#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 2.04 0.03 -1.08 -0.21 -1.26 -4.93 119.66 114.25 3dgv s GLN 2 Ca 0.00 1.87 0.00 0.00 0.02 0.00 0.00 55.36 57.26 3dgv s GLN 2 Cb 0.00 -1.81 -0.02 0.00 1.00 0.00 0.00 33.01 32.18 3dgv s GLN 2 CO 0.00 -1.94 -0.04 -0.98 -2.12 0.00 0.00 175.29 170.21 3dgv s ARG 3 N -3.82 0.40 0.00 2.91 1.70 -1.26 -3.49 118.95 115.38 3dgv s ARG 3 Ca 0.77 -0.72 0.00 0.00 -0.47 0.00 0.00 55.73 55.31 3dgv s ARG 3 Cb -0.32 0.02 0.00 0.00 -0.57 0.00 0.00 34.95 34.08 3dgv s ARG 3 CO 0.46 -0.03 0.00 0.41 -1.08 0.00 0.00 175.30 175.05 3dgv n GLY 4 N 1.39 -0.03 3.30 3.88 0.00 -1.26 -1.18 105.19 111.30 3dgv n GLY 4 Ca -0.23 -1.32 -0.16 0.00 0.00 0.00 0.00 46.02 44.31 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 1.21 -0.12 1.61 -0.21 -0.89 -1.65 119.66 117.62 3dgv s GLN 5 Ca 0.00 -1.55 -0.02 0.00 0.02 0.00 0.00 55.36 53.81 3dgv s GLN 5 Cb 0.00 -0.78 -0.03 0.00 1.00 0.00 0.00 33.01 33.20 3dgv s GLN 5 CO 0.00 0.07 -0.02 0.08 -2.12 0.00 0.00 175.29 173.29 3dgv s VAL 6 N -3.24 4.05 0.19 1.09 1.01 -0.61 -0.88 120.40 122.01 3dgv s VAL 6 Ca 0.21 -0.32 0.10 0.00 0.00 0.00 0.00 61.98 61.96 3dgv s VAL 6 Cb 0.02 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3dgv s VAL 6 CO 0.04 0.55 -0.20 -0.76 0.00 0.00 0.00 175.10 174.74 3dgv s LEU 7 N -0.27 2.46 -0.05 3.92 1.43 -0.46 -0.74 118.68 124.97 3dgv s LEU 7 Ca 0.05 -0.89 0.05 0.00 -1.03 0.00 0.00 54.13 52.31 3dgv s LEU 7 Cb -0.12 -0.93 -0.02 0.00 0.03 0.00 0.00 46.19 45.15 3dgv s LEU 7 CO 0.02 0.00 -0.20 -0.55 0.23 0.00 0.00 176.35 175.86 3dgv s SER 8 N -2.81 3.55 -0.04 2.29 0.15 0.88 -1.67 113.70 116.06 3dgv s SER 8 Ca 0.19 -0.36 0.03 0.00 0.70 0.00 0.00 55.95 56.51 3dgv s SER 8 Cb -0.06 -0.82 0.01 0.00 -1.71 0.00 0.00 66.02 63.44 3dgv s SER 8 CO 0.08 0.29 -0.11 0.00 1.20 0.00 0.00 173.24 174.71 3dgv s ALA 9 N -0.43 1.04 -0.51 5.45 0.00 -0.43 0.02 121.76 126.89 3dgv s ALA 9 Ca 0.05 -0.39 -0.07 0.00 0.00 0.00 0.00 51.96 51.54 3dgv s ALA 9 Cb -0.12 -0.40 0.13 0.00 0.00 0.00 0.00 23.12 22.73 3dgv s ALA 9 CO 0.02 0.15 0.37 -1.17 0.00 0.00 0.00 175.76 175.12 3dgv s LEU 10 N 0.30 5.62 -0.19 0.00 2.96 0.16 -1.68 118.68 125.85 3dgv s LEU 10 Ca -0.06 -2.16 -0.29 0.00 -0.22 0.00 0.00 54.13 51.40 3dgv s LEU 10 Cb -0.11 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.61 3dgv s LEU 10 CO 0.01 -0.60 1.29 -2.16 -1.32 0.00 0.00 176.35 173.57 3dgv s PRO 11 N 0.99 4.15 0.09 0.98 0.04 -1.26 -3.90 135.00 136.09 3dgv s PRO 11 Ca 0.09 1.58 0.22 0.00 0.04 0.00 0.00 61.00 62.94 3dgv s PRO 11 Cb -0.23 -3.80 -0.16 0.00 0.04 0.00 0.00 34.50 30.35 3dgv s PRO 11 CO -0.03 -0.81 0.78 0.54 0.04 0.00 0.00 177.00 177.52 3dgv n ARG 12 N 6.79 0.63 -4.34 4.56 1.74 -1.26 0.11 116.66 124.89 3dgv n ARG 12 Ca 0.14 -0.03 -0.18 0.00 -0.77 0.00 0.00 57.85 57.01 3dgv n ARG 12 Cb 0.45 -1.68 -0.10 0.00 -1.02 0.00 0.00 32.46 30.11 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 -3.44 0.56 0.33 0.55 -4.23 -1.26 -4.66 115.64 103.49 3dgv s THR 13 Ca -0.04 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.51 3dgv s THR 13 Cb 0.12 -2.60 0.16 0.00 1.34 0.00 0.00 72.50 71.51 3dgv s THR 13 CO 0.85 0.00 1.87 0.28 -0.54 0.00 0.00 174.62 177.08 3dgv h SER 14 N 2.28 0.50 -0.20 3.99 0.02 -1.99 -0.99 113.55 117.17 3dgv h SER 14 Ca -0.37 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 60.44 3dgv h SER 14 Cb 1.25 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 3dgv h SER 14 CO 0.59 0.57 -0.03 -0.09 -1.14 0.00 0.00 176.83 176.73 3dgv h ARG 15 N 0.52 0.37 0.00 3.45 2.43 -2.00 -2.52 114.38 116.63 3dgv h ARG 15 Ca 0.11 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 3dgv h ARG 15 Cb 0.33 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.85 3dgv h ARG 15 CO 0.01 0.61 -0.09 1.96 -1.51 0.00 0.00 179.97 180.95 3dgv h GLN 16 N 0.10 0.00 -0.11 0.20 4.20 -1.82 -0.90 115.11 116.78 3dgv h GLN 16 Ca 0.05 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 3dgv h GLN 16 Cb 0.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.25 3dgv h GLN 16 CO 0.02 0.09 -0.22 0.28 -0.67 0.00 0.00 178.83 178.33 3dgv h VAL 17 N 0.00 1.39 -0.00 -0.54 2.07 -0.89 -2.47 116.25 115.81 3dgv h VAL 17 Ca -0.00 -1.50 -0.18 0.00 0.82 0.00 0.00 66.70 65.84 3dgv h VAL 17 Cb 0.20 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 3dgv h VAL 17 CO 0.01 0.43 -0.81 0.06 0.02 0.00 0.00 177.57 177.29 3dgv h GLN 18 N -0.10 0.07 -0.74 1.57 3.07 -1.08 -1.74 115.11 116.15 3dgv h GLN 18 Ca 0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 58.65 58.66 3dgv h GLN 18 Cb 0.81 0.02 -0.03 0.00 0.08 0.00 0.00 27.48 28.35 3dgv h GLN 18 CO 0.05 0.84 0.41 0.82 0.09 0.00 0.00 178.83 181.04 3dgv h ILE 19 N 0.04 1.22 -0.44 1.86 2.04 -1.24 -1.34 117.51 119.66 3dgv h ILE 19 Ca -0.02 -0.55 -0.15 0.00 1.00 0.00 0.00 64.86 65.15 3dgv h ILE 19 Cb 1.42 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3dgv h ILE 19 CO 0.11 0.24 -0.30 0.25 0.00 0.00 0.00 178.15 178.46 3dgv h LEU 20 N 1.02 1.01 -0.34 1.44 5.85 -1.27 -0.64 115.31 122.39 3dgv h LEU 20 Ca 0.26 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3dgv h LEU 20 Cb 0.03 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 3dgv h LEU 20 CO -0.04 1.22 0.22 1.56 -0.34 0.00 0.00 178.44 181.06 3dgv h GLN 21 N 0.82 0.43 -0.78 1.25 4.20 -1.22 -1.57 115.11 118.25 3dgv h GLN 21 Ca 0.09 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.78 3dgv h GLN 21 Cb 0.88 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.53 3dgv h GLN 21 CO 0.08 0.29 0.50 -0.97 -0.67 0.00 0.00 178.83 178.06 3dgv h ASN 22 N 0.45 0.90 -0.72 1.46 -0.73 -1.04 -2.49 115.58 113.41 3dgv h ASN 22 Ca 0.12 -0.03 -0.01 0.00 1.87 0.00 0.00 56.30 58.25 3dgv h ASN 22 Cb -0.05 -0.23 -0.04 0.00 0.27 0.00 0.00 38.32 38.28 3dgv h ASN 22 CO -0.03 0.67 0.40 0.58 -0.37 0.00 0.00 177.43 178.68 3dgv h VAL 23 N 1.06 1.22 0.00 2.57 2.07 -0.67 -1.55 116.25 120.94 3dgv h VAL 23 Ca 0.28 -0.54 -0.09 0.00 0.82 0.00 0.00 66.70 67.17 3dgv h VAL 23 Cb -0.10 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 3dgv h VAL 23 CO -0.06 0.24 -0.42 0.71 0.02 0.00 0.00 177.57 178.06 3dgv h THR 24 N 1.02 1.03 -0.28 2.57 1.35 -0.86 -1.92 112.91 115.81 3dgv h THR 24 Ca 0.26 -1.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.52 3dgv h THR 24 Cb 0.03 1.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 3dgv h THR 24 CO -0.04 0.41 0.00 0.35 -0.25 0.00 0.00 175.52 175.99 3dgv n THR 25 N -3.64 0.36 -0.09 6.82 -2.24 -0.97 -4.42 114.28 110.10 3dgv n THR 25 Ca -0.01 -0.57 -0.17 0.00 -2.27 0.00 0.00 64.05 61.03 3dgv n THR 25 Cb 0.52 0.77 -0.07 0.00 -2.10 0.00 0.00 70.33 69.44 3dgv n THR 25 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3dgv n THR 26 N 1.02 1.01 -2.63 4.28 -1.04 -0.62 -5.03 114.28 111.27 3dgv n THR 26 Ca 0.18 -0.30 -0.23 0.00 -2.04 0.00 0.00 64.05 61.66 3dgv n THR 26 Cb 0.50 -1.54 0.10 0.00 -1.82 0.00 0.00 70.33 67.57 3dgv n THR 26 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3dgv s TYR 27 N -2.34 1.68 -0.89 -1.42 2.02 -0.77 -5.00 117.35 110.63 3dgv s TYR 27 Ca -0.25 -0.29 -0.24 0.00 -0.37 0.00 0.00 57.07 55.92 3dgv s TYR 27 Cb 0.09 -2.91 0.05 0.00 -0.40 0.00 0.00 41.96 38.79 3dgv s TYR 27 CO 0.35 -1.59 1.33 0.15 -1.57 0.00 0.00 175.55 174.22 3dgv s LYS 28 N -5.07 3.42 0.01 -0.62 3.01 -1.26 -4.88 119.74 114.35 3dgv s LYS 28 Ca 0.65 -0.86 0.00 0.00 -1.01 0.00 0.00 55.97 54.75 3dgv s LYS 28 Cb -0.06 -4.85 -0.01 0.00 -1.01 0.00 0.00 37.83 31.91 3dgv s LYS 28 CO 0.43 -2.12 -0.02 0.42 0.51 0.00 0.00 175.35 174.57 3dgv s ILE 29 N 4.97 0.10 -0.12 2.17 1.01 -1.26 -1.60 121.20 126.46 3dgv s ILE 29 Ca 0.39 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.63 3dgv s ILE 29 Cb -0.04 -0.16 0.02 0.00 0.01 0.00 0.00 42.46 42.28 3dgv s ILE 29 CO -0.00 -0.21 -0.16 -0.69 0.00 0.00 0.00 174.94 173.87 3dgv s VAL 30 N -0.66 1.62 0.23 2.92 1.01 -0.64 -4.96 120.40 119.92 3dgv s VAL 30 Ca -0.07 -0.70 -0.30 0.00 0.00 0.00 0.00 61.98 60.91 3dgv s VAL 30 Cb -0.05 -1.48 -0.10 0.00 0.00 0.00 0.00 36.38 34.76 3dgv s VAL 30 CO -0.00 0.47 1.40 -0.76 0.00 0.00 0.00 175.10 176.20 3dgv s LEU 31 N 1.07 4.40 -0.26 3.92 1.43 -1.26 -0.54 118.68 127.43 3dgv s LEU 31 Ca -0.04 2.58 -0.14 0.00 -1.03 0.00 0.00 54.13 55.51 3dgv s LEU 31 Cb -0.15 -3.62 -0.14 0.00 0.03 0.00 0.00 46.19 42.31 3dgv s LEU 31 CO -0.04 -0.64 -0.21 0.79 0.23 0.00 0.00 176.35 176.48 3dgv n TRP 32 N 2.40 0.24 -3.67 0.29 7.02 0.11 -4.85 117.44 118.99 3dgv n TRP 32 Ca 0.06 0.09 -0.09 0.00 -1.02 0.00 0.00 57.50 56.55 3dgv n TRP 32 Cb 0.41 -1.02 -0.10 0.00 -2.42 0.00 0.00 31.31 28.18 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 -2.48 0.33 1.05 -0.99 0.74 -0.54 -4.31 119.66 113.46 3dgv s GLN 33 Ca -0.36 0.98 -0.18 0.00 0.05 0.00 0.00 55.36 55.85 3dgv s GLN 33 Cb 0.12 0.25 0.26 0.00 1.10 0.00 0.00 33.01 34.74 3dgv s GLN 33 CO 0.53 -0.23 0.90 -0.35 -0.55 0.00 0.00 175.29 175.59 3dgv n PRO 34 N 5.15 -2.94 0.12 1.67 -0.04 -1.26 0.81 135.00 138.52 3dgv n PRO 34 Ca -0.11 -1.45 0.00 0.00 -0.04 0.00 0.00 63.50 61.90 3dgv n PRO 34 Cb 0.51 -1.39 0.01 0.00 -0.04 0.00 0.00 33.50 32.59 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 -2.61 1.08 -4.03 0.52 3.04 -1.89 -3.46 116.25 108.91 3dgv h VAL 35 Ca -0.34 -2.47 -0.18 0.00 -1.01 0.00 0.00 66.70 62.69 3dgv h VAL 35 Cb 1.06 2.50 -0.19 0.00 -2.01 0.00 0.00 31.29 32.65 3dgv h VAL 35 CO 0.22 0.61 -0.70 0.00 -1.01 0.00 0.00 177.57 176.69 3dgv s ALA 36 N -2.95 0.38 -0.06 3.17 0.00 -1.26 -4.76 121.76 116.28 3dgv s ALA 36 Ca 0.03 -0.85 0.30 0.00 0.00 0.00 0.00 51.96 51.44 3dgv s ALA 36 Cb 0.08 0.17 1.35 0.00 0.00 0.00 0.00 23.12 24.72 3dgv s ALA 36 CO 0.76 -0.20 1.91 0.00 0.00 0.00 0.00 175.76 178.23 3dgv h ALA 37 N 4.07 1.00 -0.00 0.00 0.00 -1.96 -2.39 119.26 119.97 3dgv h ALA 37 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 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 0.50 0.00 0.05 0.93 0.00 0.00 0.00 179.25 180.73 3dgv h GLU 38 N 0.00 0.00 -0.05 0.00 3.07 -1.99 -2.86 114.58 112.75 3dgv h GLU 38 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3dgv h GLU 38 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 3dgv h GLU 38 CO 0.00 0.00 0.00 0.66 -1.40 0.00 0.00 179.01 178.27 3dgv n TYR 39 N -3.07 0.06 -1.91 4.33 0.53 -0.90 -4.93 117.16 111.26 3dgv n TYR 39 Ca -0.03 -0.16 -0.42 0.00 -1.02 0.00 0.00 57.90 56.27 3dgv n TYR 39 Cb 0.12 -0.01 -0.03 0.00 -1.03 0.00 0.00 39.34 38.39 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 -0.57 2.83 0.04 -0.72 1.01 -1.08 -4.89 121.20 117.81 3dgv s ILE 40 Ca 0.06 0.43 0.06 0.00 0.00 0.00 0.00 60.65 61.20 3dgv s ILE 40 Cb 0.04 -3.28 -0.02 0.00 0.01 0.00 0.00 42.46 39.21 3dgv s ILE 40 CO 0.06 0.01 -0.16 -0.69 0.00 0.00 0.00 174.94 174.16 3dgv s VAL 41 N 2.06 1.28 0.31 2.92 1.01 -1.26 -5.06 120.40 121.66 3dgv s VAL 41 Ca 0.73 -1.