.25 118.83 3dgv h VAL 176 Ca 0.02 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.88 3dgv h VAL 176 Cb 0.91 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 3dgv h VAL 176 CO 0.08 0.24 0.44 0.50 0.02 0.00 0.00 177.57 178.84 3dgv h LYS 177 N 0.33 0.71 -0.21 1.57 1.63 -0.78 0.11 116.57 119.93 3dgv h LYS 177 Ca 0.10 -0.04 -0.16 0.00 -0.85 0.00 0.00 60.65 59.69 3dgv h LYS 177 Cb 0.28 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.74 3dgv h LYS 177 CO 0.00 0.47 -0.54 0.00 -3.45 0.00 0.00 179.45 175.93 3dgv h ALA 178 N 1.63 0.67 -0.03 5.00 0.00 -0.67 -0.54 119.26 125.33 3dgv h ALA 178 Ca 0.28 -0.51 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 3dgv h ALA 178 Cb 0.17 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.89 3dgv h ALA 178 CO -0.08 0.69 -0.39 0.28 0.00 0.00 0.00 179.25 179.75 3dgv h VAL 179 N 0.47 1.47 -0.48 0.00 2.07 -0.65 -2.67 116.25 116.45 3dgv h VAL 179 Ca 0.01 -1.91 0.06 0.00 0.82 0.00 0.00 66.70 65.68 3dgv h VAL 179 Cb 1.09 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 33.37 3dgv h VAL 179 CO 0.10 0.54 0.20 0.00 0.02 0.00 0.00 177.57 178.44 3dgv h ALA 180 N 0.34 0.60 -1.00 1.67 0.00 -0.81 -0.81 119.26 119.25 3dgv h ALA 180 Ca -0.04 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3dgv h ALA 180 Cb 1.09 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 3dgv h ALA 180 CO 0.08 -0.18 0.66 -0.44 0.00 0.00 0.00 179.25 179.37 3dgv h ASP 181 N 0.39 1.15 -0.10 0.00 3.32 -1.15 -1.25 116.42 118.79 3dgv h ASP 181 Ca 0.23 -0.03 -0.20 0.00 0.02 0.00 0.00 57.03 57.04 3dgv h ASP 181 Cb 0.20 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3dgv h ASP 181 CO -0.21 0.84 -0.68 0.15 -1.72 0.00 0.00 179.24 177.62 3dgv h PHE 182 N 1.36 0.96 -0.29 4.55 3.57 -1.01 -1.86 116.94 124.22 3dgv h PHE 182 Ca 0.37 -0.39 -0.16 0.00 3.53 0.00 0.00 57.97 61.32 3dgv h PHE 182 Cb -0.15 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.42 3dgv h PHE 182 CO 0.00 1.20 -0.46 -0.07 -2.23 0.00 0.00 178.31 176.75 3dgv h LEU 183 N 0.52 0.83 -0.77 0.59 3.38 -1.01 -2.37 115.31 116.48 3dgv h LEU 183 Ca -0.02 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 3dgv h LEU 183 Cb 1.29 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 3dgv h LEU 183 CO 0.14 1.16 0.43 0.03 0.09 0.00 0.00 178.44 180.29 3dgv h ARG 184 N 0.61 1.07 -0.05 1.13 3.08 -1.15 -1.38 114.38 117.70 3dgv h ARG 184 Ca 0.03 -0.12 -0.11 0.00 0.07 0.00 0.00 59.98 59.85 3dgv h ARG 184 Cb 1.03 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 3dgv h ARG 184 CO 0.10 0.79 -0.49 -0.09 -1.07 0.00 0.00 179.97 179.21 3dgv h ARG 185 N 1.07 0.12 -0.38 0.04 2.43 -1.14 -2.77 114.38 113.75 3dgv h ARG 185 Ca 0.27 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.33 3dgv h ARG 185 Cb 0.02 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 3dgv h ARG 185 CO -0.04 0.59 0.03 0.09 -1.51 0.00 0.00 179.97 179.12 3dgv n ASN 186 N -3.96 4.14 0.12 -3.80 3.02 -0.91 -4.72 115.26 109.15 3dgv n ASN 186 Ca -0.02 -3.12 0.10 0.00 -0.03 0.00 0.00 54.58 51.51 3dgv n ASN 186 Cb 0.52 -0.60 0.47 0.00 -0.61 0.00 0.00 39.78 39.56 3dgv n ASN 186 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dgv n ILE 187 N -0.37 1.11 0.06 2.41 0.13 -0.54 -2.64 119.36 119.52 3dgv n ILE 187 Ca 0.26 0.55 -0.10 0.00 -1.10 0.00 0.00 62.75 62.37 3dgv n ILE 187 Cb 1.03 -1.52 -0.13 0.00 -0.84 0.00 0.00 39.64 38.17 3dgv n ILE 187 CO 0.00 0.00 0.00 0.50 2.80 0.00 0.00 176.55 179.85 3dgv h LYS 188 N 0.00 0.07 0.00 9.51 3.64 -1.85 -3.35 116.57 124.59 3dgv h LYS 188 Ca 0.00 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3dgv h LYS 188 Cb 0.11 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3dgv h LYS 188 CO 0.00 0.98 -0.98 0.72 -2.27 0.00 0.00 179.45 177.90 3dgv n HIS 188 N -3.35 0.00 -2.59 1.91 8.25 -1.08 -4.92 115.22 113.44 3dgv n HIS 188 Ca -0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.98 3dgv n HIS 188 Cb 0.98 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.96 3dgv n HIS 188 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3dgv s ILE 189 N -2.55 4.56 0.00 1.59 1.01 -1.18 0.38 121.20 125.01 3dgv s ILE 189 Ca 0.02 1.85 0.00 0.00 0.00 0.00 0.00 60.65 62.52 3dgv s ILE 189 Cb 0.10 -4.19 0.00 0.00 0.01 0.00 0.00 42.46 38.38 3dgv s ILE 189 CO 0.59 -0.00 0.00 0.29 0.00 0.00 0.00 174.94 175.82 3dgv n LYS 190 N 5.11 3.36 -3.89 2.79 4.76 -0.25 -4.89 118.16 125.15 3dgv n LYS 190 Ca 0.10 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.43 3dgv n LYS 190 Cb 0.48 -0.75 -0.12 0.00 -1.84 0.00 0.00 35.03 32.79 3dgv n LYS 190 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3dgv s ALA 191 N -1.50 -0.08 -0.06 7.82 0.00 -1.20 -3.87 121.76 122.87 3dgv s ALA 191 Ca 0.00 