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 3dgv s VAL 41 Cb -0.42 -1.15 -0.10 0.00 0.00 0.00 0.00 36.38 34.71 3dgv s VAL 41 CO 0.32 0.06 1.38 -1.59 0.00 0.00 0.00 175.10 175.28 3dgv s LYS 42 N -1.16 4.28 0.00 2.72 -2.85 -1.26 -2.29 119.74 119.18 3dgv s LYS 42 Ca 0.03 2.31 0.00 0.00 -1.00 0.00 0.00 55.97 57.31 3dgv s LYS 42 Cb -0.08 -3.06 0.00 0.00 -2.06 0.00 0.00 37.83 32.62 3dgv s LYS 42 CO 0.01 -0.33 0.00 0.41 0.10 0.00 0.00 175.35 175.55 3dgv n GLY 43 N 1.19 0.98 3.43 0.59 0.00 0.12 -5.00 105.19 106.50 3dgv n GLY 43 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.46 2.70 0.57 1.61 1.51 -0.97 -4.99 117.35 115.32 3dgv s TYR 44 Ca 0.00 -0.32 -0.19 0.00 -1.01 0.00 0.00 57.07 55.54 3dgv s TYR 44 Cb 0.00 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 40.13 3dgv s TYR 44 CO 0.00 0.05 1.20 -1.21 -1.11 0.00 0.00 175.55 174.48 3dgv s GLU 45 N -0.42 3.13 -0.17 -0.62 2.02 -1.26 -4.45 118.70 116.92 3dgv s GLU 45 Ca 0.05 1.80 0.01 0.00 0.02 0.00 0.00 54.97 56.84 3dgv s GLU 45 Cb -0.12 -2.00 0.03 0.00 0.10 0.00 0.00 34.13 32.14 3dgv s GLU 45 CO 0.02 -1.08 -0.13 0.08 0.02 0.00 0.00 175.26 174.17 3dgv s VAL 46 N -1.61 1.68 -0.17 2.63 1.01 -0.67 -4.55 120.40 118.71 3dgv s VAL 46 Ca 0.75 -0.84 -0.10 0.00 0.00 0.00 0.00 61.98 61.80 3dgv s VAL 46 Cb -0.29 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 3dgv s VAL 46 CO 0.32 0.35 0.16 -1.00 0.00 0.00 0.00 175.10 174.93 3dgv s HIS 47 N 1.42 3.46 -0.20 5.22 3.76 0.24 -1.32 115.29 127.87 3dgv s HIS 47 Ca 0.02 0.42 -0.26 0.00 -0.15 0.00 0.00 55.06 55.09 3dgv s HIS 47 Cb -0.14 -2.13 0.07 0.00 1.11 0.00 0.00 32.58 31.48 3dgv s HIS 47 CO -0.10 0.39 0.69 -0.59 -0.85 0.00 0.00 174.74 174.28 3dgv s PHE 48 N 0.03 -0.73 0.16 1.40 -0.12 -0.67 0.07 117.98 118.13 3dgv s PHE 48 Ca 0.11 1.64 -0.26 0.00 -0.05 0.00 0.00 56.93 58.37 3dgv s PHE 48 Cb -0.12 0.30 -0.08 0.00 -0.63 0.00 0.00 43.02 42.50 3dgv s PHE 48 CO 0.00 -0.43 0.80 0.12 -0.05 0.00 0.00 175.22 175.66 3dgv s PHE 49 N -0.08 3.89 -0.12 3.49 5.36 0.30 -1.35 117.98 129.47 3dgv s PHE 49 Ca -0.03 1.65 0.02 0.00 -0.96 0.00 0.00 56.93 57.61 3dgv s PHE 49 Cb -0.04 -2.81 0.01 0.00 -0.34 0.00 0.00 43.02 39.85 3dgv s PHE 49 CO 0.03 0.47 -0.17 0.08 -1.46 0.00 0.00 175.22 174.18 3dgv s VAL 50 N -0.98 1.65 0.47 3.12 1.01 -0.06 -1.61 120.40 124.00 3dgv s VAL 50 Ca 0.37 -0.73 -0.24 0.00 0.00 0.00 0.00 61.98 61.38 3dgv s VAL 50 Cb -0.23 -1.49 -0.07 0.00 0.00 0.00 0.00 36.38 34.59 3dgv s VAL 50 CO 0.27 0.47 1.34 0.21 0.00 0.00 0.00 175.10 177.39 3dgv s ASN 51 N 0.95 5.85 0.35 3.32 2.47 -0.63 -2.09 114.94 125.17 3dgv s ASN 51 Ca -0.06 2.73 0.10 0.00 0.42 0.00 0.00 52.86 56.05 3dgv s ASN 51 Cb -0.15 -2.64 0.86 0.00 -1.45 0.00 0.00 41.25 37.88 3dgv s ASN 51 CO -0.02 -1.17 1.82 0.00 -3.72 0.00 0.00 177.10 174.01 3dgv h ALA 52 N 2.13 1.89 -0.39 1.71 0.00 -1.48 -0.23 119.26 122.88 3dgv h ALA 52 Ca -0.50 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.48 3dgv h ALA 52 Cb 1.27 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3dgv h ALA 52 CO 0.60 -0.20 0.26 0.66 0.00 0.00 0.00 179.25 180.58 3dgv h SER 53 N 0.64 0.36 -0.02 0.00 4.64 -1.89 -2.76 113.55 114.52 3dgv h SER 53 Ca 0.51 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 3dgv h SER 53 Cb 0.94 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 3dgv h SER 53 CO -0.27 0.25 -0.15 0.47 -0.87 0.00 0.00 176.83 176.26 3dgv n ASP 54 N -4.48 2.63 0.07 4.97 9.92 -0.11 -4.64 116.55 124.91 3dgv n ASP 54 Ca 0.04 -1.82 -0.11 0.00 -0.53 0.00 0.00 54.79 52.36 3dgv n ASP 54 Cb 0.15 0.15 -0.05 0.00 -0.64 0.00 0.00 41.12 40.73 3dgv n ASP 54 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 3dgv h VAL 55 N 3.89 0.55 -0.96 2.53 2.07 -1.35 -0.75 116.25 122.23 3dgv h VAL 55 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 3dgv h VAL 55 Cb 0.90 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 3dgv h VAL 55 CO 0.00 0.00 0.63 0.28 0.02 0.00 0.00 177.57 178.50 3dgv h SER 56 N -0.33 1.05 0.75 0.57 0.02 -1.82 -1.47 113.55 112.32 3dgv h SER 56 Ca 0.05 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.85 3dgv h SER 56 Cb 0.39 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 3dgv h SER 56 CO -0.15 0.73 -0.63 0.78 -1.14 0.00 0.00 176.83 176.42 3dgv h ASN 57 N 1.23 0.00 0.02 3.07 2.35 -1.70 -1.17 115.58 119.39 3dgv h ASN 57 Ca 0.37 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.12 3dgv h ASN 57 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 3dgv h ASN 57 CO -0.11 0.63 -0.01 0.58 -1.65 0.00 0.00 177.43 176.87 3dgv h VAL 58 N 0.00 1.45 -0.61 2.81 2.07 -0.82 -2.14 116.25 119.00 3dgv h VAL 58 Ca -0.01 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.92 3dgv h VAL 58 Cb 1.17 2.50 -0.03 0.00 -1.52 0.00 0.00 31.29 33.41 3dgv h VAL 58 CO 0.08 0.40 0.39 0.11 0.02 0.00 0.00 177.57 178.57 3dgv h LYS 59 N -0.74 0.82 -0.43 1.57 1.57 -1.24 0.29 116.57 118.39 3dgv h LYS 59 Ca -0.00 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3dgv h LYS 59 Cb 0.68 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 3dgv h LYS 59 CO 0.01 0.56 0.06 0.00 -0.57 0.00 0.00 179.45 179.50 3dgv h ALA 60 N 1.59 0.58 -0.15 3.86 0.00 -1.28 -1.46 119.26 122.40 3dgv h ALA 60 Ca 0.22 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 3dgv h ALA 60 Cb -0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3dgv h ALA 60 CO -0.05 0.31 -0.59 1.25 0.00 0.00 0.00 179.25 180.17 3dgv h HIS 61 N 0.58 0.61 -0.34 0.00 -0.00 -0.46 -1.60 115.15 113.95 3dgv h HIS 61 Ca 0.13 -0.23 -0.07 0.00 -0.00 0.00 0.00 60.37 60.20 3dgv h HIS 61 Cb 0.39 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.68 3dgv h HIS 61 CO 0.03 0.95 -0.06 -0.07 -0.00 0.00 0.00 177.93 178.78 3dgv h LEU 62 N 0.36 0.64 0.35 0.26 3.38 -0.46 -2.00 115.31 117.85 3dgv h LEU 62 Ca -0.00 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 3dgv h LEU 62 Cb 1.13 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 3dgv h LEU 62 CO 0.11 0.84 -0.46 -1.13 0.09 0.00 0.00 178.44 177.89 3dgv h ASN 63 N 0.43 -1.28 -0.97 -0.43 -0.00 -1.11 -1.04 115.58 111.18 3dgv h ASN 63 Ca 0.09 0.12 0.18 0.00 -0.00 0.00 0.00 56.30 56.69 3dgv h ASN 63 Cb 0.55 0.44 -0.09 0.00 -0.00 0.00 0.00 38.32 39.22 3dgv h ASN 63 CO 0.03 -0.58 0.61 0.00 -0.00 0.00 0.00 177.43 177.49 3dgv h ALA 64 N -0.55 1.80 -0.03 1.57 0.00 -1.27 -0.40 119.26 120.37 3dgv h ALA 64 Ca -0.03 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3dgv h ALA 64 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3dgv h ALA 64 CO -0.12 -0.12 0.00 0.43 0.00 0.00 0.00 179.25 179.44 3dgv n SER 65 N -4.66 0.67 -2.92 0.00 7.64 -0.76 -4.91 113.62 108.68 3dgv n SER 65 Ca 0.21 -1.33 -0.19 0.00 1.01 0.00 0.00 58.87 58.58 3dgv n SER 65 Cb 0.57 -0.02 0.06 0.00 -1.01 0.00 0.00 64.21 63.81 3dgv n SER 65 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3dgv n ARG 66 N -0.43 -6.20 -3.74 1.43 1.74 -0.16 -4.89 116.66 104.41 3dgv n ARG 66 Ca 0.20 0.66 -0.38 0.00 -0.77 0.00 0.00 57.85 57.56 3dgv n ARG 66 Cb 0.20 -5.18 -0.12 0.00 -1.02 0.00 0.00 32.46 26.35 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 -3.24 3.76 0.40 0.55 1.01 -0.45 -4.88 121.20 118.35 3dgv s ILE 67 Ca 0.45 -1.24 -0.26 0.00 0.00 0.00 0.00 60.65 59.60 3dgv s ILE 67 Cb -0.20 -3.18 -0.09 0.00 0.01 0.00 0.00 42.46 39.00 3dgv s ILE 67 CO 0.56 -0.25 1.31 -2.16 0.00 0.00 0.00 174.94 174.41 3dgv s PRO 68 N 1.38 4.00 0.08 2.79 0.04 -1.25 -4.44 135.00 137.60 3dgv s PRO 68 Ca -0.01 2.19 -0.10 0.00 0.04 0.00 0.00 61.00 63.11 3dgv s PRO 68 Cb -0.20 -2.79 0.01 0.00 0.04 0.00 0.00 34.50 31.55 3dgv s PRO 68 CO 0.02 -0.48 0.23 -0.59 0.04 0.00 0.00 177.00 176.23 3dgv s PHE 69 N -1.24 0.05 0.06 0.56 -0.71 -1.26 -0.67 117.98 114.77 3dgv s PHE 69 Ca 0.56 -0.39 -0.03 0.00 -1.04 0.00 0.00 56.93 56.02 3dgv s PHE 69 Cb -0.39 0.01 -0.03 0.00 -1.21 0.00 0.00 43.02 41.40 3dgv s PHE 69 CO 0.50 -0.54 0.03 -0.98 -1.34 0.00 0.00 175.22 172.90 3dgv s ARG 70 N -3.45 0.67 -0.23 1.99 1.70 0.10 -4.98 118.95 114.76 3dgv s ARG 70 Ca 0.02 -1.12 -0.19 0.00 -0.47 0.00 0.00 55.73 53.97 3dgv s ARG 70 Cb 0.03 0.24 -0.03 0.00 -0.57 0.00 0.00 34.95 34.62 3dgv s ARG 70 CO -0.09 -0.15 0.54 0.08 -1.08 0.00 0.00 175.30 174.60 3dgv s VAL 71 N -3.80 5.07 -0.15 4.99 1.01 -1.26 -0.08 120.40 126.17 3dgv s VAL 71 Ca 0.05 0.98 -0.12 0.00 0.00 0.00 0.00 61.98 62.90 3dgv s VAL 71 Cb 0.06 -3.86 -0.08 0.00 0.00 0.00 0.00 36.38 32.50 3dgv s VAL 71 CO -0.10 0.12 0.02 -0.07 0.00 0.00 0.00 175.10 175.08 3dgv h LEU 72 N 8.37 0.00 -8.21 3.92 3.38 -1.25 -3.47 115.31 118.04 3dgv h LEU 72 Ca -0.31 -0.20 -0.67 0.00 0.09 0.00 0.00 57.88 56.80 3dgv h LEU 72 Cb 1.14 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 41.57 3dgv h LEU 72 CO 0.74 0.89 -0.84 -0.69 0.09 0.00 0.00 178.44 178.64 3dgv s VAL 73 N -2.13 2.34 -0.37 1.22 1.01 -0.95 -4.84 120.40 116.68 3dgv s VAL 73 Ca -0.15 -0.87 0.23 0.00 0.00 0.00 0.00 61.98 61.19 3dgv s VAL 73 Cb 0.02 -1.98 0.10 0.00 0.00 0.00 0.00 36.38 34.53 3dgv s VAL 73 CO 0.30 0.53 1.26 -0.08 0.00 0.00 0.00 175.10 177.10 3dgv h GLU 74 N 7.61 0.00 -1.79 2.72 4.57 -1.88 -1.62 114.58 124.19 3dgv h GLU 74 Ca -0.38 0.00 -0.30 0.00 -1.18 0.00 0.00 59.36 57.50 3dgv h GLU 74 Cb 1.17 0.00 -0.29 0.00 -0.16 0.00 0.00 28.75 29.47 3dgv h GLU 74 CO 0.59 0.00 -0.63 1.21 -1.18 0.00 0.00 179.01 179.00 3dgv s ASN 75 N -5.36 0.68 0.43 1.04 3.84 -1.26 -4.77 114.94 109.55 3dgv s ASN 75 Ca 0.03 -1.28 0.15 0.00 0.21 0.00 0.00 52.86 51.97 3dgv s ASN 75 Cb 0.09 0.84 0.95 0.00 -0.55 0.00 0.00 41.25 42.58 3dgv s ASN 75 CO 0.74 -0.26 1.95 0.58 -2.79 0.00 0.00 177.10 177.32 3dgv h VAL 76 N 5.23 1.12 -0.40 -5.21 2.07 -1.59 -2.96 116.25 114.52 3dgv h VAL 76 Ca 0.03 -0.82 -0.12 0.00 0.82 0.00 0.00 66.70 66.61 3dgv h VAL 76 Cb 1.08 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 3dgv h VAL 76 CO 0.20 0.23 -0.23 -0.08 0.02 0.00 0.00 177.57 177.71 3dgv h GLU 77 N 0.00 0.79 -0.39 1.57 4.81 -1.81 -2.30 114.58 117.25 3dgv h GLU 77 Ca -0.00 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 58.88 3dgv h GLU 77 Cb 0.43 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 3dgv h GLU 77 CO 0.03 0.94 0.14 -0.44 -0.73 0.00 0.00 179.01 178.95 3dgv h ASP 78 N 0.69 0.55 -0.16 1.04 3.32 -1.85 -1.79 116.42 118.22 3dgv h ASP 78 Ca 0.09 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 3dgv h ASP 78 Cb 0.74 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 3dgv h ASP 78 CO 0.06 0.59 0.02 -0.07 -1.72 0.00 0.00 179.24 178.12 3dgv h LEU 79 N 0.48 0.26 -0.83 1.55 4.07 -1.54 0.17 115.31 119.47 3dgv h LEU 79 Ca 0.13 -0.27 -0.02 0.00 0.08 0.00 0.00 57.88 57.80 3dgv h LEU 79 Cb 0.23 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 41.86 3dgv h LEU 79 CO -0.01 0.47 0.45 0.40 -1.08 0.00 0.00 178.44 178.67 3dgv h ILE 80 N 0.04 1.25 -0.54 1.22 2.04 -1.43 -0.52 117.51 119.57 3dgv h ILE 80 Ca 0.05 -0.62 -0.04 0.00 1.00 0.00 0.00 64.86 65.24 3dgv h ILE 80 Cb 0.32 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 3dgv h ILE 80 CO 0.00 0.28 0.17 -0.09 0.00 0.00 0.00 178.15 178.52 3dgv h ARG 81 N 1.16 0.84 -0.44 2.37 2.43 -1.11 -2.57 114.38 117.06 3dgv h ARG 81 Ca 0.29 -0.18 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 