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.86 3dgv s ALA 191 Cb 0.00 0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.15 3dgv s ALA 191 CO 0.00 -0.09 -0.07 -0.47 0.00 0.00 0.00 175.76 175.13 3dgv s TYR 192 N -0.62 1.02 -0.03 0.00 5.04 0.10 -0.95 117.35 121.90 3dgv s TYR 192 Ca -0.07 -0.35 0.03 0.00 -2.44 0.00 0.00 57.07 54.24 3dgv s TYR 192 Cb -0.04 -0.84 0.01 0.00 0.35 0.00 0.00 41.96 41.43 3dgv s TYR 192 CO -0.00 -0.25 -0.10 0.42 -1.34 0.00 0.00 175.55 174.27 3dgv s ILE 193 N 0.97 0.90 -0.17 3.14 1.01 0.03 -0.34 121.20 126.74 3dgv s ILE 193 Ca -0.10 -0.41 -0.00 0.00 0.00 0.00 0.00 60.65 60.15 3dgv s ILE 193 Cb -0.14 -0.80 0.00 0.00 0.01 0.00 0.00 42.46 41.52 3dgv s ILE 193 CO 0.00 0.28 -0.15 -0.55 0.00 0.00 0.00 174.94 174.52 3dgv s SER 194 N 0.29 3.63 -0.24 3.58 0.15 -0.27 -1.83 113.70 119.02 3dgv s SER 194 Ca -0.05 -0.50 -0.21 0.00 0.70 0.00 0.00 55.95 55.89 3dgv s SER 194 Cb -0.10 -1.57 -0.02 0.00 -1.71 0.00 0.00 66.02 62.62 3dgv s SER 194 CO 0.01 0.06 0.68 -0.04 1.20 0.00 0.00 173.24 175.14 3dgv s MET 195 N 0.99 4.16 0.09 5.44 -1.94 -0.06 -1.39 119.30 126.58 3dgv s MET 195 Ca -0.02 0.66 0.01 0.00 -1.71 0.00 0.00 55.69 54.63 3dgv s MET 195 Cb -0.15 -3.63 -0.00 0.00 2.01 0.00 0.00 34.83 33.06 3dgv s MET 195 CO -0.03 -0.39 0.03 0.72 -0.01 0.00 0.00 175.02 175.34 3dgv n HIS 196 N 5.60 0.06 -3.54 -0.03 8.25 0.23 -4.16 115.22 121.63 3dgv n HIS 196 Ca 0.01 -0.57 -0.10 0.00 -0.26 0.00 0.00 57.72 56.80 3dgv n HIS 196 Cb 0.49 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.57 3dgv n HIS 196 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3dgv s SER 197 N -1.56 -0.45 0.39 0.41 1.04 -1.26 -0.28 113.70 111.99 3dgv s SER 197 Ca 0.04 -0.15 0.04 0.00 0.48 0.00 0.00 55.95 56.36 3dgv s SER 197 Cb 0.00 0.59 -0.05 0.00 0.10 0.00 0.00 66.02 66.66 3dgv s SER 197 CO 0.03 -0.99 0.05 -0.72 0.98 0.00 0.00 173.24 172.58 3dgv s TYR 198 N -3.67 2.06 0.00 5.02 1.13 -1.26 -4.91 117.35 115.72 3dgv s TYR 198 Ca 0.04 -0.94 0.00 0.00 -1.41 0.00 0.00 57.07 54.76 3dgv s TYR 198 Cb -0.02 -1.44 0.00 0.00 -1.10 0.00 0.00 41.96 39.40 3dgv s TYR 198 CO -0.07 0.10 0.00 -1.13 -2.51 0.00 0.00 175.55 171.94 3dgv n SER 199 N -0.96 0.00 -3.26 -0.18 3.41 -0.12 -4.87 113.62 107.64 3dgv n SER 199 Ca -0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.45 3dgv n SER 199 Cb 0.66 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.64 3dgv n SER 199 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dgv n GLN 200 N 0.00 -1.54 -3.99 4.33 6.02 -0.73 -4.80 117.38 116.67 3dgv n GLN 200 Ca 0.00 1.16 -0.10 0.00 -0.01 0.00 0.00 57.00 58.05 3dgv n GLN 200 Cb 0.00 -5.19 -0.11 0.00 1.02 0.00 0.00 30.24 25.96 3dgv n GLN 200 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3dgv s LYS 201 N -3.87 0.33 -0.28 -1.09 1.02 -0.92 -0.96 119.74 113.98 3dgv s LYS 201 Ca 0.16 -0.62 -0.06 0.00 0.02 0.00 0.00 55.97 55.47 3dgv s LYS 201 Cb -0.03 0.05 0.01 0.00 -0.52 0.00 0.00 37.83 37.34 3dgv s LYS 201 CO 0.78 -0.04 0.04 0.42 -0.92 0.00 0.00 175.35 175.64 3dgv s ILE 202 N -1.42 3.72 -0.01 2.17 1.01 0.13 -0.63 121.20 126.17 3dgv s ILE 202 Ca -0.15 -0.74 0.02 0.00 0.00 0.00 0.00 60.65 59.78 3dgv s ILE 202 Cb -0.10 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 3dgv s ILE 202 CO -0.01 0.13 -0.01 -0.69 0.00 0.00 0.00 174.94 174.36 3dgv s VAL 203 N 1.46 4.08 0.17 2.92 1.01 0.03 -2.46 120.40 127.61 3dgv s VAL 203 Ca 0.02 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.41 3dgv s VAL 203 Cb -0.17 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.36 3dgv s VAL 203 CO 0.01 0.39 0.00 0.72 0.00 0.00 0.00 175.10 176.22 3dgv s PHE 204 N -1.06 1.20 0.60 5.22 -0.12 -0.87 -0.89 117.98 122.07 3dgv s PHE 204 Ca 0.19 -1.02 -0.19 0.00 -0.05 0.00 0.00 56.93 55.85 3dgv s PHE 204 Cb -0.11 -0.68 -0.04 0.00 -0.63 0.00 0.00 43.02 41.55 3dgv s PHE 204 CO 0.09 -0.22 1.14 -2.30 -0.05 0.00 0.00 175.22 173.89 3dgv n PRO 205 N -0.24 1.12 -4.12 1.99 -0.02 -1.26 -1.29 135.00 131.18 3dgv n PRO 205 Ca -0.06 0.43 -0.28 0.00 -2.02 0.00 0.00 63.50 61.57 3dgv n PRO 205 Cb 0.63 -2.35 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 3dgv n PRO 205 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 3dgv s TYR 206 N -1.42 3.05 -0.09 6.00 2.02 -1.26 -4.40 117.35 121.25 3dgv s TYR 206 Ca 0.77 -0.03 0.17 0.00 -0.37 0.00 0.00 57.07 57.60 3dgv s TYR 206 Cb -0.41 -1.50 -0.25 0.00 -0.40 0.00 0.00 41.96 39.40 3dgv s TYR 206 CO 0.45 0.51 0.39 0.43 -1.57 0.00 0.00 175.55 175.77 3dgv n SER 207 N 0.00 1.17 -0.02 2.29 7.64 -1.26 -1.38 113.62 122.06 3dgv n SER 207 Ca -0.09 -0.08 0.14 0.00 1.01 0.00 0.00 58.87 59.86 3dgv n SER 207 Cb 0.54 1.69 0.70 0.00 -1.01 0.00 0.00 64.21 66.12 3dgv n SER 207 