3dgv h ARG 81 Cb 0.04 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3dgv h ARG 81 CO -0.05 0.76 0.04 1.96 -1.51 0.00 0.00 179.97 181.18 3dgv h GLN 82 N 0.75 0.69 0.00 0.20 4.20 -0.18 -3.14 115.11 117.63 3dgv h GLN 82 Ca 0.17 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3dgv h GLN 82 Cb 0.27 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.95 3dgv h GLN 82 CO -0.01 0.68 -0.65 1.04 -0.67 0.00 0.00 178.83 179.22 3dgv n GLN 83 N -4.26 0.14 -0.25 1.46 6.02 -0.25 -3.41 117.38 116.84 3dgv n GLN 83 Ca 0.03 0.02 0.07 0.00 -0.01 0.00 0.00 57.00 57.10 3dgv n GLN 83 Cb 0.25 -1.57 0.19 0.00 1.02 0.00 0.00 30.24 30.13 3dgv n GLN 83 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3dgv n THR 84 N -1.76 1.19 0.05 5.09 -2.24 -0.98 -4.49 114.28 111.14 3dgv n THR 84 Ca 0.04 -1.11 -0.16 0.00 -2.27 0.00 0.00 64.05 60.55 3dgv n THR 84 Cb 0.38 0.40 -0.14 0.00 -2.10 0.00 0.00 70.33 68.87 3dgv n THR 84 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3dgv h SER 85 N 2.30 0.35 0.00 3.42 0.87 -1.56 -3.43 113.55 115.51 3dgv h SER 85 Ca 0.00 -0.50 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 3dgv h SER 85 Cb 0.87 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 3dgv h SER 85 CO 0.04 1.42 0.00 0.59 -0.53 0.00 0.00 176.83 178.35 3dgv n ASN 86 N -3.42 0.00 0.00 6.23 5.03 -1.26 -4.82 115.26 117.01 3dgv n ASN 86 Ca -0.16 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.29 3dgv n ASN 86 Cb 1.04 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.80 3dgv n ASN 86 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3dgv n ASP 87 N 0.00 0.00 -0.25 6.41 4.64 -1.25 -3.99 116.55 122.12 3dgv n ASP 87 Ca 0.00 0.00 0.04 0.00 -1.38 0.00 0.00 54.79 53.45 3dgv n ASP 87 Cb 0.00 0.00 0.05 0.00 -1.04 0.00 0.00 41.12 40.13 3dgv n ASP 87 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 3dgv n THR 88 N 0.00 0.81 0.04 5.18 -2.24 -1.26 -4.86 114.28 111.95 3dgv n THR 88 Ca 0.00 -0.95 -0.20 0.00 -2.27 0.00 0.00 64.05 60.63 3dgv n THR 88 Cb 0.00 0.26 -0.14 0.00 -2.10 0.00 0.00 70.33 68.35 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 3.36 0.89 -2.80 2.28 2.10 -1.91 -3.46 117.51 117.96 3dgv h ILE 89 Ca 0.00 -2.55 -0.44 0.00 1.08 0.00 0.00 64.86 62.95 3dgv h ILE 89 Cb 1.13 2.66 0.05 0.00 -1.09 0.00 0.00 36.82 39.57 3dgv h ILE 89 CO 0.00 0.83 0.01 -0.44 -1.08 0.00 0.00 178.15 177.47 3dgv s SER 90 N -7.05 5.27 0.00 2.19 0.01 -1.26 -5.09 113.70 107.77 3dgv s SER 90 Ca -0.15 0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.24 3dgv s SER 90 Cb 0.06 -1.02 0.00 0.00 0.21 0.00 0.00 66.02 65.27 3dgv s SER 90 CO 0.83 -1.17 0.00 -2.65 0.41 0.00 0.00 173.24 170.66 3dgv n PRO 91 N -2.42 0.00 0.00 12.44 -0.02 -1.26 -5.00 135.00 138.74 3dgv n PRO 91 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 3dgv n PRO 91 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.07 3dgv n PRO 91 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3dgv n ARG 92 N 0.00 0.00 0.02 -0.52 3.00 -1.26 -4.92 116.66 112.99 3dgv n ARG 92 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 3dgv n ARG 92 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 3dgv n ARG 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3dgv n ALA 4 N 0.00 3.00 0.00 5.13 0.00 -1.26 -4.98 120.51 122.40 3dgv n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3dgv n ALA 4 Cb 0.02 0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.86 3dgv n ALA 4 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3dgv n SER 5 N -3.22 0.00 0.00 0.00 2.88 -1.26 -3.33 113.62 108.69 3dgv n SER 5 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3dgv n SER 5 Cb 0.27 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 3dgv n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3dgv n SER 6 N 0.00 0.00 0.06 -3.46 2.88 -1.26 -4.15 113.62 107.69 3dgv n SER 6 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 3dgv n SER 6 Cb 0.00 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 63.76 3dgv n SER 6 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3dgv n SER 7 N 1.27 0.63 -0.22 -3.46 3.41 -1.25 -3.20 113.62 110.79 3dgv n SER 7 Ca 0.00 0.26 0.19 0.00 -0.26 0.00 0.00 58.87 59.06 3dgv n SER 7 Cb 0.00 -0.20 0.52 0.00 -0.26 0.00 0.00 64.21 64.26 3dgv n SER 7 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3dgv h TYR 8 N 0.00 0.51 -0.01 7.33 5.03 -1.71 -1.24 116.97 126.88 3dgv h TYR 8 Ca 0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.33 3dgv h TYR 8 Cb 0.69 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 38.81 3dgv h TYR 8 CO 0.00 0.15 -0.06 0.66 -1.32 0.00 0.00 178.16 177.59 3dgv n TYR 9 N -4.50 0.00 -1.22 -3.82 4.01 -1.19 -3.07 117.16 107.38 3dgv n TYR 9 Ca 0.18 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.81 3dgv n TYR 9 Cb 0.67 -0.05 0.23 0.00 -0.31 0.00 0.00 39.34 39.87 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 -0.42 2.63 -4.03 -0.72 1.02 -0.47 -4.84 120.64 113.81 3dgv n GLU 10 Ca 0.18 -3.07 -0.08 0.00 -0.02 0.00 0.00 57.16 54.17 3dgv n GLU 10 Cb 0.29 -2.08 -0.10 0.00 -0.02 0.00 0.00 31.44 29.52 3dgv n GLU 10 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3dgv s GLN 11 N -3.17 0.49 0.20 3.49 -0.21 -1.17 -4.69 119.66 114.59 3dgv s GLN 11 Ca 0.52 -0.95 -0.23 0.00 0.02 0.00 0.00 55.36 54.73 3dgv s GLN 11 Cb 0.44 0.17 -0.08 0.00 1.00 0.00 0.00 33.01 34.54 3dgv s GLN 11 CO 0.09 -0.09 0.76 0.71 -2.12 0.00 0.00 175.29 174.64 3dgv s TYR 12 N -2.86 3.78 0.10 0.91 2.02 -1.26 -5.00 117.35 115.04 3dgv s TYR 12 Ca -0.03 1.53 0.09 0.00 -0.37 0.00 0.00 57.07 58.29 3dgv s TYR 12 Cb 0.00 -2.71 -0.03 0.00 -0.40 0.00 0.00 41.96 38.82 3dgv s TYR 12 CO -0.06 0.42 -0.23 -1.01 -1.57 0.00 0.00 175.55 173.11 3dgv s HIS 13 N -1.33 1.95 0.77 2.71 3.76 -1.26 -3.85 115.29 118.03 3dgv s HIS 13 Ca 0.39 -0.40 -0.12 0.00 -0.15 0.00 0.00 55.06 54.79 3dgv s HIS 13 Cb -0.20 -1.08 0.05 0.00 1.11 0.00 0.00 32.58 32.46 3dgv s HIS 13 CO 0.24 0.23 1.11 -1.54 -0.85 0.00 0.00 174.74 173.92 3dgv s SER 14 N -1.85 4.85 0.24 1.40 1.04 -1.26 -4.78 113.70 113.35 3dgv s SER 14 Ca 0.09 1.16 -0.05 0.00 0.48 0.00 0.00 55.95 57.63 3dgv s SER 14 Cb -0.10 -1.88 0.45 0.00 0.10 0.00 0.00 66.02 64.58 3dgv s SER 14 CO 0.04 -1.72 1.72 0.25 0.98 0.00 0.00 173.24 174.51 3dgv h LEU 15 N -0.92 0.19 -0.38 2.42 5.85 -1.94 -0.10 115.31 120.43 3dgv h LEU 15 Ca -0.46 0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.27 3dgv h LEU 15 Cb 1.27 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 3dgv h LEU 15 CO 0.62 0.06 -0.17 -1.13 -0.34 0.00 0.00 178.44 177.48 3dgv h ASN 16 N 0.38 0.80 -0.75 1.25 -0.00 -2.00 -1.39 115.58 113.87 3dgv h ASN 16 Ca 0.41 -0.40 -0.06 0.00 -0.00 0.00 0.00 56.30 56.25 3dgv h ASN 16 Cb 0.64 -0.22 -0.03 0.00 -0.00 0.00 0.00 38.32 38.71 3dgv h ASN 16 CO -0.43 1.02 0.24 -0.08 -0.00 0.00 0.00 177.43 178.19 3dgv h GLU 17 N 0.58 1.16 -0.53 6.67 4.57 -1.70 -2.61 114.58 122.71 3dgv h GLU 17 Ca 0.09 -0.24 -0.05 0.00 -1.18 0.00 0.00 59.36 57.97 3dgv h GLU 17 Cb 0.71 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 3dgv h GLU 17 CO 0.05 0.98 0.12 0.82 -1.18 0.00 0.00 179.01 179.80 3dgv h ILE 18 N 1.11 1.23 -0.47 2.32 2.04 -0.79 -0.20 117.51 122.76 3dgv h ILE 18 Ca 0.24 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.30 3dgv h ILE 18 Cb 0.30 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 3dgv h ILE 18 CO -0.01 0.31 0.26 1.88 0.00 0.00 0.00 178.15 180.59 3dgv h TYR 19 N 0.79 0.48 0.00 1.37 0.05 -0.90 -0.87 116.97 117.90 3dgv h TYR 19 Ca 0.17 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.91 3dgv h TYR 19 Cb 0.31 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 3dgv h TYR 19 CO 0.02 0.26 -0.45 0.66 -1.05 0.00 0.00 178.16 177.60 3dgv h SER 20 N 0.52 0.00 -0.70 3.88 4.64 -1.30 -2.94 113.55 117.65 3dgv h SER 20 Ca 0.19 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.50 3dgv h SER 20 Cb 0.06 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.11 3dgv h SER 20 CO -0.11 0.27 0.37 -0.25 -0.87 0.00 0.00 176.83 176.24 3dgv h TRP 21 N 0.00 0.98 -0.84 4.77 7.01 -0.77 -2.17 115.95 124.93 3dgv h TRP 21 Ca -0.02 -0.03 0.04 0.00 2.11 0.00 0.00 58.89 60.99 3dgv h TRP 21 Cb 1.22 -0.31 -0.05 0.00 -2.10 0.00 0.00 29.16 27.92 3dgv h TRP 21 CO 0.00 0.70 0.55 0.82 -2.79 0.00 0.00 178.44 177.73 3dgv h ILE 22 N 0.97 1.14 -0.23 2.65 2.04 -0.98 -0.57 117.51 122.52 3dgv h ILE 22 Ca 0.25 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.68 3dgv h ILE 22 Cb 0.06 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 3dgv h ILE 22 CO -0.04 0.19 -0.12 -0.33 0.00 0.00 0.00 178.15 177.85 3dgv h GLU 23 N 1.04 0.49 0.50 2.37 4.39 -1.40 -1.22 114.58 120.76 3dgv h GLU 23 Ca 0.34 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 3dgv h GLU 23 Cb 0.04 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3dgv h GLU 23 CO -0.10 0.77 -0.45 0.28 -1.16 0.00 0.00 179.01 178.35 3dgv h VAL 24 N 0.20 0.10 -0.97 3.13 2.07 -1.07 -1.93 116.25 117.78 3dgv h VAL 24 Ca 0.05 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.81 3dgv h VAL 24 Cb 0.63 0.10 -0.12 0.00 -1.52 0.00 0.00 31.29 30.38 3dgv h VAL 24 CO 0.04 0.00 0.53 -0.03 0.02 0.00 0.00 177.57 178.12 3dgv h MET 25 N -0.95 0.51 0.00 1.57 -1.53 -1.07 0.59 114.93 114.05 3dgv h MET 25 Ca -0.06 -0.03 -0.12 0.00 -3.44 0.00 0.00 59.70 56.06 3dgv h MET 25 Cb 0.82 -0.12 -0.02 0.00 -0.55 0.00 0.00 31.60 31.74 3dgv h MET 25 CO -0.04 0.34 -0.55 0.00 0.14 0.00 0.00 176.91 176.80 3dgv h THR 26 N 0.53 1.00 0.00 -0.77 1.03 -0.89 -1.54 112.91 112.27 3dgv h THR 26 Ca 0.61 -2.26 -0.04 0.00 -0.01 0.00 0.00 66.41 64.71 3dgv h THR 26 Cb 1.16 2.39 -0.01 0.00 -1.07 0.00 0.00 68.15 70.62 3dgv h THR 26 CO -0.49 0.54 -0.94 -0.08 -0.01 0.00 0.00 175.52 174.55 3dgv h GLU 27 N 0.00 0.00 0.13 0.00 4.57 -0.43 -3.28 114.58 115.58 3dgv h GLU 27 Ca -0.01 0.00 -0.32 0.00 -1.18 0.00 0.00 59.36 57.85 3dgv h GLU 27 Cb 1.34 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.93 3dgv h GLU 27 CO 0.07 0.08 -1.62 -0.09 -1.18 0.00 0.00 179.01 176.27 3dgv h ARG 28 N 0.00 0.28 -2.21 1.92 2.43 -0.72 -3.39 114.38 112.69 3dgv h ARG 28 Ca -0.03 -0.48 -0.58 0.00 -0.81 0.00 0.00 59.98 58.08 3dgv h ARG 28 Cb 1.14 0.18 -0.42 0.00 -0.42 0.00 0.00 29.97 30.45 3dgv h ARG 28 CO 0.01 1.15 -0.72 0.66 -1.51 0.00 0.00 179.97 179.56 3dgv n TYR 29 N -3.47 3.24 0.29 2.20 4.01 -0.60 -4.92 117.16 117.91 3dgv n TYR 29 Ca -0.19 -4.00 0.15 0.00 -0.16 0.00 0.00 57.90 53.70 3dgv n TYR 29 Cb 1.05 -0.49 0.73 0.00 -0.31 0.00 0.00 39.34 40.32 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 3.40 0.00 0.00 -0.72 0.13 -1.76 -0.24 132.00 132.81 3dgv h PRO 30 Ca 0.14 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.19 3dgv h PRO 30 Cb 0.62 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.74 3dgv h PRO 30 CO 0.77 0.00 -1.74 -0.25 -0.23 0.00 0.00 178.00 176.55 3dgv n ASP 31 N -2.61 0.34 -0.12 1.44 8.00 -1.26 -4.65 116.55 117.69 3dgv n ASP 31 Ca -0.01 0.14 -0.22 0.00 0.71 0.00 0.00 54.79 55.41 3dgv n ASP 31 Cb 0.15 1.19 -0.12 0.00 -0.02 0.00 0.00 41.12 42.32 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 -2.53 0.64 -4.02 -1.24 2.81 -0.31 -4.46 117.12 108.01 3dgv n MET 32 Ca -0.08 0.21 -0.34 0.00 -1.81 0.00 0.00 57.70 55.68 3dgv n MET 32 Cb 0.70 -1.54 -0.15 0.00 -0.71 0.00 0.00 33.22 31.52 3dgv n MET 32 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3dgv s VAL 33 N -2.51 2.68 -0.17 2.03 0.11 -0.26 -1.89 120.40 120.39 3dgv s VAL 33 Ca -0.35 -0.74 -0.03 0.00 -2.93 0.00 0.00 61.98 57.93 3dgv s VAL 33 Cb 0.11 -2.19 -0.02 0.00 -1.53 0.00 0.00 36.38 32.75 3dgv s VAL 33 CO 0.58 0.47 -0.05 -0.70 -3.33 0.00 0.00 175.10 172.07 3dgv s GLU 34 N 1.38 3.54 0.03 1.54 2.12 0.11 -4.67 118.70 122.76 3dgv s GLU 34 Ca 0.05 -0.58 -0.27 0.00 0.36 0.00 0.00 54.97 54.53 3dgv s GLU 34 Cb -0.14 -2.89 -0.05 0.00 0.26 0.00 0.00 34.13 31.32 3dgv s GLU 34 CO -0.08 0.12 0.87 0.21 -0.54 0.00 0.00 175.26 175.84 3dgv s LYS 35 N 0.66 4.56 -0.08 4.30 2.20 -1.26 -0.34 119.74 129.78 3dgv s LYS 35 Ca -0.03 1.24 0.02 0.00 -0.36 0.00 0.00 55.97 56.84 3dgv s LYS 35 Cb -0.15 -3.41 0.01 0.00 -1.51 0.00 0.00 37.83 32.78 3dgv s LYS 35 CO 0.02 0.13 -0.15 0.42 -0.36 0.00 0.00 175.35 175.41 3dgv s ILE 36 N 0.41 1.38 -0.31 5.43 1.01 0.86 -4.96 121.20 125.01 3dgv s ILE 36 Ca 0.44 -0.61 -0.20 0.00 0.00 0.00 0.00 60.65 60.29 3dgv s ILE 36 Cb -0.21 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.01 3dgv s ILE 36 CO 0.25 0.41 0.60 -2.28 0.00 0.00 0.00 174.94 173.93 3dgv s HIS 37 N 0.69 3.21 -0.57 3.97 5.65 -1.26 -0.54 115.29 126.43 3dgv s HIS 37 Ca -0.13 0.51 0.10 0.00 0.25 0.00 0.00 55.06 55.78 3dgv s HIS 37 Cb -0.16 -2.97 -0.08 0.00 -1.18 0.00 0.00 32.58 28.19 3dgv s HIS 37 CO 0.03 -0.48 0.46 0.44 -0.65 0.00 0.00 174.74 174.55 3dgv n ILE 38 N 5.40 0.00 -3.64 0.89 -5.35 -0.41 -4.99 119.36 111.26 3dgv n ILE 38 Ca -0.02 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 3dgv n ILE 38 Cb 0.49 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.42 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 1.14 -0.80 2.98 3.28 0.00 -1.24 -4.77 105.19 105.78 3dgv n GLY 39 Ca 0.02 -0.98 -0.16 0.00 0.00 0.00 0.00 46.02 44.90 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 0.73 1.30 1.61 0.01 -1.26 -0.79 113.70 111.29 3dgv s SER 40 Ca 0.00 -0.13 -0.22 0.00 1.31 0.00 0.00 55.95 56.91 3dgv s SER 40 Cb 0.00 -0.07 0.32 0.00 0.21 0.00 0.00 66.02 66.48 3dgv s SER 40 CO 0.00 0.06 1.07 -1.54 0.41 0.00 0.00 173.24 173.25 3dgv n SER 41 N 2.86 -2.48 -0.06 2.44 3.41 0.14 -4.52 113.62 115.41 3dgv n SER 41 Ca -0.13 -1.13 -0.09 0.00 -0.26 0.00 0.00 58.87 57.25 3dgv n SER 41 Cb 0.58 -1.02 0.06 0.00 -0.26 0.00 0.00 64.21 63.56 3dgv n SER 41 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3dgv h TYR 42 N -2.92 0.86 -0.03 7.33 3.20 -1.95 -0.81 116.97 122.65 3dgv h TYR 42 Ca -0.42 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.21 3dgv h TYR 42 Cb 1.29 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.38 3dgv h TYR 42 CO 0.00 0.99 0.00 0.39 -1.64 0.00 0.00 178.16 177.90 3dgv n GLU 43 N -4.05 1.09 -1.75 1.82 1.02 -1.26 -4.89 120.64 112.62 3dgv n GLU 43 Ca -0.02 -0.14 -0.05 0.00 -0.02 0.00 0.00 57.16 56.94 3dgv n GLU 43 Cb 0.51 -1.12 -0.01 0.00 -0.02 0.00 0.00 31.44 30.81 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 -0.47 -0.34 -3.09 3.49 4.76 -0.31 -5.04 118.16 117.16 3dgv n LYS 44 Ca 0.06 0.37 -0.34 0.00 -2.87 0.00 0.00 58.31 55.53 3dgv n LYS 44 Cb 0.05 -4.11 -0.06 0.00 -1.84 0.00 0.00 35.03 29.08 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 -2.21 3.49 0.35 2.13 1.51 -1.26 -4.75 117.35 116.62 3dgv s TYR 45 Ca 0.00 1.33 -0.27 0.00 -1.01 0.00 0.00 57.07 57.12 3dgv s TYR 45 Cb 0.00 -2.60 -0.09 0.00 -0.11 0.00 0.00 41.96 39.15 3dgv s TYR 45 CO 0.00 0.19 1.21 -1.25 -1.11 0.00 0.00 175.55 174.59 3dgv s PRO 46 N -2.54 4.28 -0.25 -1.71 0.04 -1.26 0.24 135.00 133.79 3dgv s PRO 46 Ca 0.50 1.98 -0.09 0.00 0.04 0.00 0.00 61.00 63.43 3dgv s PRO 46 Cb -0.13 -2.93 -0.04 0.00 0.04 0.00 0.00 34.50 31.45 3dgv s PRO 46 CO 0.19 -0.17 0.11 -0.51 0.04 0.00 0.00 177.00 176.66 3dgv s LEU 47 N -2.03 3.70 -0.08 -3.56 1.02 0.03 -4.82 118.68 112.94 3dgv s LEU 47 Ca 0.52 -0.09 0.02 0.00 0.02 0.00 0.00 54.13 54.59 3dgv s LEU 47 Cb -0.35 -2.00 -0.02 0.00 0.02 0.00 0.00 46.19 43.85 3dgv s LEU 47 CO 0.45 -0.00 -0.14 -0.31 0.02 0.00 0.00 176.35 176.37 3dgv s TYR 48 N 1.45 2.75 -0.14 0.29 2.02 -1.26 -1.29 117.35 121.17 3dgv s TYR 48 Ca 0.06 -0.37 -0.02 0.00 -0.37 0.00 0.00 57.07 56.37 3dgv s TYR 48 Cb -0.15 -1.72 -0.02 0.00 -0.40 0.00 0.00 41.96 39.67 3dgv s TYR 48 CO 0.05 0.02 -0.07 0.08 -1.57 0.00 0.00 175.55 174.06 3dgv s VAL 49 N -0.27 3.58 -0.27 0.71 1.01 0.30 -4.43 120.40 121.03 3dgv s VAL 49 Ca 0.02 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.39 3dgv s VAL 49 Cb -0.13 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 3dgv s VAL 49 CO 0.03 0.51 0.30 -0.76 0.00 0.00 0.00 175.10 175.18 3dgv s LEU 50 N 0.26 4.04 -0.10 3.92 1.43 -0.06 -0.10 118.68 128.06 3dgv s LEU 50 Ca -0.05 0.18 -0.26 0.00 -1.03 0.00 0.00 54.13 52.97 3dgv s LEU 50 Cb -0.15 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.74 3dgv s LEU 50 CO 0.04 -0.13 0.85 -0.75 0.23 0.00 0.00 176.35 176.59 3dgv s LYS 51 N 1.91 4.40 -0.12 1.70 2.20 0.54 -0.58 119.74 129.79 3dgv s LYS 51 Ca 0.12 1.10 0.02 0.00 -0.36 0.00 0.00 55.97 56.86 3dgv s LYS 51 Cb -0.16 -3.52 0.01 0.00 -1.51 0.00 0.00 37.83 32.66 3dgv s LYS 51 CO 0.10 -0.17 -0.19 0.08 -0.36 0.00 0.00 175.35 174.81 3dgv s VAL 52 N 1.57 1.78 -0.28 4.02 1.01 0.27 -0.71 120.40 128.06 3dgv s VAL 52 Ca 0.42 -0.82 -0.25 0.00 0.00 0.00 0.00 61.98 61.33 3dgv s VAL 52 Cb -0.18 -1.59 0.15 0.00 0.00 0.00 0.00 36.38 34.77 3dgv s VAL 52 CO 0.17 0.50 1.21 -0.94 0.00 0.00 0.00 175.10 176.04 3dgv s SER 53 N 0.81 -0.27 -0.20 3.32 1.04 -0.79 0.50 113.70 118.10 3dgv s SER 53 Ca -0.09 0.51 -0.29 0.00 0.48 0.00 0.00 55.95 56.56 3dgv s SER 53 Cb -0.16 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.48 3dgv s SER 53 CO 0.00 -0.10 1.09 -1.59 0.98 0.00 0.00 173.24 173.63 3dgv s LYS 54 N 0.06 4.26 0.14 4.02 -2.85 -1.26 -4.36 119.74 119.75 3dgv s LYS 54 Ca 0.05 1.44 -0.30 0.00 -1.00 0.00 0.00 55.97 56.16 3dgv s LYS 54 Cb -0.05 -3.66 -0.07 0.00 -2.06 0.00 0.00 37.83 31.99 3dgv s LYS 54 CO -0.10 -0.63 1.06 0.15 0.10 0.00 0.00 175.35 175.94 3dgv s LYS 55 N 3.18 4.61 -0.29 1.78 1.02 -1.26 -5.00 119.74 123.77 3dgv s LYS 55 Ca 0.47 1.63 -0.23 0.00 0.02 0.00 0.00 55.97 57.86 3dgv s LYS 55 Cb -0.17 -3.32 0.17 0.00 -0.52 0.00 0.00 37.83 33.99 3dgv s LYS 55 CO 0.09 0.08 1.28 -1.83 -0.92 0.00 0.00 175.35 174.05 3dgv s GLU 56 N -0.06 0.20 0.00 1.68 -1.05 -1.26 -5.12 118.70 113.08 3dgv s GLU 56 Ca 0.50 0.25 0.00 0.00 -0.15 0.00 0.00 54.97 55.57 3dgv s GLU 56 Cb -0.27 0.09 0.00 0.00 -0.44 0.00 0.00 34.13 33.50 3dgv s GLU 56 CO 0.33 -0.03 0.00 0.00 0.95 0.00 0.00 175.26 176.51 3dgv n GLN 57 N 2.08 0.00 0.00 -4.83 -0.00 -1.26 -4.80 117.38 108.58 3dgv n GLN 57 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.88 3dgv n GLN 57 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.81 3dgv n GLN 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3dgv n ARG 57 N 8.53 0.50 0.00 2.61 1.74 -1.26 -5.09 116.66 123.70 3dgv n ARG 57 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3dgv n ARG 57 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 3dgv n ARG 57 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dgv n ALA 58 N -3.00 0.00 -2.36 7.54 0.00 -1.26 -5.00 120.51 116.42 3dgv n ALA 58 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 3dgv n ALA 58 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 3dgv n ALA 58 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3dgv n LYS 59 N 13.88 -4.89 -2.02 0.00 4.01 -1.26 -5.01 118.16 122.87 3dgv n LYS 59 Ca 0.00 3.59 -0.29 0.00 -0.51 0.00 0.00 58.31 61.10 3dgv n LYS 59 Cb 0.00 -4.67 0.03 0.00 -0.51 0.00 0.00 35.03 29.88 3dgv n LYS 59 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 3dgv s ASN 60 N -0.59 5.70 0.06 4.39 0.01 -1.26 -4.69 114.94 118.55 3dgv s ASN 60 Ca -0.07 1.10 0.08 0.00 -0.71 0.00 0.00 52.86 53.26 3dgv s ASN 60 Cb 0.00 -2.02 -0.03 0.00 0.41 0.00 0.00 41.25 39.61 3dgv s ASN 60 CO 0.19 -1.14 -0.22 0.00 -1.51 0.00 0.00 177.10 174.43 3dgv s ALA 61 N -3.21 1.86 -0.10 0.60 0.00 -0.25 -0.49 121.76 120.16 3dgv s ALA 61 Ca 0.56 -1.14 -0.03 0.00 0.00 0.00 0.00 51.96 51.35 3dgv s ALA 61 Cb -0.11 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 3dgv s ALA 61 CO 0.51 0.41 0.02 1.41 0.00 0.00 0.00 175.76 178.11 3dgv s MET 62 N -1.36 3.18 -0.15 0.00 1.75 -0.23 -1.15 119.30 121.34 3dgv s MET 62 Ca 0.08 -0.38 -0.11 0.00 -1.25 0.00 0.00 55.69 54.03 3dgv s MET 62 Cb -0.09 -2.89 -0.05 0.00 2.84 0.00 0.00 34.83 34.64 3dgv s MET 62 CO 0.02 0.64 0.22 -0.46 -0.65 0.00 0.00 175.02 174.79 3dgv s TRP 63 N -0.70 3.49 -0.12 4.11 -0.11 -0.54 -1.09 118.94 123.98 3dgv s TRP 63 Ca 0.11 0.52 -0.01 0.00 1.22 0.00 0.00 56.10 57.95 3dgv s TRP 63 Cb -0.12 -2.20 0.03 0.00 -1.50 0.00 0.00 33.47 29.69 3dgv s TRP 63 CO 0.02 0.39 -0.05 0.42 -4.62 0.00 0.00 176.95 173.11 3dgv s ILE 64 N 0.01 0.90 0.16 5.86 1.01 0.33 -1.29 121.20 128.17 3dgv s ILE 64 Ca 0.14 -0.29 0.07 0.00 0.00 0.00 0.00 60.65 60.57 3dgv s ILE 64 Cb -0.12 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 3dgv s ILE 64 CO 0.03 0.27 -0.01 1.51 0.00 0.00 0.00 174.94 176.74 3dgv s ASP 65 N 1.75 4.78 0.10 3.58 1.47 -1.00 -1.05 116.67 126.30 3dgv s ASP 65 Ca 0.04 -0.37 0.03 0.00 1.18 0.00 0.00 52.55 53.43 3dgv s ASP 65 Cb -0.13 -1.03 -0.04 0.00 -0.34 0.00 0.00 42.92 41.38 3dgv s ASP 65 CO -0.08 0.10 -0.09 0.00 0.68 0.00 0.00 175.17 175.79 3dgv n GLY 67 N 0.33 0.41 0.33 0.00 0.00 -1.26 -1.91 105.19 103.09 3dgv n GLY 67 Ca -0.14 -0.73 -0.04 0.00 0.00 0.00 0.00 46.02 45.10 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 1.25 -3.44 -0.61 2.04 -1.90 -1.24 117.51 113.60 3dgv h ILE 68 Ca -0.12 -0.77 -0.64 0.00 1.00 0.00 0.00 64.86 64.32 3dgv h ILE 68 Cb 0.79 0.37 -0.23 0.00 -0.74 0.00 0.00 36.82 37.01 3dgv h ILE 68 CO 0.15 0.31 -0.66 -1.00 0.00 0.00 0.00 178.15 176.96 3dgv s HIS 69 N -5.50 3.04 0.28 1.37 3.76 -1.26 -4.53 115.29 112.45 3dgv s HIS 69 Ca -0.12 -0.47 -0.01 0.00 -0.15 0.00 0.00 55.06 54.31 3dgv s HIS 69 Cb 0.16 -2.10 0.46 0.00 1.11 0.00 0.00 32.58 32.21 3dgv s HIS 69 CO 0.82 -0.26 1.89 0.00 -0.85 0.00 0.00 174.74 176.34 3dgv h ALA 70 N 7.57 1.44 -0.00 -1.40 0.00 -1.65 -2.63 119.26 122.60 3dgv h ALA 70 Ca -0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3dgv h ALA 70 Cb 1.18 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3dgv h ALA 70 CO 0.61 0.40 -0.12 2.89 0.00 0.00 0.00 179.25 183.03 3dgv n ARG 71 N -4.50 0.32 -1.79 0.00 1.85 -0.91 -4.33 116.66 107.29 3dgv n ARG 71 Ca 0.15 -0.08 -0.41 0.00 -1.00 0.00 0.00 57.85 56.51 3dgv n ARG 71 Cb 0.20 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 30.10 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 -1.27 3.54 -0.10 2.89 1.02 -0.99 -4.75 120.64 120.98 