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dgv n TYR 208 N -2.01 0.00 -3.83 1.43 0.18 -1.26 -1.60 117.16 110.07 3dgv n TYR 208 Ca -0.02 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.69 3dgv n TYR 208 Cb 0.42 -0.31 -0.00 0.00 -0.38 0.00 0.00 39.34 39.06 3dgv n TYR 208 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 3dgv s SER 209 N -2.65 -0.15 0.00 9.48 1.04 -1.26 -4.71 113.70 115.45 3dgv s SER 209 Ca 0.25 -0.71 0.27 0.00 0.48 0.00 0.00 55.95 56.24 3dgv s SER 209 Cb 0.20 0.69 0.93 0.00 0.10 0.00 0.00 66.02 67.94 3dgv s SER 209 CO 0.48 -1.31 1.70 0.54 0.98 0.00 0.00 173.24 175.63 3dgv n ARG 210 N -0.50 0.18 -2.82 4.02 3.00 -1.26 -4.52 116.66 114.76 3dgv n ARG 210 Ca -0.05 -0.07 -0.33 0.00 -0.01 0.00 0.00 57.85 57.39 3dgv n ARG 210 Cb 0.60 -1.50 -0.06 0.00 0.00 0.00 0.00 32.46 31.50 3dgv n ARG 210 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 3dgv s SER 211 N -2.87 6.85 0.40 0.55 1.04 -1.26 -5.01 113.70 113.40 3dgv s SER 211 Ca 0.16 1.58 -0.24 0.00 0.48 0.00 0.00 55.95 57.93 3dgv s SER 211 Cb 0.19 -2.50 -0.09 0.00 0.10 0.00 0.00 66.02 63.72 3dgv s SER 211 CO 0.58 -0.37 1.05 -0.13 0.98 0.00 0.00 173.24 175.36 3dgv s ARG 212 N -3.30 4.16 0.55 4.02 1.81 -1.26 -4.53 118.95 120.40 3dgv s ARG 212 Ca 0.60 1.51 -0.16 0.00 -1.72 0.00 0.00 55.73 55.96 3dgv s ARG 212 Cb -0.09 -2.54 -0.06 0.00 -0.45 0.00 0.00 34.95 31.80 3dgv s ARG 212 CO 0.17 -0.14 1.01 -1.54 -0.68 0.00 0.00 175.30 174.12 3dgv s SER 213 N -1.57 6.36 0.25 0.23 1.04 -1.26 -4.96 113.70 113.79 3dgv s SER 213 Ca 0.58 1.63 -0.04 0.00 0.48 0.00 0.00 55.95 58.59 3dgv s SER 213 Cb -0.22 -2.51 0.47 0.00 0.10 0.00 0.00 66.02 63.86 3dgv s SER 213 CO 0.28 -0.77 1.72 0.50 0.98 0.00 0.00 173.24 175.94 3dgv h LYS 214 N 0.68 0.40 -0.85 4.02 3.64 -1.96 -2.06 116.57 120.43 3dgv h LYS 214 Ca -0.47 -0.02 -0.33 0.00 -1.27 0.00 0.00 60.65 58.56 3dgv h LYS 214 Cb 1.19 -0.09 -0.19 0.00 -0.41 0.00 0.00 32.23 32.73 3dgv h LYS 214 CO 0.60 0.26 0.41 -0.25 -2.27 0.00 0.00 179.45 178.21 3dgv n ASP 215 N -5.03 4.43 -0.14 4.20 8.00 -1.26 -4.65 116.55 122.10 3dgv n ASP 215 Ca 0.15 -3.34 -0.03 0.00 0.71 0.00 0.00 54.79 52.27 3dgv n ASP 215 Cb 0.44 -0.78 0.04 0.00 -0.02 0.00 0.00 41.12 40.80 3dgv n ASP 215 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 3dgv h HIS 216 N 2.03 -0.03 -0.14 1.24 -0.00 -1.71 -0.27 115.15 116.26 3dgv h HIS 216 Ca 0.40 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.80 3dgv h HIS 216 Cb 2.52 0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 30.01 3dgv h HIS 216 CO 1.39 -0.10 0.09 1.49 -0.00 0.00 0.00 177.93 180.80 3dgv h GLU 217 N 0.11 0.20 -0.31 5.26 4.81 -1.85 0.11 114.58 122.90 3dgv h GLU 217 Ca 0.22 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.28 3dgv h GLU 217 Cb 0.32 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3dgv h GLU 217 CO -0.37 0.17 -0.43 1.49 -0.73 0.00 0.00 179.01 179.14 3dgv h GLU 218 N 0.17 0.78 -0.86 1.92 4.81 -1.87 -2.12 114.58 117.41 3dgv h GLU 218 Ca 0.05 -0.42 -0.02 0.00 -0.13 0.00 0.00 59.36 58.84 3dgv h GLU 218 Cb 0.02 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 3dgv h GLU 218 CO -0.01 1.05 0.45 -0.07 -0.73 0.00 0.00 179.01 179.70 3dgv h LEU 219 N 0.63 1.09 -0.73 1.64 3.38 -0.70 -1.08 115.31 119.54 3dgv h LEU 219 Ca 0.04 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 3dgv h LEU 219 Cb 0.99 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 3dgv h LEU 219 CO 0.09 0.89 0.31 -1.28 0.09 0.00 0.00 178.44 178.55 3dgv h SER 220 N 1.21 0.99 -0.82 -0.43 0.87 -0.69 -1.89 113.55 112.79 3dgv h SER 220 Ca 0.30 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 3dgv h SER 220 Cb 0.06 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 61.73 3dgv h SER 220 CO -0.04 0.88 0.43 0.25 -0.53 0.00 0.00 176.83 177.81 3dgv h LEU 221 N 1.04 1.03 -0.72 2.23 7.12 -0.79 -1.46 115.31 123.76 3dgv h LEU 221 Ca 0.25 -0.11 -0.10 0.00 0.13 0.00 0.00 57.88 58.04 3dgv h LEU 221 Cb 0.18 -0.26 -0.02 0.00 -0.53 0.00 0.00 40.66 40.03 3dgv h LEU 221 CO -0.02 0.85 -0.14 0.58 -0.13 0.00 0.00 178.44 179.58 3dgv h VAL 222 N 1.14 1.26 -0.47 1.05 2.07 -1.00 -1.27 116.25 119.03 3dgv h VAL 222 Ca 0.29 -1.24 -0.13 0.00 0.82 0.00 0.00 66.70 66.44 3dgv h VAL 222 Cb 0.06 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3dgv h VAL 222 CO -0.04 0.42 -0.20 0.00 0.02 0.00 0.00 177.57 177.77 3dgv h ALA 223 N 1.09 0.66 0.00 1.67 0.00 -0.98 -1.16 119.26 120.54 3dgv h ALA 223 Ca 0.12 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.54 3dgv h ALA 223 Cb 0.65 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3dgv h ALA 223 CO 0.05 0.64 -0.49 0.07 0.00 0.00 0.00 179.25 179.52 3dgv h ARG 224 N 0.82 0.00 -0.77 0.00 0.11 -1.12 -1.48 