3dgv n GLU 72 Ca 0.11 -2.84 0.22 0.00 -0.02 0.00 0.00 57.16 54.63 3dgv n GLU 72 Cb 0.30 -2.97 0.65 0.00 -0.02 0.00 0.00 31.44 29.40 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 5.44 0.12 0.00 -0.32 4.06 -1.82 0.48 115.95 123.92 3dgv h TRP 73 Ca 0.64 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.59 3dgv h TRP 73 Cb 0.49 -0.04 -0.00 0.00 -1.00 0.00 0.00 29.16 28.61 3dgv h TRP 73 CO 1.55 0.04 -0.01 0.97 -3.56 0.00 0.00 178.44 177.43 3dgv h ILE 74 N 0.10 0.74 -0.02 1.49 6.09 -1.88 -2.83 117.51 121.20 3dgv h ILE 74 Ca 0.34 -0.04 -0.03 0.00 -1.37 0.00 0.00 64.86 63.76 3dgv h ILE 74 Cb 1.19 1.02 0.00 0.00 0.47 0.00 0.00 36.82 39.51 3dgv h ILE 74 CO -0.04 0.01 -0.09 -1.28 -3.07 0.00 0.00 178.15 173.69 3dgv h SER 75 N 0.00 0.12 -0.21 2.19 0.87 -1.21 -2.63 113.55 112.69 3dgv h SER 75 Ca -0.00 -0.64 -0.02 0.00 -1.23 0.00 0.00 61.79 59.90 3dgv h SER 75 Cb 0.02 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 3dgv h SER 75 CO 0.00 0.74 0.07 -0.65 -0.53 0.00 0.00 176.83 176.45 3dgv h PRO 76 N -0.49 0.40 0.00 2.24 0.11 -1.65 -2.15 132.00 130.45 3dgv h PRO 76 Ca -0.00 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 3dgv h PRO 76 Cb 0.73 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.76 3dgv h PRO 76 CO 0.02 0.37 -0.07 0.00 -0.21 0.00 0.00 178.00 178.11 3dgv h ALA 77 N 1.69 1.57 -0.09 -0.75 0.00 -1.35 -2.39 119.26 117.95 3dgv h ALA 77 Ca 0.10 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3dgv h ALA 77 Cb 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3dgv h ALA 77 CO -0.00 0.09 -0.25 0.35 0.00 0.00 0.00 179.25 179.44 3dgv h PHE 78 N 0.00 0.41 -0.88 0.00 3.57 -1.01 -2.37 116.94 116.66 3dgv h PHE 78 Ca -0.00 -0.16 0.04 0.00 3.53 0.00 0.00 57.97 61.38 3dgv h PHE 78 Cb 0.16 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 3dgv h PHE 78 CO 0.00 0.86 0.56 0.00 -2.23 0.00 0.00 178.31 177.50 3dgv h LEU 80 N 1.08 1.06 -0.81 0.00 4.07 -1.50 -1.99 115.31 117.23 3dgv h LEU 80 Ca 0.36 -0.19 -0.06 0.00 0.08 0.00 0.00 57.88 58.07 3dgv h LEU 80 Cb 0.04 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 41.48 3dgv h LEU 80 CO -0.13 0.97 0.18 -0.25 -1.08 0.00 0.00 178.44 178.13 3dgv h TRP 81 N 1.10 1.11 0.78 1.13 2.91 -0.42 0.33 115.95 122.90 3dgv h TRP 81 Ca 0.24 -0.12 -0.04 0.00 1.13 0.00 0.00 58.89 60.10 3dgv h TRP 81 Cb 0.28 -0.32 0.01 0.00 -0.51 0.00 0.00 29.16 28.62 3dgv h TRP 81 CO 0.02 0.90 -0.37 0.35 -1.03 0.00 0.00 178.44 178.31 3dgv h PHE 82 N 1.02 -0.97 -0.70 2.65 3.57 0.19 -0.88 116.94 121.81 3dgv h PHE 82 Ca 0.22 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.75 3dgv h PHE 82 Cb 0.34 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 39.35 3dgv h PHE 82 CO 0.03 -0.60 0.40 0.28 -2.23 0.00 0.00 178.31 176.19 3dgv h VAL 83 N -1.28 1.00 -0.10 1.41 2.07 -1.36 -0.60 116.25 117.39 3dgv h VAL 83 Ca -0.11 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 3dgv h VAL 83 Cb 0.80 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 3dgv h VAL 83 CO 0.18 0.14 -0.08 1.23 0.02 0.00 0.00 177.57 179.05 3dgv h GLY 84 N 0.75 0.16 0.28 2.17 0.00 -0.91 -2.67 103.07 102.84 3dgv h GLY 84 Ca 0.31 -0.08 -0.23 0.00 0.00 0.00 0.00 47.33 47.32 3dgv h GLY 84 CO -0.17 0.08 -1.24 1.76 0.00 0.00 0.00 176.54 176.97 3dgv h SER 85 N 0.15 0.19 0.47 0.19 0.02 0.34 -3.17 113.55 111.74 3dgv h SER 85 Ca 0.03 -0.75 -0.11 0.00 -0.84 0.00 0.00 61.79 60.13 3dgv h SER 85 Cb 0.24 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 3dgv h SER 85 CO 0.01 1.52 -0.50 -0.37 -1.14 0.00 0.00 176.83 176.35 3dgv h VAL 86 N -0.62 1.36 -0.30 2.27 -1.51 -1.41 -0.94 116.25 115.10 3dgv h VAL 86 Ca -0.30 -1.72 -0.07 0.00 -1.23 0.00 0.00 66.70 63.38 3dgv h VAL 86 Cb 1.52 1.91 -0.02 0.00 -2.13 0.00 0.00 31.29 32.57 3dgv h VAL 86 CO -0.05 0.49 -0.11 0.00 -1.23 0.00 0.00 177.57 176.68 3dgv h THR 87 N 0.03 1.23 0.00 7.19 1.03 -1.59 -2.14 112.91 118.65 3dgv h THR 87 Ca -0.00 -0.98 -0.36 0.00 -0.01 0.00 0.00 66.41 65.05 3dgv h THR 87 Cb 0.90 1.12 -0.07 0.00 -1.07 0.00 0.00 68.15 69.02 3dgv h THR 87 CO 0.07 0.32 -2.36 0.00 -0.01 0.00 0.00 175.52 173.54 3dgv n TYR 88 N -4.21 0.00 0.93 0.00 9.36 -1.10 -4.40 117.16 117.74 3dgv n TYR 88 Ca 0.01 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.35 3dgv n TYR 88 Cb 0.31 -0.97 0.16 0.00 -0.63 0.00 0.00 39.34 38.22 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 -2.84 0.09 -1.86 2.98 4.02 -0.38 -4.79 117.16 114.38 3dgv n TYR 89 Ca -0.35 -0.04 -0.42 0.00 -0.01 0.00 0.00 57.90 57.08 3dgv n TYR 89 Cb 1.10 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 40.39 3dgv n TYR 89 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 3dgv s TYR 90 N -1.91 2.97 0.00 -0.72 5.04 -0.81 -0.44 117.35 121.48 3dgv s TYR 90 Ca 0.31 0.62 0.00 0.00 -2.44 0.00 0.00 57.07 55.56 3dgv s TYR 90 Cb 0.21 -4.00 0.00 0.00 0.35 0.00 0.00 41.96 38.52 3dgv s TYR 90 CO 0.31 -3.61 0.00 0.41 -1.34 0.00 0.00 175.55 171.32 3dgv n GLY 91 N 3.38 0.52 0.00 8.97 0.00 -1.26 -4.75 105.19 112.05 3dgv n GLY 91 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.09 3.01 -3.80 1.61 5.02 0.21 -5.07 118.16 117.05 3dgv n LYS 92 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 3dgv n LYS 92 Cb 0.07 -0.64 -0.15 0.00 -0.02 0.00 0.00 35.03 34.29 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 -1.05 -0.02 0.19 1.97 0.41 0.42 -5.05 118.70 115.57 3dgv s GLU 93 Ca 0.00 0.14 -0.13 0.00 -0.41 0.00 0.00 54.97 54.57 3dgv s GLU 93 Cb 0.00 -0.16 0.19 0.00 -1.78 0.00 0.00 34.13 32.39 3dgv s GLU 93 CO 0.00 -0.11 1.72 -0.22 -0.49 0.00 0.00 175.26 176.16 3dgv h LYS 94 N 6.88 0.24 -0.00 1.61 3.64 -1.97 -0.27 116.57 126.70 3dgv h LYS 94 Ca -0.38 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 58.98 3dgv h LYS 94 Cb 1.15 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 3dgv h LYS 94 CO 0.49 0.16 -0.00 1.98 -2.27 0.00 0.00 179.45 179.81 3dgv h MET 95 N 0.25 0.00 -0.30 1.90 4.05 -1.96 -1.80 114.93 117.06 3dgv h MET 95 Ca 0.25 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.65 3dgv h MET 95 Cb 0.33 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.11 3dgv h MET 95 CO -0.32 0.39 0.12 0.45 0.23 0.00 0.00 176.91 177.78 3dgv h HIS 96 N -0.39 0.41 -0.02 1.39 3.86 -1.81 -1.95 115.15 116.64 3dgv h HIS 96 Ca 0.00 -0.01 -0.26 0.00 -1.16 0.00 0.00 60.37 58.94 3dgv h HIS 96 Cb 0.39 -0.13 0.02 0.00 1.06 0.00 0.00 27.41 28.75 3dgv h HIS 96 CO 0.06 0.33 -1.00 1.15 0.86 0.00 0.00 177.93 179.33 3dgv h THR 97 N 0.42 1.28 0.00 2.45 2.02 -0.86 -3.18 112.91 115.04 3dgv h THR 97 Ca 0.11 -2.21 -0.11 0.00 0.77 0.00 0.00 66.41 64.97 3dgv h THR 97 Cb 0.09 2.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.80 3dgv h THR 97 CO -0.01 0.69 -0.52 0.78 0.37 0.00 0.00 175.52 176.82 3dgv h ASN 98 N 0.42 0.00 -0.19 4.18 2.35 -1.15 -0.37 115.58 120.81 3dgv h ASN 98 Ca -0.12 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.67 3dgv h ASN 98 Cb 1.65 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.95 3dgv h ASN 98 CO 0.20 0.52 -0.53 -0.07 -1.65 0.00 0.00 177.43 175.90 3dgv h LEU 99 N 0.00 -1.69 -0.42 1.61 3.38 -1.34 0.33 115.31 117.18 3dgv h LEU 99 Ca -0.01 0.21 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 3dgv h LEU 99 Cb 0.96 0.67 -0.01 0.00 0.09 0.00 0.00 40.66 42.37 3dgv h LEU 99 CO 0.07 -0.45 -0.29 -0.07 0.09 0.00 0.00 178.44 177.80 3dgv h LEU 100 N -0.52 0.00 -0.29 1.67 3.38 -1.52 -1.93 115.31 116.10 3dgv h LEU 100 Ca 0.04 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 3dgv h LEU 100 Cb 0.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3dgv h LEU 100 CO -0.46 0.29 -0.05 0.50 0.09 0.00 0.00 178.44 178.81 3dgv h LYS 101 N 0.00 0.55 -0.27 1.13 3.64 -0.80 -3.27 116.57 117.54 3dgv h LYS 101 Ca -0.00 -0.20 -0.06 0.00 -1.27 0.00 0.00 60.65 59.12 3dgv h LYS 101 Cb 1.06 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 3dgv h LYS 101 CO 0.04 0.73 -0.07 0.45 -2.27 0.00 0.00 179.45 178.33 3dgv h HIS 102 N 0.31 0.60 -3.68 1.91 3.86 -0.14 -3.48 115.15 114.53 3dgv h HIS 102 Ca 0.08 -0.13 -0.08 0.00 -1.16 0.00 0.00 60.37 59.07 3dgv h HIS 102 Cb 0.52 -0.15 -0.14 0.00 1.06 0.00 0.00 27.41 28.70 3dgv h HIS 102 CO 0.05 0.73 -0.32 -1.64 0.86 0.00 0.00 177.93 177.61 3dgv s MET 103 N -4.77 0.86 0.42 2.45 -1.94 -0.74 -4.45 119.30 111.13 3dgv s MET 103 Ca -0.13 -0.85 -0.12 0.00 -1.71 0.00 0.00 55.69 52.88 3dgv s MET 103 Cb 0.08 0.36 -0.07 0.00 2.01 0.00 0.00 34.83 37.21 3dgv s MET 103 CO 0.77 -0.28 0.82 -0.51 -0.01 0.00 0.00 175.02 175.81 3dgv s ASP 104 N -2.70 6.56 -0.08 3.03 1.01 0.35 -4.26 116.67 120.57 3dgv s ASP 104 Ca 0.03 1.24 0.03 0.00 0.71 0.00 0.00 52.55 54.55 3dgv s ASP 104 Cb 0.03 -2.37 0.01 0.00 1.01 0.00 0.00 42.92 41.60 3dgv s ASP 104 CO -0.10 -0.43 -0.17 -0.36 0.21 0.00 0.00 175.17 174.33 3dgv s PHE 105 N -2.41 1.89 -0.32 4.23 0.08 0.18 -1.06 117.98 120.57 3dgv s PHE 105 Ca 0.53 -0.75 -0.14 0.00 0.12 0.00 0.00 56.93 56.69 3dgv s PHE 105 Cb -0.10 -1.33 -0.02 0.00 -0.57 0.00 0.00 43.02 41.00 3dgv s PHE 105 CO 0.30 -0.34 0.30 0.71 -0.10 0.00 0.00 175.22 176.09 3dgv s TYR 106 N 0.58 3.22 -0.20 0.36 2.02 -0.25 0.96 117.35 124.03 3dgv s TYR 106 Ca -0.15 -0.00 -0.01 0.00 -0.37 0.00 0.00 57.07 56.54 3dgv s TYR 106 Cb -0.16 -2.55 0.01 0.00 -0.40 0.00 0.00 41.96 38.86 3dgv s TYR 106 CO 0.05 -0.34 -0.14 0.42 -1.57 0.00 0.00 175.55 173.98 3dgv s ILE 107 N 1.89 2.51 -0.44 2.71 -1.09 0.26 -0.51 121.20 126.53 3dgv s ILE 107 Ca 0.10 -0.86 -0.06 0.00 -2.23 0.00 0.00 60.65 57.60 3dgv s ILE 107 Cb -0.17 -2.13 0.12 0.00 -1.58 0.00 0.00 42.46 38.70 3dgv s ILE 107 CO 0.11 0.45 0.28 -0.32 -1.23 0.00 0.00 174.94 174.23 3dgv s MET 108 N 1.34 2.26 0.39 2.79 -2.45 -0.21 -0.89 119.30 122.53 3dgv s MET 108 Ca 0.04 -1.79 0.10 0.00 -1.25 0.00 0.00 55.69 52.78 3dgv s MET 108 Cb -0.14 -3.77 0.81 0.00 1.25 0.00 0.00 34.83 32.98 3dgv s MET 108 CO -0.09 -1.14 1.93 -1.35 1.05 0.00 0.00 175.02 175.42 3dgv h PRO 109 N 8.26 0.25 -2.76 4.11 0.11 -1.83 -0.82 132.00 139.32 3dgv h PRO 109 Ca -0.17 -0.05 -0.21 0.00 0.11 0.00 0.00 66.00 65.68 3dgv h PRO 109 Cb 1.06 -0.04 -0.32 0.00 0.11 0.00 0.00 31.00 31.81 3dgv h PRO 109 CO 0.79 0.36 -0.52 0.08 -0.21 0.00 0.00 178.00 178.50 3dgv s VAL 110 N -4.79 -0.44 -0.18 3.15 1.01 -1.24 -4.23 120.40 113.68 3dgv s VAL 110 Ca -0.06 0.23 -0.19 0.00 0.00 0.00 0.00 61.98 61.96 3dgv s VAL 110 Cb 0.16 -0.50 -0.21 0.00 0.00 0.00 0.00 36.38 35.83 3dgv s VAL 110 CO 0.73 0.08 0.28 0.58 0.00 0.00 0.00 175.10 176.77 3dgv h VAL 111 N 6.27 0.90 -2.04 2.92 2.07 -1.40 -3.41 116.25 121.56 3dgv h VAL 111 Ca -0.15 -2.23 -0.78 0.00 0.82 0.00 0.00 66.70 64.36 3dgv h VAL 111 Cb 1.12 2.34 -0.21 0.00 -1.52 0.00 0.00 31.29 33.02 3dgv h VAL 111 CO 0.15 0.46 1.49 -3.20 0.02 0.00 0.00 177.57 176.48 3dgv n ASN 112 N -4.23 6.28 -0.28 0.57 5.15 -0.47 -4.81 115.26 117.48 3dgv n ASN 112 Ca -0.31 -3.30 -0.03 0.00 -0.60 0.00 0.00 54.58 50.33 3dgv n ASN 112 Cb 0.76 -1.34 0.12 0.00 -0.53 0.00 0.00 39.78 38.79 3dgv n ASN 112 CO 0.00 0.00 0.00 -0.37 1.40 0.00 0.00 177.26 178.29 3dgv h VAL 113 N 3.28 1.25 -0.07 3.44 -1.51 -1.84 0.18 116.25 120.97 3dgv h VAL 113 Ca 0.38 -0.66 -0.00 0.00 -1.23 0.00 0.00 66.70 65.18 3dgv h VAL 113 Cb 0.54 0.19 -0.00 0.00 -2.13 0.00 0.00 31.29 29.89 3dgv h VAL 113 CO 1.44 0.29 0.03 0.44 -1.23 0.00 0.00 177.57 178.55 3dgv h ASP 114 N 1.14 0.10 -0.56 4.19 3.32 -1.96 -1.28 116.42 121.37 3dgv h ASP 114 Ca 0.28 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 57.09 3dgv h ASP 114 Cb 0.08 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 3dgv h ASP 114 CO -0.04 0.21 -0.08 1.23 -1.72 0.00 0.00 179.24 178.84 3dgv h GLY 115 N -0.01 1.13 0.89 2.75 0.00 -1.72 -0.96 103.07 105.15 3dgv h GLY 115 Ca 0.03 -0.89 0.02 0.00 0.00 0.00 0.00 47.33 46.49 3dgv h GLY 115 CO -0.00 0.82 0.34 -1.82 0.00 0.00 0.00 176.54 175.87 3dgv h TYR 116 N 0.93 0.63 -0.19 5.60 3.20 -0.88 -1.07 116.97 125.19 3dgv h TYR 116 Ca 0.15 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.92 3dgv h TYR 116 Cb 0.65 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 3dgv h TYR 116 CO 0.05 0.37 -0.40 0.22 -1.64 0.00 0.00 178.16 176.75 3dgv h ASP 117 N 0.67 0.46 -0.34 -2.11 3.58 -1.06 -2.45 116.42 115.18 3dgv h ASP 117 Ca 0.22 -0.20 0.03 0.00 0.42 0.00 0.00 57.03 57.50 3dgv h ASP 117 Cb 0.01 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 3dgv h ASP 117 CO -0.09 0.82 0.22 0.22 -2.88 0.00 0.00 179.24 177.53 3dgv h TYR 118 N 0.36 0.33 0.00 0.28 3.20 -0.28 -2.29 116.97 118.57 3dgv h TYR 118 Ca 0.03 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 3dgv h TYR 118 Cb 0.87 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.01 3dgv h TYR 118 CO 0.03 0.20 -0.53 1.79 -1.64 0.00 0.00 178.16 178.01 3dgv h THR 119 N 0.35 0.99 -0.01 1.81 1.35 -0.73 0.81 112.91 117.47 3dgv h THR 119 Ca 0.14 -2.13 -0.20 0.00 -0.55 0.00 0.00 66.41 63.66 3dgv h THR 119 Cb 0.12 2.30 -0.01 0.00 -1.73 0.00 0.00 68.15 68.83 3dgv h THR 119 CO -0.03 0.52 -0.87 -0.50 -0.25 0.00 0.00 175.52 174.39 3dgv h TRP 120 N 0.00 0.45 0.00 4.73 4.06 -1.34 -3.20 115.95 120.65 3dgv h TRP 120 Ca -0.01 -0.24 -0.14 0.00 2.06 0.00 0.00 58.89 60.57 3dgv h TRP 120 Cb 1.26 -0.06 -0.03 0.00 -1.00 0.00 0.00 29.16 29.34 3dgv h TRP 120 CO 0.00 1.04 -1.70 1.63 -3.56 0.00 0.00 178.44 175.84 3dgv n LYS 121 N -3.73 1.60 0.00 0.49 5.02 -0.92 -4.91 118.16 115.71 3dgv n LYS 121 Ca -0.05 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 3dgv n LYS 121 Cb 0.79 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.51 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 -2.26 0.00 -3.54 1.97 4.76 0.10 -5.05 118.16 114.13 3dgv n LYS 122 Ca -0.13 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.05 3dgv n LYS 122 Cb 0.69 -0.50 -0.15 0.00 -1.84 0.00 0.00 35.03 33.24 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 -4.58 2.86 0.36 4.39 -1.08 -0.16 -4.96 116.67 113.50 3dgv s ASP 123 Ca 0.00 -0.97 0.26 0.00 -0.52 0.00 0.00 52.55 51.32 3dgv s ASP 123 Cb 0.00 -0.17 1.24 0.00 -1.46 0.00 0.00 42.92 42.53 3dgv s ASP 123 CO 0.00 -0.40 1.80 -0.09 0.52 0.00 0.00 175.17 176.99 3dgv h ARG 124 N 8.39 0.00 -0.42 4.34 9.65 -1.79 -3.14 114.38 131.41 3dgv h ARG 124 Ca -0.18 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.70 3dgv h ARG 124 Cb 1.07 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.64 3dgv h ARG 124 CO 0.38 0.00 0.00 -1.33 2.80 0.00 0.00 179.97 181.82 3dgv n MET 125 N -2.44 3.91 -3.42 0.20 2.81 -1.26 -4.73 117.12 112.19 3dgv n MET 125 Ca 0.00 -3.01 -0.30 0.00 -1.81 0.00 0.00 57.70 52.58 3dgv n MET 125 Cb 0.16 -2.06 -0.04 0.00 -0.71 0.00 0.00 33.22 30.56 3dgv n MET 125 CO 0.00 0.00 0.00 -0.46 1.51 0.00 0.00 175.97 177.02 3dgv s TRP 126 N -2.81 3.46 0.00 2.03 -0.11 -1.19 -4.96 118.94 115.36 3dgv s TRP 126 Ca 0.49 0.68 0.00 0.00 1.22 0.00 0.00 56.10 58.49 3dgv s TRP 126 Cb 0.38 -2.12 0.00 0.00 -1.50 0.00 0.00 33.47 30.23 3dgv s TRP 126 CO 0.12 0.24 0.00 -2.13 -4.62 0.00 0.00 176.95 170.56 3dgv n ARG 127 N -0.57 1.16 -2.42 5.86 0.63 -1.26 -2.14 116.66 117.93 3dgv n ARG 127 Ca -0.01 0.00 -0.25 0.00 -0.92 0.00 0.00 57.85 56.67 3dgv n ARG 127 Cb 0.53 -0.74 0.13 0.00 0.45 0.00 0.00 32.46 32.84 3dgv n ARG 127 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 3dgv s LYS 128 N -1.47 1.39 0.00 -0.14 1.02 -1.26 -2.51 119.74 116.77 3dgv s LYS 128 Ca 0.00 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.04 3dgv s LYS 128 Cb 0.00 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.11 3dgv s LYS 128 CO 0.00 -1.72 0.00 0.27 -0.92 0.00 0.00 175.35 172.98 3dgv n ASN 129 N -3.08 0.00 -1.16 2.83 6.94 -0.31 -4.37 115.26 116.11 3dgv n ASN 129 Ca 0.15 0.00 0.05 0.00 -0.02 0.00 0.00 54.58 54.76 3dgv n ASN 129 Cb 0.60 0.00 0.09 0.00 -2.36 0.00 0.00 39.78 38.12 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 0.00 0.64 -1.71 -3.83 5.12 -1.26 -4.38 116.66 111.24 3dgv n ARG 130 Ca 0.00 -2.52 -0.31 0.00 -1.93 0.00 0.00 57.85 53.09 3dgv n ARG 130 Cb 0.00 -0.64 0.03 0.00 -1.16 0.00 0.00 32.46 30.69 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 -2.50 5.78 -0.09 0.55 1.04 -1.26 -4.78 113.70 112.44 3dgv s SER 131 Ca 0.36 1.53 0.02 0.00 0.48 0.00 0.00 55.95 58.33 3dgv s SER 131 Cb 0.38 -2.48 0.01 0.00 0.10 0.00 0.00 66.02 64.03 3dgv s SER 131 CO -0.13 -1.18 -0.14 -0.22 0.98 0.00 0.00 173.24 172.55 3dgv s LEU 132 N -5.37 1.69 0.12 2.42 2.96 -1.26 -1.75 118.68 117.48 3dgv s LEU 132 Ca 0.57 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 54.12 3dgv s LEU 132 Cb -0.13 -1.00 -0.04 0.00 0.50 0.00 0.00 46.19 45.53 3dgv s LEU 132 CO 0.54 0.03 0.19 -1.00 -1.32 0.00 0.00 176.35 174.79 3dgv s HIS 133 N 0.85 3.35 0.14 5.38 3.76 -1.26 -5.05 115.29 122.46 3dgv s HIS 133 Ca -0.10 0.11 -0.31 0.00 -0.15 0.00 0.00 55.06 54.60 3dgv s HIS 133 Cb -0.15 -1.64 -0.11 0.00 1.11 0.00 0.00 32.58 31.79 3dgv s HIS 133 CO 0.01 0.54 1.83 -2.00 -0.85 0.00 0.00 174.74 174.26 3dgv s GLU 134 N -2.85 4.13 0.00 1.40 2.12 -1.26 -2.27 118.70 119.97 3dgv s GLU 134 Ca 0.33 2.62 0.00 0.00 0.36 0.00 0.00 54.97 58.28 3dgv s GLU 134 Cb -0.11 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.77 3dgv s GLU 134 CO 0.26 -0.84 0.00 1.63 -0.54 0.00 0.00 175.26 175.77 3dgv n LYS 135 N 5.40 -0.01 -2.72 4.30 4.76 -1.26 -5.01 118.16 123.62 3dgv n LYS 135 Ca 0.18 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.21 3dgv n LYS 135 Cb 0.37 -2.67 -0.04 0.00 -1.84 0.00 0.00 35.03 30.85 3dgv n LYS 135 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3dgv s ASN 136 N -2.71 7.49 0.31 4.39 0.01 -0.96 -4.96 114.94 118.51 3dgv s ASN 136 Ca 0.00 1.80 0.14 0.00 -0.71 0.00 0.00 52.86 54.08 3dgv s ASN 136 Cb 0.00 -2.59 0.44 0.00 0.41 0.00 0.00 41.25 39.52 3dgv s ASN 136 CO 0.00 -0.07 1.64 0.00 -1.51 0.00 0.00 177.10 177.16 3dgv h ALA 137 N 5.59 0.95 -2.12 0.60 0.00 -1.95 -3.47 119.26 118.85 3dgv h ALA 137 Ca -0.43 -0.49 -0.50 0.00 0.00 0.00 0.00 54.91 53.49 3dgv h ALA 137 Cb 1.21 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.77 3dgv h ALA 137 CO 0.72 0.67 -0.70 0.00 0.00 0.00 0.00 179.25 179.94 3dgv s VAL 139 N -2.93 5.23 0.00 0.00 1.01 -1.26 -4.76 120.40 117.69 3dgv s VAL 139 Ca 0.28 0.80 0.00 0.00 0.00 0.00 0.00 61.98 63.06 3dgv s VAL 139 Cb 0.02 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.65 3dgv s VAL 139 CO 0.11 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.17 3dgv n GLY 140 N 3.32 2.92 3.57 4.51 0.00 -0.72 -4.94 105.19 113.86 3dgv n GLY 140 Ca -0.09 -1.51 -0.31 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 -0.82 3.42 -0.51 2.61 2.01 -1.26 -4.81 115.64 116.27 3dgv s THR 141 Ca 0.00 -1.10 -0.28 0.00 0.31 0.00 0.00 61.69 60.62 3dgv s THR 141 Cb 0.00 -2.55 0.02 0.00 0.01 0.00 0.00 72.50 69.98 3dgv s THR 141 CO 0.00 0.22 1.31 -0.62 -0.69 0.00 0.00 174.62 174.84 3dgv s ASP 142 N -1.89 6.36 0.56 3.53 -1.08 -0.27 -1.16 116.67 122.73 3dgv s ASP 142 Ca 0.20 0.44 0.26 0.00 -0.52 0.00 0.00 52.55 52.92 3dgv s ASP 142 Cb -0.11 -2.55 1.64 0.00 -1.46 0.00 0.00 42.92 40.44 3dgv s ASP 142 CO 0.11 -1.49 2.20 -0.07 0.52 0.00 0.00 175.17 176.44 3dgv h LEU 143 N 12.22 0.00 -0.19 -1.34 3.38 -1.86 0.49 115.31 128.01 3dgv h LEU 143 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3dgv h LEU 143 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3dgv h LEU 143 CO 1.14 0.02 0.00 -3.20 0.09 0.00 0.00 178.44 176.50 3dgv n ASN 144 N -3.98 0.28 0.00 -0.43 5.15 -1.26 -2.39 115.26 112.64 3dgv n ASN 144 Ca -0.03 -1.67 0.00 0.00 -0.60 0.00 0.00 54.58 52.28 3dgv n ASN 144 Cb 0.11 -0.02 0.00 0.00 -0.53 0.00 0.00 39.78 39.33 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 -0.51 1.96 0.00 1.20 5.12 0.16 -2.86 116.66 121.73 3dgv n ARG 145 Ca 0.10 -1.19 0.10 0.00 -1.93 0.00 0.00 57.85 54.92 3dgv n ARG 145 Cb 0.08 -0.93 0.03 0.00 -1.16 0.00 0.00 32.46 30.49 3dgv n ARG 145 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 3dgv n ASN 146 N -0.35 2.17 -4.84 0.55 4.05 -1.00 -4.37 115.26 111.46 3dgv n ASN 146 Ca 0.00 -1.59 -0.32 0.00 0.45 0.00 0.00 54.58 53.12 3dgv n ASN 146 Cb 0.24 0.29 -0.05 0.00 1.23 0.00 0.00 39.78 41.49 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 -2.00 3.39 -0.91 1.20 0.40 -0.04 0.26 117.98 120.27 3dgv s PHE 147 Ca 0.19 1.38 -0.08 0.00 -0.60 0.00 0.00 56.93 57.82 3dgv s PHE 147 Cb 0.16 -2.69 -0.14 0.00 0.51 0.00 0.00 43.02 40.86 3dgv s PHE 147 CO 0.40 -0.12 3.20 0.00 0.70 0.00 0.00 175.22 179.39 3dgv n ALA 148 N -0.91 7.02 -1.73 5.36 0.00 -1.26 -4.26 120.51 124.72 3dgv n ALA 148 Ca 0.05 -2.86 -0.29 0.00 0.00 0.00 0.00 53.44 50.34 3dgv n ALA 148 Cb 0.54 -2.87 0.17 0.00 0.00 0.00 0.00 19.45 17.28 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 1.93 3.12 0.52 0.00 1.04 -1.26 -4.88 113.70 114.18 3dgv s SER 149 Ca 0.68 0.55 -0.20 0.00 0.48 0.00 0.00 55.95 57.45 3dgv s SER 149 Cb 0.24 -0.80 -0.06 0.00 0.10 0.00 0.00 66.02 65.50 3dgv s SER 149 CO -0.04 -2.75 1.13 -0.75 0.98 0.00 0.00 173.24 171.80 3dgv s LYS 150 N -5.65 3.46 -1.14 4.02 2.20 -1.26 -3.60 119.74 117.77 3dgv s LYS 150 Ca 0.69 1.62 -0.00 0.00 -0.36 0.00 0.00 55.97 57.92 3dgv s LYS 150 Cb -0.08 -2.08 0.00 0.00 -1.51 0.00 0.00 37.83 34.16 3dgv s LYS 150 CO 0.53 -0.76 0.05 0.72 -0.36 0.00 0.00 175.35 175.52 3dgv n HIS 150 N -1.13 -0.72 -1.70 4.03 8.25 -1.26 -4.50 115.22 118.20 3dgv n HIS 150 Ca 0.11 0.04 -0.44 0.00 -0.26 0.00 0.00 57.72 57.17 3dgv n HIS 150 Cb 0.51 -2.97 -0.03 0.00 1.12 0.00 0.00 29.99 28.62 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 -4.02 2.44 -2.14 4.41 -0.00 -1.24 0.07 117.44 116.96 3dgv n TRP 151 Ca -0.15 0.30 -0.16 0.00 -0.00 0.00 0.00 57.50 57.50 3dgv n TRP 151 Cb 0.62 -2.54 -0.02 0.00 -0.00 0.00 0.00 31.31 29.36 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 -0.71 -0.77 3.72 0.00 0.00 0.11 -4.82 105.19 102.71 3dgv n GLY 153 Ca -0.18 -1.63 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.07 2.48 -0.11 1.61 2.13 -1.26 -2.13 120.64 123.29 3dgv n GLU 154 Ca 0.00 0.88 0.00 0.00 0.66 0.00 0.00 57.16 58.70 3dgv n GLU 154 Cb 0.00 -2.62 0.00 0.00 0.27 0.00 0.00 31.44 29.09 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 