114.38 111.94 3dgv h ARG 224 Ca 0.11 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.13 3dgv h ARG 224 Cb 0.78 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.83 3dgv h ARG 224 CO 0.06 0.49 0.26 0.93 0.10 0.00 0.00 179.97 181.81 3dgv h GLU 225 N 0.00 1.18 -0.11 0.08 5.08 -0.90 -1.57 114.58 118.34 3dgv h GLU 225 Ca -0.00 -0.24 -0.18 0.00 -1.00 0.00 0.00 59.36 57.93 3dgv h GLU 225 Cb 0.90 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.98 3dgv h GLU 225 CO 0.06 0.99 -0.63 0.00 -1.00 0.00 0.00 179.01 178.43 3dgv h ALA 226 N 1.14 0.22 -0.53 3.43 0.00 -0.89 -1.43 119.26 121.20 3dgv h ALA 226 Ca 0.25 -0.55 0.03 0.00 0.00 0.00 0.00 54.91 54.64 3dgv h ALA 226 Cb 0.28 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 3dgv h ALA 226 CO -0.01 0.49 0.31 0.28 0.00 0.00 0.00 179.25 180.32 3dgv h VAL 227 N 0.26 1.03 -0.80 0.00 2.07 -1.31 -1.45 116.25 116.04 3dgv h VAL 227 Ca -0.05 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.30 3dgv h VAL 227 Cb 1.27 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 3dgv h VAL 227 CO 0.13 0.11 0.51 0.15 0.02 0.00 0.00 177.57 178.49 3dgv h PHE 228 N 0.60 0.96 -0.29 1.57 3.57 -1.07 0.47 116.94 122.75 3dgv h PHE 228 Ca 0.22 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 3dgv h PHE 228 Cb 0.06 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 3dgv h PHE 228 CO -0.07 0.55 -0.06 0.00 -2.23 0.00 0.00 178.31 176.50 3dgv h ALA 229 N 1.34 1.35 -0.21 2.41 0.00 -0.90 -2.82 119.26 120.43 3dgv h ALA 229 Ca 0.32 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3dgv h ALA 229 Cb 0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3dgv h ALA 229 CO -0.11 0.44 -0.12 0.52 0.00 0.00 0.00 179.25 179.98 3dgv h MET 230 N 0.44 0.44 -0.79 0.00 2.86 0.09 -2.88 114.93 115.10 3dgv h MET 230 Ca 0.09 -0.20 0.20 0.00 -2.06 0.00 0.00 59.70 57.73 3dgv h MET 230 Cb 0.39 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.00 3dgv h MET 230 CO 0.02 0.74 0.54 0.93 1.06 0.00 0.00 176.91 180.20 3dgv h GLU 231 N 0.14 0.20 0.00 1.72 5.08 -0.91 -0.94 114.58 119.86 3dgv h GLU 231 Ca 0.04 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3dgv h GLU 231 Cb 0.62 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3dgv h GLU 231 CO 0.03 0.13 -0.17 -0.97 -1.00 0.00 0.00 179.01 177.03 3dgv h ASN 232 N 0.20 0.00 0.00 1.42 -1.24 -1.27 -2.53 115.58 112.16 3dgv h ASN 232 Ca 0.39 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.38 3dgv h ASN 232 Cb 1.22 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.27 3dgv h ASN 232 CO -0.08 0.17 -1.99 2.30 -1.29 0.00 0.00 177.43 176.54 3dgv n ILE 233 N -3.51 0.09 -3.58 2.57 -5.35 -0.41 -4.71 119.36 104.46 3dgv n ILE 233 Ca -0.01 -0.51 -0.29 0.00 -0.27 0.00 0.00 62.75 61.67 3dgv n ILE 233 Cb 0.33 -0.02 -0.13 0.00 -1.74 0.00 0.00 39.64 38.08 3dgv n ILE 233 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 3dgv s HIS 234 N -3.41 1.07 0.48 4.28 3.76 -0.87 -5.02 115.29 115.58 3dgv s HIS 234 Ca -0.08 -1.65 0.40 0.00 -0.15 0.00 0.00 55.06 53.58 3dgv s HIS 234 Cb 0.13 -1.26 2.05 0.00 1.11 0.00 0.00 32.58 34.61 3dgv s HIS 234 CO 0.88 -0.83 2.24 0.00 -0.85 0.00 0.00 174.74 176.18 3dgv h ARG 235 N 7.45 0.00 0.00 1.40 -0.00 -1.74 -1.02 114.38 120.47 3dgv h ARG 235 Ca -0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.43 3dgv h ARG 235 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.95 3dgv h ARG 235 CO 0.38 0.01 -0.36 -0.91 0.00 0.00 0.00 179.97 179.10 3dgv h ASN 235 N 0.00 0.00 -3.59 7.04 2.35 -1.96 -3.47 115.58 115.95 3dgv h ASN 235 Ca -0.00 -0.07 -0.51 0.00 -0.55 0.00 0.00 56.30 55.17 3dgv h ASN 235 Cb 0.18 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 3dgv h ASN 235 CO 0.00 0.03 0.39 -0.51 -1.65 0.00 0.00 177.43 175.69 3dgv s ILE 236 N -3.19 4.29 -0.19 2.81 1.10 -0.39 -5.04 121.20 120.60 3dgv s ILE 236 Ca 0.07 1.96 0.01 0.00 -0.51 0.00 0.00 60.65 62.18 3dgv s ILE 236 Cb 0.11 -4.25 0.03 0.00 0.15 0.00 0.00 42.46 38.49 3dgv s ILE 236 CO 0.68 0.33 -0.17 -0.60 -2.11 0.00 0.00 174.94 173.07 3dgv s ARG 237 N -0.24 2.71 0.05 3.50 6.06 -1.26 -4.72 118.95 125.04 3dgv s ARG 237 Ca 0.47 -0.89 0.04 0.00 -2.50 0.00 0.00 55.73 52.85 3dgv s ARG 237 Cb -0.25 -2.56 -0.04 0.00 0.06 0.00 0.00 34.95 32.16 3dgv s ARG 237 CO 0.31 -0.29 -0.03 0.71 -2.50 0.00 0.00 175.30 173.50 3dgv s TYR 238 N 1.29 2.96 0.55 5.12 1.51 -1.26 -4.89 117.35 122.62 3dgv s TYR 238 Ca 0.02 -0.02 0.06 0.00 -1.01 0.00 0.00 57.07 56.12 3dgv s TYR 238 Cb -0.14 -1.58 0.05 0.00 -0.11 0.00 0.00 41.96 40.17 3dgv s TYR 238 CO -0.11 0.44 0.45 0.95 -1.11 0.00 0.00 175.55 176.17 3dgv s THR 239 N -1.16 1.67 -0.07 -0.71 -4.23 -0.13 -4.97 115.64 106.04 3dgv s THR 239 Ca 0.22 -1.44 -0.31 0.00 -1.18 0.00 0.00 