2.13 0.83 3.27 8.31 0.00 -1.26 -4.36 105.19 114.11 3dgv n GLY 155 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.07 -0.68 0.11 4.61 0.00 -0.90 -4.42 121.76 118.42 3dgv s ALA 156 Ca 0.00 -0.19 0.10 0.00 0.00 0.00 0.00 51.96 51.87 3dgv s ALA 156 Cb 0.00 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 3dgv s ALA 156 CO 0.00 -0.55 -0.24 0.45 0.00 0.00 0.00 175.76 175.42 3dgv s SER 157 N -2.64 3.49 0.00 0.00 0.15 -0.67 -4.75 113.70 109.28 3dgv s SER 157 Ca 0.02 -0.65 0.19 0.00 0.70 0.00 0.00 55.95 56.21 3dgv s SER 157 Cb 0.02 -0.35 0.36 0.00 -1.71 0.00 0.00 66.02 64.34 3dgv s SER 157 CO -0.10 0.20 1.29 -1.54 1.20 0.00 0.00 173.24 174.29 3dgv n SER 158 N 1.04 3.16 -4.67 5.45 3.41 -1.26 -1.18 113.62 119.57 3dgv n SER 158 Ca -0.17 -1.91 -0.37 0.00 -0.26 0.00 0.00 58.87 56.16 3dgv n SER 158 Cb 0.53 -0.21 -0.09 0.00 -0.26 0.00 0.00 64.21 64.18 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 -1.31 6.23 0.55 4.04 0.15 -1.26 -4.95 113.70 117.16 3dgv s SER 159 Ca 0.32 0.25 0.33 0.00 0.70 0.00 0.00 55.95 57.56 3dgv s SER 159 Cb 0.19 -2.14 1.53 0.00 -1.71 0.00 0.00 66.02 63.89 3dgv s SER 159 CO 0.26 0.04 2.06 0.77 1.20 0.00 0.00 173.24 177.57 3dgv h SER 160 N 7.36 0.00 0.20 5.45 4.64 -1.91 -1.46 113.55 127.83 3dgv h SER 160 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3dgv h SER 160 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3dgv h SER 160 CO 0.69 0.05 -0.06 0.00 -0.87 0.00 0.00 176.83 176.64 3dgv s SER 162 N -2.27 7.31 0.25 0.00 0.15 -0.55 -4.93 113.70 113.66 3dgv s SER 162 Ca 0.35 2.18 0.20 0.00 0.70 0.00 0.00 55.95 59.38 3dgv s SER 162 Cb 0.21 -2.62 0.97 0.00 -1.71 0.00 0.00 66.02 62.87 3dgv s SER 162 CO 0.42 -0.11 1.62 -0.62 1.20 0.00 0.00 173.24 175.76 3dgv n GLU 163 N 1.14 0.15 -1.06 5.44 -0.58 -1.26 -2.21 120.64 122.25 3dgv n GLU 163 Ca -0.01 0.51 -0.06 0.00 -0.42 0.00 0.00 57.16 57.19 3dgv n GLU 163 Cb 0.46 -1.86 0.15 0.00 -0.57 0.00 0.00 31.44 29.62 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 -2.15 2.41 -1.70 -3.67 -5.35 -1.26 -4.64 119.36 102.99 3dgv n ILE 164 Ca 0.00 -3.42 -0.44 0.00 -0.27 0.00 0.00 62.75 58.63 3dgv n ILE 164 Cb 0.12 -0.53 -0.03 0.00 -1.74 0.00 0.00 39.64 37.46 3dgv n ILE 164 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dgv n TYR 165 N -1.00 2.51 1.09 4.28 9.36 -0.94 -1.68 117.16 130.78 3dgv n TYR 165 Ca 0.30 0.28 0.12 0.00 3.32 0.00 0.00 57.90 61.92 3dgv n TYR 165 Cb 0.83 -2.56 0.14 0.00 -0.63 0.00 0.00 39.34 37.13 3dgv n TYR 165 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3dgv n GLY 167 N 1.36 -4.12 0.11 0.00 0.00 -1.26 -4.13 105.19 97.15 3dgv n GLY 167 Ca 0.12 -2.06 0.01 0.00 0.00 0.00 0.00 46.02 44.09 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 0.59 -2.38 2.61 1.35 -1.97 -3.48 112.91 109.62 3dgv h THR 168 Ca 0.00 -2.03 0.17 0.00 -0.55 0.00 0.00 66.41 64.01 3dgv h THR 168 Cb 0.00 2.12 -0.08 0.00 -1.73 0.00 0.00 68.15 68.46 3dgv h THR 168 CO 0.00 0.33 0.48 -0.72 -0.25 0.00 0.00 175.52 175.36 3dgv s TYR 169 N -2.95 -0.12 0.13 4.73 1.13 -1.26 -5.05 117.35 113.96 3dgv s TYR 169 Ca -0.01 -0.20 -0.31 0.00 -1.41 0.00 0.00 57.07 55.14 3dgv s TYR 169 Cb 0.08 0.65 -0.10 0.00 -1.10 0.00 0.00 41.96 41.49 3dgv s TYR 169 CO 0.79 -0.86 1.82 -2.14 -2.51 0.00 0.00 175.55 172.66 3dgv s PRO 170 N -3.26 4.14 -0.83 -3.49 0.02 -1.26 -1.36 135.00 128.96 3dgv s PRO 170 Ca 0.13 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.74 3dgv s PRO 170 Cb -0.02 -3.56 0.00 0.00 0.02 0.00 0.00 34.50 30.94 3dgv s PRO 170 CO 0.03 -0.84 0.00 0.39 -0.33 0.00 0.00 177.00 176.25 3dgv n GLU 171 N 5.57 -0.67 0.28 5.54 1.02 0.14 -4.89 120.64 127.63 3dgv n GLU 171 Ca 0.18 0.58 0.18 0.00 -0.02 0.00 0.00 57.16 58.08 3dgv n GLU 171 Cb 0.38 -4.53 0.80 0.00 -0.02 0.00 0.00 31.44 28.07 3dgv n GLU 171 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3dgv h SER 172 N 0.00 0.00 -3.10 1.62 4.64 -1.45 -3.39 113.55 111.87 3dgv h SER 172 Ca -0.20 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.52 3dgv h SER 172 Cb 0.93 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.95 3dgv h SER 172 CO 0.26 0.00 -0.23 -1.61 -0.87 0.00 0.00 176.83 174.37 3dgv s GLU 173 N -3.75 4.03 0.44 4.77 0.41 -1.26 -4.96 118.70 118.37 3dgv s GLU 173 Ca -0.00 0.32 0.14 0.00 -0.41 0.00 0.00 54.97 55.02 3dgv s GLU 173 Cb 0.10 -3.30 1.04 0.00 -1.78 0.00 0.00 34.13 30.19 3dgv s GLU 173 CO 0.49 0.51 1.98 -1.00 -0.49 0.00 0.00 175.26 176.75 3dgv h PRO 174 N 5.47 0.39 -0.33 0.39 0.13 -1.87 -0.96 132.00 135.22 3dgv h PRO 174 Ca -0.48 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 64.48 3dgv h PRO 174 Cb 1.20 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3dgv h PRO 174 CO 0.66 0.26 -0.36 0.93 -0.23 0.00 0.00 178.00 179.26 3dgv h GLU 175 N 0.40 0.82 -0.21 0.86 3.07 -1.91 -1.60 114.58 116.01 3dgv h GLU 175 Ca 0.28 -0.45 -0.06 0.00 -0.50 0.00 0.00 59.36 58.64 3dgv h GLU 175 Cb 0.57 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.49 3dgv h GLU 175 CO -0.08 1.08 -0.08 0.28 -1.40 0.00 0.00 179.01 178.81 3dgv h VAL 176 N 0.60 1.30 -0.82 3.13 2.07 -1.81 -1.78 116.25 118.94 3dgv h VAL 176 Ca 0.05 -1.12 0.10 0.00 0.82 0.00 0.00 66.70 66.54 3dgv h VAL 176 Cb 0.95 1.59 -0.07 0.00 -1.52 0.00 0.00 31.29 32.23 3dgv h VAL 176 CO 0.09 0.34 0.46 0.50 0.02 0.00 0.00 177.57 178.98 3dgv h LYS 177 N 0.14 0.75 -0.01 1.57 1.63 -1.18 0.35 116.57 119.82 3dgv h LYS 177 Ca 0.05 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3dgv h LYS 177 Cb 0.56 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 32.02 3dgv h LYS 177 CO 0.03 0.49 0.00 0.00 -3.45 0.00 0.00 179.45 176.52 3dgv h ALA 178 N 1.46 0.01 -0.61 5.00 0.00 -1.15 -0.44 119.26 123.52 3dgv h ALA 178 Ca 0.40 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 3dgv h ALA 178 Cb 0.38 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3dgv h ALA 178 CO -0.25 -0.37 0.21 0.28 0.00 0.00 0.00 179.25 179.12 3dgv h VAL 179 N -0.23 1.24 -0.50 0.00 2.07 -0.81 -1.71 116.25 116.30 3dgv h VAL 179 Ca 0.00 -0.79 -0.12 0.00 0.82 0.00 0.00 66.70 66.61 3dgv h VAL 179 Cb 0.25 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3dgv h VAL 179 CO 0.00 0.30 -0.16 0.00 0.02 0.00 0.00 177.57 177.73 3dgv h ALA 180 N 1.07 0.76 0.17 1.67 0.00 -0.26 -2.10 119.26 120.57 3dgv h ALA 180 Ca 0.20 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.75 3dgv h ALA 180 Cb 0.25 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3dgv h ALA 180 CO -0.01 0.67 -0.21 -0.44 0.00 0.00 0.00 179.25 179.26 3dgv h ASP 181 N 0.86 -0.57 -0.96 0.00 3.32 -0.90 -1.60 116.42 116.57 3dgv h ASP 181 Ca 0.12 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 3dgv h ASP 181 Cb 0.73 0.21 -0.05 0.00 0.22 0.00 0.00 39.33 40.44 3dgv h ASP 181 CO 0.06 -0.30 0.60 0.15 -1.72 0.00 0.00 179.24 178.02 3dgv h PHE 182 N -0.43 1.25 -0.32 4.55 3.57 -1.18 -0.54 116.94 123.84 3dgv h PHE 182 Ca 0.01 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.39 3dgv h PHE 182 Cb 0.42 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3dgv h PHE 182 CO -0.17 0.82 -0.32 -0.07 -2.23 0.00 0.00 178.31 176.34 3dgv h LEU 183 N 1.32 0.71 -0.43 0.59 3.38 -1.26 -1.63 115.31 117.99 3dgv h LEU 183 Ca 0.35 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3dgv h LEU 183 Cb -0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3dgv h LEU 183 CO -0.07 0.97 0.06 0.03 0.09 0.00 0.00 178.44 179.52 3dgv h ARG 184 N 0.58 0.72 -0.52 1.13 3.08 -0.84 -2.83 114.38 115.71 3dgv h ARG 184 Ca 0.07 -0.20 -0.05 0.00 0.07 0.00 0.00 59.98 59.86 3dgv h ARG 184 Cb 0.82 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 3dgv h ARG 184 CO 0.07 0.76 0.10 -0.09 -1.07 0.00 0.00 179.97 179.74 3dgv h ARG 185 N 0.57 0.80 -0.70 0.04 2.43 -0.82 -2.93 114.38 113.77 3dgv h ARG 185 Ca 0.13 -0.17 -0.35 0.00 -0.81 0.00 0.00 59.98 58.78 3dgv h ARG 185 Cb 0.40 -0.12 -0.21 0.00 -0.42 0.00 0.00 29.97 29.62 3dgv h ARG 185 CO 0.01 0.74 0.31 0.09 -1.51 0.00 0.00 179.97 179.61 3dgv n ASN 186 N -4.27 3.31 -0.07 -3.80 3.02 -0.64 -4.76 115.26 108.06 3dgv n ASN 186 Ca 0.03 -3.64 -0.12 0.00 -0.03 0.00 0.00 54.58 50.83 3dgv n ASN 186 Cb 0.24 -0.74 -0.06 0.00 -0.61 0.00 0.00 39.78 38.61 3dgv n ASN 186 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3dgv h ILE 187 N 1.15 1.30 -0.57 2.41 6.09 -1.30 -2.84 117.51 123.76 3dgv h ILE 187 Ca 0.43 -1.11 0.16 0.00 -1.37 0.00 0.00 64.86 62.97 3dgv h ILE 187 Cb 2.31 1.62 -0.02 0.00 0.47 0.00 0.00 36.82 41.19 3dgv h ILE 187 CO 0.77 0.33 0.53 0.07 -3.07 0.00 0.00 178.15 176.78 3dgv h LYS 188 N 0.10 0.00 0.00 2.19 2.10 -1.86 -1.24 116.57 117.86 3dgv h LYS 188 Ca 0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 3dgv h LYS 188 Cb 0.55 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.88 3dgv h LYS 188 CO 0.02 0.00 -1.30 1.58 -2.00 0.00 0.00 179.45 177.76 3dgv n HIS 188 N -3.85 0.68 -3.73 0.07 -0.00 -1.07 -4.90 115.22 102.42 3dgv n HIS 188 Ca 0.11 0.20 -0.35 0.00 0.46 0.00 0.00 57.72 58.14 3dgv n HIS 188 Cb 0.75 -0.82 -0.08 0.00 -0.12 0.00 0.00 29.99 29.72 3dgv n HIS 188 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 3dgv s ILE 189 N -3.41 5.39 -0.03 3.57 1.01 -0.47 -1.09 121.20 126.17 3dgv s ILE 189 Ca -0.03 0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.82 3dgv s ILE 189 Cb 0.11 -3.47 -0.01 0.00 0.01 0.00 0.00 42.46 39.10 3dgv s ILE 189 CO 0.83 0.43 0.03 0.29 0.00 0.00 0.00 174.94 176.52 3dgv n LYS 190 N 3.59 4.37 -3.86 2.79 4.76 -0.30 -4.89 118.16 124.61 3dgv n LYS 190 Ca -0.16 -0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.16 3dgv n LYS 190 Cb 0.52 -0.71 -0.11 0.00 -1.84 0.00 0.00 35.03 32.89 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 -1.43 -0.29 -0.06 7.82 0.00 -1.24 -3.88 121.76 122.67 3dgv s ALA 191 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 51.96 51.99 3dgv s ALA 191 Cb 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.13 3dgv s ALA 191 CO 0.04 -0.15 -0.11 -0.47 0.00 0.00 0.00 175.76 175.07 3dgv s TYR 192 N -0.88 1.36 -0.03 0.00 5.04 0.51 -1.47 117.35 121.88 3dgv s TYR 192 Ca -0.10 -0.50 0.02 0.00 -2.44 0.00 0.00 57.07 54.06 3dgv s TYR 192 Cb -0.05 -1.02 0.01 0.00 0.35 0.00 0.00 41.96 41.24 3dgv s TYR 192 CO 0.01 -0.27 -0.09 0.42 -1.34 0.00 0.00 175.55 174.28 3dgv s ILE 193 N 0.72 0.81 -0.17 3.14 1.01 -0.41 -0.27 121.20 126.02 3dgv s ILE 193 Ca -0.14 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.17 3dgv s ILE 193 Cb -0.16 -0.74 0.02 0.00 0.01 0.00 0.00 42.46 41.60 3dgv s ILE 193 CO 0.03 0.26 -0.19 -0.55 0.00 0.00 0.00 174.94 174.49 3dgv s SER 194 N 0.35 3.05 0.04 3.58 0.15 -0.11 -2.39 113.70 118.38 3dgv s SER 194 Ca -0.06 -0.62 -0.21 0.00 0.70 0.00 0.00 55.95 55.76 3dgv s SER 194 Cb -0.10 -1.42 -0.06 0.00 -1.71 0.00 0.00 66.02 62.72 3dgv s SER 194 CO 0.01 -0.01 0.61 -0.04 1.20 0.00 0.00 173.24 175.00 3dgv s MET 195 N 1.33 4.30 0.37 5.44 1.00 -0.66 -1.27 119.30 129.81 3dgv s MET 195 Ca 0.05 0.78 -0.05 0.00 0.00 0.00 0.00 55.69 56.48 3dgv s MET 195 Cb -0.13 -3.29 0.02 0.00 0.00 0.00 