61.69 58.98 3dgv s THR 239 Cb -0.11 -2.12 0.08 0.00 1.34 0.00 0.00 72.50 71.68 3dgv s THR 239 CO 0.13 0.00 0.71 -1.38 -0.54 0.00 0.00 174.62 173.55 3dgv s HIS 240 N -2.77 -0.64 -3.69 3.99 -3.43 -1.26 -0.69 115.29 106.80 3dgv s HIS 240 Ca 0.36 1.12 0.00 0.00 -0.80 0.00 0.00 55.06 55.74 3dgv s HIS 240 Cb -0.03 0.41 0.00 0.00 -1.43 0.00 0.00 32.58 31.53 3dgv s HIS 240 CO 0.23 -0.57 0.00 0.41 -2.00 0.00 0.00 174.74 172.81 3dgv n GLY 241 N 0.99 -2.30 3.82 -1.38 0.00 -1.03 -4.96 105.19 100.32 3dgv n GLY 241 Ca -0.18 -1.23 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 3dgv n GLY 241 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dgv s SER 242 N -0.61 5.20 0.36 1.61 1.04 -1.26 -2.05 113.70 117.99 3dgv s SER 242 Ca 0.00 1.57 0.04 0.00 0.48 0.00 0.00 55.95 58.03 3dgv s SER 242 Cb 0.00 -2.41 0.69 0.00 0.10 0.00 0.00 66.02 64.40 3dgv s SER 242 CO 0.00 -1.56 2.02 1.23 0.98 0.00 0.00 173.24 175.91 3dgv h GLY 243 N -0.80 0.83 0.51 7.32 0.00 -0.68 -1.57 103.07 108.68 3dgv h GLY 243 Ca -0.44 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.58 3dgv h GLY 243 CO 0.57 0.29 0.00 -1.14 0.00 0.00 0.00 176.54 176.26 3dgv n SER 244 N -4.45 0.00 0.19 0.19 3.41 -0.48 -2.40 113.62 110.08 3dgv n SER 244 Ca 0.06 -1.19 0.04 0.00 -0.26 0.00 0.00 58.87 57.53 3dgv n SER 244 Cb 0.06 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.40 3dgv n SER 244 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 3dgv h GLU 245 N 0.00 0.00 -7.17 4.33 4.11 -1.59 -3.46 114.58 110.80 3dgv h GLU 245 Ca 0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.36 58.96 3dgv h GLU 245 Cb 0.00 0.00 0.21 0.00 0.50 0.00 0.00 28.75 29.46 3dgv h GLU 245 CO 0.00 0.36 0.06 0.43 0.07 0.00 0.00 179.01 179.93 3dgv n SER 246 N -3.90 -1.04 0.02 3.06 7.64 -1.01 -4.94 113.62 113.45 3dgv n SER 246 Ca -0.01 0.03 -0.11 0.00 1.01 0.00 0.00 58.87 59.79 3dgv n SER 246 Cb 0.42 -1.33 -0.05 0.00 -1.01 0.00 0.00 64.21 62.24 3dgv n SER 246 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3dgv h LEU 247 N -2.44 -0.17 -9.49 -3.43 4.07 -1.90 -3.44 115.31 98.50 3dgv h LEU 247 Ca -0.55 0.03 -0.57 0.00 0.08 0.00 0.00 57.88 56.87 3dgv h LEU 247 Cb 1.31 0.09 -0.11 0.00 1.08 0.00 0.00 40.66 43.03 3dgv h LEU 247 CO 0.46 -0.08 -0.66 -0.72 -1.08 0.00 0.00 178.44 176.36 3dgv s TYR 248 N -6.18 2.57 0.86 1.13 1.13 -1.26 -5.14 117.35 110.46 3dgv s TYR 248 Ca -0.14 -0.29 -0.13 0.00 -1.41 0.00 0.00 57.07 55.10 3dgv s TYR 248 Cb 0.08 -1.22 0.12 0.00 -1.10 0.00 0.00 41.96 39.84 3dgv s TYR 248 CO 0.67 0.61 1.23 -0.51 -2.51 0.00 0.00 175.55 175.03 3dgv s LEU 249 N -3.65 2.57 -0.48 -3.49 1.43 -1.26 -4.89 118.68 108.91 3dgv s LEU 249 Ca 0.32 0.60 0.06 0.00 -1.03 0.00 0.00 54.13 54.08 3dgv s LEU 249 Cb -0.05 -2.93 0.20 0.00 0.03 0.00 0.00 46.19 43.44 3dgv s LEU 249 CO 0.19 -2.21 0.65 0.00 0.23 0.00 0.00 176.35 175.21 3dgv n ALA 250 N -3.48 -0.46 -1.75 4.21 0.00 -0.63 -4.43 120.51 113.97 3dgv n ALA 250 Ca 0.11 -1.70 -0.34 0.00 0.00 0.00 0.00 53.44 51.51 3dgv n ALA 250 Cb 0.60 -1.26 -0.01 0.00 0.00 0.00 0.00 19.45 18.78 3dgv n ALA 250 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3dgv s PRO 251 N 0.54 3.57 0.00 0.00 0.04 -1.26 -4.15 135.00 133.74 3dgv s PRO 251 Ca 0.31 1.35 0.00 0.00 0.04 0.00 0.00 61.00 62.71 3dgv s PRO 251 Cb 0.05 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.53 3dgv s PRO 251 CO -0.12 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 176.71 3dgv n GLY 252 N -0.41 1.08 3.81 0.56 0.00 -1.26 -4.58 105.19 104.40 3dgv n GLY 252 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 3dgv n GLY 252 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dgv s GLY 253 N -2.00 2.61 0.15 -0.02 0.00 -1.20 -0.57 107.32 106.29 3dgv s GLY 253 Ca 0.00 0.21 -0.12 0.00 0.00 0.00 0.00 44.72 44.81 3dgv s GLY 253 CO 0.00 0.56 1.61 1.48 0.00 0.00 0.00 173.10 176.75 3dgv h SER 254 N 3.22 0.83 -0.32 1.64 4.64 -1.91 -1.05 113.55 120.60 3dgv h SER 254 Ca -0.48 -0.29 -0.03 0.00 -0.47 0.00 0.00 61.79 60.52 3dgv h SER 254 Cb 1.19 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 3dgv h SER 254 CO 0.65 0.92 0.11 -2.24 -0.87 0.00 0.00 176.83 175.40 3dgv h ASP 255 N 0.72 0.52 -0.13 4.97 2.03 -1.94 0.15 116.42 122.75 3dgv h ASP 255 Ca 0.14 -0.07 -0.09 0.00 -0.73 0.00 0.00 57.03 56.28 3dgv h ASP 255 Cb 0.48 -0.13 0.00 0.00 -0.83 0.00 0.00 39.33 38.84 3dgv h ASP 255 CO 0.02 0.52 -0.28 0.44 -1.03 0.00 0.00 179.24 178.91 3dgv h ASP 256 N 0.56 0.47 -0.36 4.15 3.32 -1.92 -2.63 116.42 120.01 3dgv h ASP 256 Ca 0.13 -0.57 0.04 0.00 0.02 0.00 0.00 57.03 56.65 3dgv h ASP 256 Cb 0.20 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.58 3dgv h ASP 256 CO -0.01 0.95 0.14 -0.25 -1.72 0.00 0.00 179.24 178.35 3dgv h TRP 257 N 0.00 0.25 0.00 4.55 7.01 -0.44 -1.79 115.95 125.52 3dgv h TRP 257 Ca 0.00 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 60.96 3dgv h TRP 257 Cb 0.88 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.87 3dgv h TRP 257 CO 0.10 0.11 -0.30 0.97 -2.79 0.00 0.00 178.44 176.53 3dgv h ILE 258 N 0.30 0.67 -0.09 2.65 6.09 -0.81 -2.66 117.51 123.65 3dgv h ILE 258 Ca 0.16 -1.41 -0.21 0.00 -1.37 0.00 0.00 64.86 62.04 3dgv h ILE 258 Cb 0.12 1.93 0.00 0.00 0.47 0.00 0.00 36.82 39.35 3dgv h ILE 258 CO -0.15 0.30 -0.79 0.22 -3.07 0.00 0.00 178.15 174.65 3dgv h TYR 259 N 0.00 0.76 -0.00 2.19 3.20 -1.04 -1.91 116.97 120.17 3dgv h TYR 259 Ca -0.00 -0.35 0.00 0.00 3.14 0.00 0.00 58.73 61.52 3dgv h TYR 259 Cb 0.91 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.06 3dgv h TYR 259 CO 0.00 1.15 -0.03 -0.25 -1.64 0.00 0.00 178.16 177.39 3dgv n ASP 260 N -3.86 0.38 -0.15 -2.11 8.00 -0.72 -2.09 116.55 116.00 3dgv n ASP 260 Ca -0.06 -0.87 0.11 0.00 0.71 0.00 0.00 54.79 54.68 3dgv n ASP 260 Cb 0.75 -0.05 0.08 0.00 -0.02 0.00 0.00 41.12 41.88 3dgv n ASP 260 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3dgv n LEU 261 N -0.82 1.11 0.00 0.64 7.94 -1.02 -4.95 117.00 119.89 3dgv n LEU 261 Ca 0.20 -0.39 0.00 0.00 -1.11 0.00 0.00 56.01 54.70 3dgv n LEU 261 Cb 0.21 -0.08 0.00 0.00 0.53 0.00 0.00 43.42 44.08 3dgv n LEU 261 CO 0.20 0.24 0.00 0.61 -1.11 0.00 0.00 177.39 177.33 3dgv n GLY 262 N 1.46 1.08 3.50 -3.96 0.00 -0.89 -5.06 105.19 101.32 3dgv n GLY 262 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3dgv n GLY 262 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dgv s ILE 263 N -1.86 4.03 0.18 -0.61 -1.09 -0.74 -4.91 121.20 116.19 3dgv s ILE 263 Ca 0.00 0.01 -0.11 0.00 -2.23 0.00 0.00 60.65 58.32 3dgv s ILE 263 Cb 0.00 -4.80 0.08 0.00 -1.58 0.00 0.00 42.46 36.16 3dgv s ILE 263 CO 0.00 -1.65 1.71 0.50 -1.23 0.00 0.00 174.94 174.27 3dgv h LYS 264 N 9.79 0.95 -4.66 2.79 3.64 -1.84 -3.37 116.57 123.88 3dgv h LYS 264 Ca -0.28 -0.20 -0.73 0.00 -1.27 0.00 0.00 60.65 58.17 3dgv h LYS 264 Cb 1.06 -0.14 -0.20 0.00 -0.41 0.00 0.00 32.23 32.54 3dgv h LYS 264 CO 1.23 0.83 0.86 0.71 -2.27 0.00 0.00 179.45 180.81 3dgv s TYR 265 N -5.44 3.42 -0.11 1.91 2.02 -1.25 -4.96 117.35 112.93 3dgv s TYR 265 Ca -0.13 -1.80 -0.00 0.00 -0.37 0.00 0.00 57.07 54.77 3dgv s TYR 265 Cb 0.13 -4.19 0.02 0.00 -0.40 0.00 0.00 41.96 37.52 3dgv s TYR 265 CO 0.81 -1.35 -0.08 0.45 -1.57 0.00 0.00 175.55 173.81 3dgv s SER 266 N 3.00 2.18 0.05 2.29 0.15 -1.26 -0.72 113.70 119.39 3dgv s SER 266 Ca 0.33 -0.31 0.01 0.00 0.70 0.00 0.00 55.95 56.69 3dgv s SER 266 Cb -0.05 -0.85 -0.03 0.00 -1.71 0.00 0.00 66.02 63.37 3dgv s SER 266 CO -0.06 -0.11 -0.06 -0.36 1.20 0.00 0.00 173.24 173.85 3dgv s PHE 267 N 1.64 0.61 -0.12 3.44 0.08 0.54 -4.22 117.98 119.96 3dgv s PHE 267 Ca 0.04 -0.64 -0.02 0.00 0.12 0.00 0.00 56.93 56.42 3dgv s PHE 267 Cb -0.13 -0.38 -0.03 0.00 -0.57 0.00 0.00 43.02 41.91 3dgv s PHE 267 CO -0.08 -0.15 -0.03 0.99 -0.10 0.00 0.00 175.22 175.85 3dgv s THR 268 N -2.09 3.98 -0.28 0.64 2.01 -0.07 -1.11 115.64 118.72 3dgv s THR 268 Ca -0.05 -0.35 -0.10 0.00 0.31 0.00 0.00 61.69 61.50 3dgv s THR 268 Cb -0.05 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 3dgv s THR 268 CO -0.02 0.54 0.16 -0.36 -0.69 0.00 0.00 174.62 174.25 3dgv s PHE 269 N -0.20 3.18 -0.46 4.92 0.40 -0.49 -0.79 117.98 124.54 3dgv s PHE 269 Ca 0.04 -0.19 -0.22 0.00 -0.60 0.00 0.00 56.93 55.96 3dgv s PHE 269 Cb -0.13 -2.35 0.03 0.00 0.51 0.00 0.00 43.02 41.09 3dgv s PHE 269 CO 0.02 -0.29 0.71 -1.21 0.70 0.00 0.00 175.22 175.16 3dgv s GLU 270 N 1.69 3.31 0.32 0.44 0.41 0.19 0.78 118.70 125.84 3dgv s GLU 270 Ca 0.06 -0.33 -0.06 0.00 -0.41 0.00 0.00 54.97 54.24 3dgv s GLU 270 Cb -0.16 -3.97 0.08 0.00 -1.78 0.00 0.00 34.13 28.30 3dgv s GLU 270 CO 0.08 -1.10 0.39 1.28 -0.49 0.00 0.00 175.26 175.42 3dgv n LEU 271 N 6.50 0.00 -4.71 1.80 4.77 0.61 -1.78 117.00 124.19 3dgv n LEU 271 Ca -0.01 -0.42 -0.32 0.00 -0.03 0.00 0.00 56.01 55.23 3dgv n LEU 271 Cb 0.48 -0.31 0.13 0.00 -2.33 0.00 0.00 43.42 41.39 3dgv n LEU 271 CO 0.56 -0.96 0.71 -0.13 -1.33 0.00 0.00 177.39 176.24 3dgv s ARG 272 N -3.86 1.55 0.00 3.23 0.52 -1.26 -1.46 118.95 117.67 3dgv s ARG 272 Ca 0.23 1.50 0.00 0.00 -0.52 0.00 0.00 55.73 56.93 3dgv s ARG 272 Cb -0.01 -1.79 0.00 0.00 0.52 0.00 0.00 34.95 33.67 3dgv s ARG 272 CO 0.16 -2.23 0.00 -0.40 0.02 0.00 0.00 175.30 172.86 3dgv n ASP 273 N -3.76 0.00 -0.29 0.23 5.68 -1.26 -4.62 116.55 112.54 3dgv n ASP 273 Ca 0.11 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.52 3dgv n ASP 273 Cb 0.52 0.00 0.19 0.00 -1.14 0.00 0.00 41.12 40.69 3dgv n ASP 273 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3dgv n LYS 274 N 0.00 0.83 0.00 0.11 4.76 -1.26 -0.94 118.16 121.65 3dgv n LYS 274 Ca 0.00 -0.59 0.00 0.00 -2.87 0.00 0.00 58.31 54.85 3dgv n LYS 274 Cb 0.00 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 3dgv n LYS 274 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dgv n GLY 275 N 1.40 0.30 0.24 0.72 0.00 -1.26 -4.89 105.19 101.70 3dgv n GLY 275 Ca 0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.96 3dgv n GLY 275 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3dgv h LYS 276 N 0.00 -0.53 0.00 1.61 3.64 -1.91 -3.32 116.57 116.06 3dgv h LYS 276 Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3dgv h LYS 276 Cb 0.00 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3dgv h LYS 276 CO 0.00 -0.34 -0.91 0.66 -2.27 0.00 0.00 179.45 176.60 3dgv n TYR 277 N -5.31 0.00 0.00 1.91 4.01 -1.26 -4.39 117.16 112.11 3dgv n TYR 277 Ca -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 3dgv n TYR 277 Cb 0.24 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 3dgv n TYR 277 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dgv n GLY 278 N 1.41 3.32 0.24 2.72 0.00 -1.25 -0.49 105.19 111.14 3dgv n GLY 278 Ca 0.02 0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.27 3dgv n GLY 278 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3dgv h PHE 279 N 0.00 0.00 -1.59 1.61 0.04 -1.92 -3.35 116.94 111.74 3dgv h PHE 279 Ca 0.00 0.00 -0.76 0.00 2.80 0.00 0.00 57.97 60.01 3dgv h PHE 279 Cb 0.00 0.00 -0.19 0.00 2.20 0.00 0.00 35.95 37.96 3dgv h PHE 279 CO 0.00 0.00 1.75 1.28 -0.60 0.00 0.00 178.31 180.74 3dgv n LEU 280 N -2.94 7.70 -4.66 1.54 4.32 0.36 -4.55 117.00 118.77 3dgv n LEU 280 Ca 0.02 -5.03 -0.42 0.00 -0.02 0.00 0.00 56.01 50.55 3dgv n LEU 280 Cb 0.34 -1.27 -0.03 0.00 -1.62 0.00 0.00 43.42 40.84 3dgv n LEU 280 CO 0.28 2.03 0.78 -0.22 -1.22 0.00 0.00 177.39 179.04 3dgv s LEU 281 N -3.03 4.14 0.63 2.23 2.96 -1.26 -4.80 118.68 119.56 3dgv s LEU 281 Ca 0.49 1.31 -0.18 0.00 -0.22 0.00 0.00 54.13 55.53 3dgv s LEU 281 Cb 0.21 -3.42 -0.04 0.00 0.50 0.00 0.00 46.19 43.44 3dgv s LEU 281 CO -0.13 -0.54 0.91 -2.65 -1.32 0.00 0.00 176.35 172.63 3dgv n PRO 282 N 5.77 0.76 0.28 0.98 -0.02 -1.26 -4.88 135.00 136.63 3dgv n PRO 282 Ca 0.09 0.30 0.14 0.00 -2.02 0.00 0.00 63.50 62.01 3dgv n PRO 282 Cb 0.47 -2.13 0.80 0.00 -0.02 0.00 0.00 33.50 32.62 3dgv n PRO 282 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3dgv h GLU 283 N 0.27 0.00 0.00 -0.52 5.08 -1.94 -1.49 114.58 115.98 3dgv h GLU 283 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 3dgv h GLU 283 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 3dgv h GLU 283 CO 0.49 0.08 0.00 0.66 -1.00 0.00 0.00 179.01 179.24 3dgv h SER 284 N 0.00 0.00 0.17 1.42 4.64 -1.90 -1.96 113.55 115.92 3dgv h SER 284 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dgv h SER 284 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3dgv h SER 284 CO 0.01 0.00 -0.27 -1.22 -0.87 0.00 0.00 176.83 174.48 3dgv n TYR 285 N -3.08 0.00 -0.11 4.77 4.01 -0.56 -4.30 117.16 117.89 3dgv n TYR 285 Ca -0.02 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.63 3dgv n TYR 285 Cb 0.14 -0.09 -0.02 0.00 -0.31 0.00 0.00 39.34 39.06 3dgv n TYR 285 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 3dgv h ILE 286 N 1.56 1.17 0.38 -0.72 2.04 -1.48 -2.33 117.51 118.14 3dgv h ILE 286 Ca 0.00 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 3dgv h ILE 286 Cb 0.56 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 3dgv h ILE 286 CO 0.00 0.18 -0.18 -0.09 0.00 0.00 0.00 178.15 178.06 3dgv h ARG 287 N 0.40 -0.50 -0.82 2.37 2.43 -1.77 -0.65 114.38 115.85 3dgv h ARG 287 Ca 0.11 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.36 3dgv h ARG 287 Cb 0.15 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.77 3dgv h ARG 287 CO -0.01 -0.19 0.54 -1.00 -1.51 0.00 0.00 179.97 177.79 3dgv h PRO 288 N -0.82 0.94 -0.32 0.20 0.13 -1.80 0.50 132.00 130.83 3dgv h PRO 288 Ca -0.05 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 64.98 3dgv h PRO 288 Cb 0.54 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 3dgv h PRO 288 CO 0.09 0.62 0.05 1.15 -0.23 0.00 0.00 178.00 179.67 3dgv h THR 289 N 0.96 1.24 0.08 1.56 2.02 -1.30 -2.81 112.91 114.67 3dgv h THR 289 Ca 0.33 -0.83 -0.25 0.00 0.77 0.00 0.00 66.41 66.43 3dgv h THR 289 Cb 0.11 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 3dgv h THR 289 CO -0.11 0.27 -1.13 0.00 0.37 0.00 0.00 175.52 174.93 3dgv h SER 291 N 0.13 -1.00 -0.28 0.00 0.02 -0.94 0.85 113.55 112.33 3dgv h SER 291 Ca -0.11 0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 3dgv h SER 291 Cb 1.82 0.44 -0.01 0.00 0.14 0.00 0.00 62.40 64.79 3dgv h SER 291 CO 0.19 -0.34 -0.07 1.05 -1.14 0.00 0.00 176.83 176.52 3dgv h GLU 292 N -0.36 0.54 -0.69 3.45 4.11 -1.51 -2.77 114.58 117.36 3dgv h GLU 292 Ca 0.11 -0.21 0.06 0.00 0.07 0.00 0.00 59.36 59.40 3dgv h GLU 292 Cb 0.54 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 3dgv h GLU 292 CO -0.39 0.74 0.46 0.00 0.07 0.00 0.00 179.01 179.89 3dgv h ALA 293 N 0.78 1.72 -0.56 1.06 0.00 -1.28 -1.63 119.26 119.35 3dgv h ALA 293 Ca 0.07 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3dgv h ALA 293 Cb 0.54 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3dgv h ALA 293 CO 0.03 0.17 0.08 1.25 0.00 0.00 0.00 179.25 180.78 3dgv h LEU 294 N 0.72 0.90 -0.82 0.00 5.85 -0.56 -1.41 115.31 119.99 3dgv h LEU 294 Ca 0.30 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 3dgv h LEU 294 Cb 0.25 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3dgv h LEU 294 CO -0.09 0.94 -0.27 -0.37 -0.34 0.00 0.00 178.44 178.31 3dgv h VAL 295 N 0.83 0.58 -0.19 1.05 -1.51 -1.09 -1.51 116.25 114.40 3dgv h VAL 295 Ca 0.17 -1.34 -0.13 0.00 -1.23 0.00 0.00 66.70 64.17 3dgv h VAL 295 Cb 0.43 1.91 -0.01 0.00 -2.13 0.00 0.00 31.29 31.49 3dgv h VAL 295 CO 0.01 0.26 -0.44 0.00 -1.23 0.00 0.00 177.57 176.18 3dgv h ALA 296 N 1.73 0.88 -0.21 5.19 0.00 -0.99 -1.29 119.26 124.58 3dgv h ALA 296 Ca -0.00 -0.45 -0.14 0.00 0.00 0.00 0.00 54.91 54.32 3dgv h ALA 296 Cb 0.89 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3dgv h ALA 296 CO 0.03 0.65 -0.42 0.28 0.00 0.00 0.00 179.25 179.79 3dgv h VAL 297 N 0.38 1.32 -0.93 0.00 2.07 -0.86 -2.04 116.25 116.20 3dgv h VAL 297 Ca 0.03 -1.64 -0.01 0.00 0.82 0.00 0.00 66.70 65.90 3dgv h VAL 297 Cb 0.92 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 3dgv h VAL 297 CO 0.08 0.51 0.56 0.00 0.02 0.00 0.00 177.57 178.74 3dgv h ALA 298 N 0.61 1.23 -0.06 1.67 0.00 -1.22 0.50 119.26 121.99 3dgv h ALA 298 Ca 0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3dgv h ALA 298 Cb 1.02 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3dgv h ALA 298 CO 0.09 0.66 0.02 -0.22 0.00 0.00 0.00 179.25 179.80 3dgv h LYS 299 N 1.28 0.10 -0.39 0.00 1.63 -1.14 -0.46 116.57 117.58 3dgv h LYS 299 Ca 0.33 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.11 3dgv h LYS 299 Cb -0.05 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.55 3dgv h LYS 299 CO -0.06 0.26 0.26 0.82 -3.45 0.00 0.00 179.45 177.27 3dgv h ILE 300 N -0.09 1.11 -0.68 2.00 2.04 -1.14 -1.75 117.51 119.00 3dgv h ILE 300 Ca 0.02 -0.22 0.03 0.00 1.00 0.00 0.00 64.86 65.69 3dgv h ILE 300 Cb 0.20 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 3dgv h ILE 300 CO -0.00 0.11 0.43 0.00 0.00 0.00 0.00 178.15 178.69 3dgv h ALA 301 N 1.13 0.88 0.00 1.87 0.00 -0.67 -0.20 119.26 122.29 3dgv h ALA 301 Ca 0.14 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 3dgv h ALA 301 Cb -0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3dgv h ALA 301 CO -0.03 0.21 -0.46 0.66 0.00 0.00 0.00 179.25 179.63 3dgv h SER 302 N 0.85 0.00 -0.42 0.00 4.64 -0.80 -1.53 113.55 116.29 3dgv h SER 302 Ca 0.27 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.45 3dgv h SER 302 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3dgv h SER 302 CO -0.10 0.46 -0.30 -0.74 -0.87 0.00 0.00 176.83 175.28 3dgv h HIS 303 N 0.00 1.12 -0.13 4.77 6.17 -0.42 -3.23 115.15 123.43 3dgv h HIS 303 Ca -0.00 -0.30 -0.00 0.00 0.71 0.00 0.00 60.37 60.77 3dgv h HIS 303 Cb 0.86 -0.25 -0.01 0.00 2.52 0.00 0.00 27.41 30.54 3dgv h HIS 303 CO 0.00 1.12 0.08 0.28 0.71 0.00 0.00 177.93 180.12 3dgv h VAL 304 N 0.80 1.06 0.00 5.26 2.07 -0.12 -2.99 116.25 122.33 3dgv h VAL 304 Ca 0.09 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 3dgv h VAL 304 Cb 0.88 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 31.59 3dgv h VAL 304 CO 0.08 0.06 -0.04 -0.37 0.02 0.00 0.00 177.57 177.32 3dgv h VAL 305 N 0.14 0.14 -0.56 2.57 -1.51 -1.37 -0.77 116.25 114.90 3dgv h VAL 305 Ca 0.05 -0.44 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 3dgv h VAL 305 Cb 0.03 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 30.56 3dgv h VAL 305 CO -0.01 0.04 0.00 2.29 -1.23 0.00 0.00 177.57 178.66 3dgv n LYS 306 N -3.21 4.71 0.00 5.19 2.85 -1.14 -4.29 118.16 122.27 3dgv n LYS 306 Ca -0.01 -3.13 0.00 0.00 -1.05 0.00 0.00 58.31 54.12 3dgv n LYS 306 Cb 0.25 -2.22 0.00 0.00 -0.65 0.00 0.00 35.03 32.41 3dgv n LYS 306 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3dgv n ASN 307 N 0.59 0.00 -0.46 -5.58 4.13 -0.41 -5.08 115.26 108.45 3dgv n ASN 307 Ca 0.27 -1.00 0.06 0.00 1.68 0.00 0.00 54.58 55.59 3dgv n ASN 307 Cb 1.16 0.00 0.05 0.00 -1.54 0.00 0.00 39.78 39.45 3dgv n ASN 307 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09