0.00 34.83 31.42 3dgv s MET 195 CO -0.13 0.49 0.57 -1.01 0.00 0.00 0.00 175.02 174.94 3dgv s HIS 196 N -0.64 0.89 0.20 -0.03 3.76 0.44 -4.36 115.29 115.56 3dgv s HIS 196 Ca 0.31 -1.23 -0.18 0.00 -0.15 0.00 0.00 55.06 53.81 3dgv s HIS 196 Cb -0.19 0.14 0.03 0.00 1.11 0.00 0.00 32.58 33.67 3dgv s HIS 196 CO 0.19 -1.28 0.55 -1.54 -0.85 0.00 0.00 174.74 171.81 3dgv s SER 197 N -3.22 -0.28 0.00 1.40 1.04 -1.26 -0.48 113.70 110.90 3dgv s SER 197 Ca 0.27 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.23 3dgv s SER 197 Cb -0.02 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.70 3dgv s SER 197 CO 0.19 -1.08 0.00 0.00 0.98 0.00 0.00 173.24 173.33 3dgv n TYR 198 N -0.36 0.00 0.00 5.02 4.11 -1.26 -4.90 117.16 119.77 3dgv n TYR 198 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.80 3dgv n TYR 198 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.96 3dgv n TYR 198 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 3dgv n SER 199 N -0.97 0.00 -3.02 9.48 3.41 0.13 -4.76 113.62 117.88 3dgv n SER 199 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 3dgv n SER 199 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 -0.06 -1.59 -3.90 4.33 6.02 -0.91 -4.83 117.38 116.44 3dgv n GLN 200 Ca 0.00 1.65 -0.09 0.00 -0.01 0.00 0.00 57.00 58.54 3dgv n GLN 200 Cb 0.00 -5.69 -0.05 0.00 1.02 0.00 0.00 30.24 25.52 3dgv n GLN 200 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 3dgv s LYS 201 N -2.93 1.36 -0.22 -1.09 -2.85 -0.63 -1.76 119.74 111.62 3dgv s LYS 201 Ca 0.06 -1.10 -0.00 0.00 -1.00 0.00 0.00 55.97 53.93 3dgv s LYS 201 Cb -0.02 0.45 0.02 0.00 -2.06 0.00 0.00 37.83 36.23 3dgv s LYS 201 CO 0.76 -0.55 -0.11 0.42 0.10 0.00 0.00 175.35 175.97 3dgv s ILE 202 N -3.95 2.57 0.13 3.79 1.01 0.01 -0.50 121.20 124.26 3dgv s ILE 202 Ca 0.16 -1.02 0.06 0.00 0.00 0.00 0.00 60.65 59.85 3dgv s ILE 202 Cb 0.01 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 3dgv s ILE 202 CO 0.02 0.31 -0.01 -0.69 0.00 0.00 0.00 174.94 174.56 3dgv s VAL 203 N 1.30 3.83 0.20 2.92 1.01 0.08 -2.40 120.40 127.35 3dgv s VAL 203 Ca 0.01 -1.19 -0.06 0.00 0.00 0.00 0.00 61.98 60.74 3dgv s VAL 203 Cb -0.16 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 3dgv s VAL 203 CO -0.07 0.03 0.25 0.72 0.00 0.00 0.00 175.10 176.02 3dgv s PHE 204 N -1.46 0.78 0.57 5.22 -0.12 -1.09 -1.01 117.98 120.87 3dgv s PHE 204 Ca 0.26 -1.08 -0.20 0.00 -0.05 0.00 0.00 56.93 55.86 3dgv s PHE 204 Cb -0.11 -0.25 -0.05 0.00 -0.63 0.00 0.00 43.02 41.98 3dgv s PHE 204 CO 0.18 -0.74 1.18 -2.30 -0.05 0.00 0.00 175.22 173.49 3dgv n PRO 205 N -0.28 1.30 -4.08 1.99 -0.02 -1.26 -1.72 135.00 130.94 3dgv n PRO 205 Ca -0.01 0.49 -0.23 0.00 -2.02 0.00 0.00 63.50 61.72 3dgv n PRO 205 Cb 0.64 -2.38 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 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 -1.38 3.19 -0.02 6.00 2.02 -1.26 -4.41 117.35 121.50 3dgv s TYR 206 Ca 0.74 -0.06 0.08 0.00 -0.37 0.00 0.00 57.07 57.46 3dgv s TYR 206 Cb -0.42 -1.47 -0.13 0.00 -0.40 0.00 0.00 41.96 39.54 3dgv s TYR 206 CO 0.48 0.51 0.17 0.43 -1.57 0.00 0.00 175.55 175.57 3dgv n SER 207 N -0.98 3.05 0.03 2.29 7.64 -1.26 -0.71 113.62 123.68 3dgv n SER 207 Ca -0.08 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.92 3dgv n SER 207 Cb 0.57 1.33 0.29 0.00 -1.01 0.00 0.00 64.21 65.39 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 -1.84 0.27 -4.01 1.43 0.18 -1.26 -0.84 117.16 111.09 3dgv n TYR 208 Ca -0.03 0.08 -0.08 0.00 1.88 0.00 0.00 57.90 59.76 3dgv n TYR 208 Cb 0.27 -0.49 -0.09 0.00 -0.38 0.00 0.00 39.34 38.64 3dgv n TYR 208 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 3dgv s SER 209 N -3.56 0.36 0.19 9.48 0.15 -1.26 -4.73 113.70 114.32 3dgv s SER 209 Ca 0.10 -0.85 0.16 0.00 0.70 0.00 0.00 55.95 56.06 3dgv s SER 209 Cb 0.16 0.23 -0.03 0.00 -1.71 0.00 0.00 66.02 64.67 3dgv s SER 209 CO 0.67 -0.61 1.18 -0.09 1.20 0.00 0.00 173.24 175.60 3dgv h ARG 210 N 3.17 0.00 -6.96 5.44 9.65 -1.91 -3.41 114.38 120.36 3dgv h ARG 210 Ca -0.34 0.00 -0.49 0.00 -1.10 0.00 0.00 59.98 58.05 3dgv h ARG 210 Cb 1.16 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 29.77 3dgv h ARG 210 CO 0.61 0.42 0.44 -1.54 2.80 0.00 0.00 179.97 182.70 3dgv s SER 211 N -6.17 6.64 0.60 -3.80 1.04 -1.26 -4.95 113.70 105.81 3dgv s SER 211 Ca 0.01 2.15 -0.12 0.00 0.48 0.00 0.00 55.95 58.47 3dgv s SER 211 Cb 0.08 -2.60 -0.04 0.00 0.10 0.00 0.00 66.02 63.56 3dgv s SER 211 CO 0.78 -0.58 1.02 0.00 0.98 0.00 0.00 173.24 175.44 3dgv s ARG 212 N -2.44 3.63 0.38 4.02 1.70 -1.26 -4.60 118.95 120.38 3dgv s ARG 212 Ca 0.58 0.81 -0.06 0.00 -0.47 0.00 0.00 55.73 56.58 3dgv s ARG 212 Cb -0.25 -2.09 -0.05 0.00 -0.57 0.00 0.00 34.95 31.99 3dgv s ARG 212 CO 0.31 -0.54 0.68 -1.54 -1.08 0.00 0.00 175.30 173.13 3dgv s SER 213 N -3.93 6.42 0.35 -2.89 1.04 -1.26 -4.95 113.70 108.47 3dgv s SER 213 Ca 0.56 0.88 0.14 0.00 0.48 0.00 0.00 55.95 58.01 3dgv s SER 213 Cb -0.11 -2.22 1.04 0.00 0.10 0.00 0.00 66.02 64.83 3dgv s SER 213 CO 0.50 -0.36 1.70 0.50 0.98 0.00 0.00 173.24 176.56 3dgv h LYS 214 N 1.13 0.41 -0.62 4.02 3.64 -1.97 -0.23 116.57 122.95 3dgv h LYS 214 Ca -0.48 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 58.74 3dgv h LYS 214 Cb 1.19 -0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 32.84 3dgv h LYS 214 CO 0.64 0.27 0.16 -0.25 -2.27 0.00 0.00 179.45 177.99 3dgv n ASP 215 N -4.89 4.80 -0.30 4.20 8.00 -1.26 -4.63 116.55 122.46 3dgv n ASP 215 Ca 0.29 -3.17 0.10 0.00 0.71 0.00 0.00 54.79 52.73 3dgv n ASP 215 Cb 0.91 -0.70 0.27 0.00 -0.02 0.00 0.00 41.12 41.58 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 2.76 0.75 -0.08 1.24 -0.00 -1.36 -1.62 115.15 116.84 3dgv h HIS 216 Ca 0.17 0.04 -0.03 0.00 -0.00 0.00 0.00 60.37 60.55 3dgv h HIS 216 Cb 2.11 -0.20 -0.00 0.00 -0.00 0.00 0.00 27.41 29.32 3dgv h HIS 216 CO 1.13 0.09 -0.06 1.49 -0.00 0.00 0.00 177.93 180.58 3dgv h GLU 217 N 0.54 0.18 -0.41 5.26 4.81 -1.83 -0.76 114.58 122.37 3dgv h GLU 217 Ca 0.51 -0.09 -0.08 0.00 -0.13 0.00 0.00 59.36 59.58 3dgv h GLU 217 Cb 0.85 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.21 3dgv h GLU 217 CO -0.43 0.58 -0.06 1.49 -0.73 0.00 0.00 179.01 179.86 3dgv h GLU 218 N -0.21 0.69 -0.28 1.92 4.81 -1.82 -2.55 114.58 117.15 3dgv h GLU 218 Ca 0.02 -0.20 -0.14 0.00 -0.13 0.00 0.00 59.36 58.91 3dgv h GLU 218 Cb 0.54 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 3dgv h GLU 218 CO 0.02 0.75 -0.38 -0.07 -0.73 0.00 0.00 179.01 178.60 3dgv h LEU 219 N 0.64 0.68 -0.31 1.64 3.38 -1.22 -1.89 115.31 118.24 3dgv h LEU 219 Ca 0.12 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3dgv h LEU 219 Cb 0.49 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3dgv h LEU 219 CO 0.03 0.99 0.19 -1.28 0.09 0.00 0.00 178.44 178.46 3dgv h SER 220 N 0.54 0.33 -0.67 -0.43 0.87 -0.90 -1.28 113.55 112.01 3dgv h SER 220 Ca 0.05 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.58 3dgv h SER 220 Cb 0.90 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.75 3dgv h SER 220 CO 0.08 0.24 0.31 0.25 -0.53 0.00 0.00 176.83 177.18 3dgv h LEU 221 N 0.40 0.90 -0.56 2.23 5.85 -1.23 -1.39 115.31 121.51 3dgv h LEU 221 Ca 0.12 -0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 3dgv h LEU 221 Cb -0.03 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 3dgv h LEU 221 CO -0.04 0.77 0.07 0.58 -0.34 0.00 0.00 178.44 179.49 3dgv h VAL 222 N 0.98 1.26 -0.57 1.05 2.07 -1.04 0.17 116.25 120.17 3dgv h VAL 222 Ca 0.24 -1.00 -0.04 0.00 0.82 0.00 0.00 66.70 66.72 3dgv h VAL 222 Cb 0.13 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3dgv h VAL 222 CO -0.03 0.36 0.21 0.00 0.02 0.00 0.00 177.57 178.14 3dgv h ALA 223 N 0.99 0.74 -0.56 1.67 0.00 -0.88 0.76 119.26 121.98 3dgv h ALA 223 Ca 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dgv h ALA 223 Cb 0.44 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3dgv h ALA 223 CO 0.01 0.36 0.37 0.00 0.00 0.00 0.00 179.25 179.99 3dgv h ARG 224 N 0.78 0.74 -0.59 0.00 3.08 -1.05 0.37 114.38 117.72 3dgv h ARG 224 Ca 0.19 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 3dgv h ARG 224 Cb 0.22 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 3dgv h ARG 224 CO -0.01 0.50 0.23 0.93 -1.07 0.00 0.00 179.97 180.55 3dgv h GLU 225 N 0.76 0.88 -0.05 0.04 5.08 -0.65 0.24 114.58 120.88 3dgv h GLU 225 Ca 0.21 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3dgv h GLU 225 Cb -0.08 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 3dgv h GLU 225 CO -0.04 0.75 0.03 0.00 -1.00 0.00 0.00 179.01 178.75 3dgv h ALA 226 N 1.08 0.07 -0.57 3.43 0.00 -0.51 -0.03 119.26 122.72 3dgv h ALA 226 Ca 0.20 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3dgv h ALA 226 Cb 0.20 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3dgv h ALA 226 CO -0.02 -0.40 0.34 0.28 0.00 0.00 0.00 179.25 179.45 3dgv h VAL 227 N 0.01 1.17 -0.72 0.00 2.07 -0.04 -2.02 116.25 116.71 3dgv h VAL 227 Ca 0.02 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.16 3dgv h VAL 227 Cb 0.07 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.20 3dgv h VAL 227 CO -0.00 0.18 0.47 0.15 0.02 0.00 0.00 177.57 178.39 3dgv h PHE 228 N 0.77 0.89 -0.72 1.57 3.57 -0.37 -1.46 116.94 121.18 3dgv h PHE 228 Ca 0.20 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.75 3dgv h PHE 228 Cb -0.01 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.40 3dgv h PHE 228 CO -0.02 0.54 0.47 0.00 -2.23 0.00 0.00 178.31 177.06 3dgv h ALA 229 N 1.28 0.93 -0.48 2.41 0.00 -0.60 -2.49 119.26 120.32 3dgv h ALA 229 Ca 0.28 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 3dgv h ALA 229 Cb -0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3dgv h ALA 229 CO -0.08 0.28 0.02 0.52 0.00 0.00 0.00 179.25 180.00 3dgv h MET 230 N 0.93 0.77 -0.26 0.00 2.86 -0.75 -2.21 114.93 116.28 3dgv h MET 230 Ca 0.28 -0.20 0.02 0.00 -2.06 0.00 0.00 59.70 57.75 3dgv h MET 230 Cb -0.05 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 3dgv h MET 230 CO -0.08 0.77 0.18 0.93 1.06 0.00 0.00 176.91 179.76 3dgv h GLU 231 N 0.73 0.25 0.00 1.72 5.08 -0.84 -0.57 114.58 120.95 3dgv h GLU 231 Ca 0.15 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 3dgv h GLU 231 Cb 0.41 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 3dgv h GLU 231 CO 0.01 0.17 -0.10 -0.97 -1.00 0.00 0.00 179.01 177.12 3dgv h ASN 232 N 0.26 0.00 0.00 1.42 -0.73 -1.13 -2.80 115.58 112.60 3dgv h ASN 232 Ca 0.11 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.28 3dgv h ASN 232 Cb 0.11 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.70 3dgv h ASN 232 CO -0.02 0.10 -1.62 2.30 -0.37 0.00 0.00 177.43 177.82 3dgv n ILE 233 N -3.83 0.00 -3.50 2.57 -5.35 -0.30 -4.73 119.36 104.22 3dgv n ILE 233 Ca -0.02 -0.33 -0.29 0.00 -0.27 0.00 0.00 62.75 61.84 3dgv n ILE 233 Cb 0.20 0.34 -0.13 0.00 -1.74 0.00 0.00 39.64 38.31 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 -3.24 0.81 0.54 4.28 3.76 -0.73 -5.02 115.29 115.68 3dgv s HIS 234 Ca -0.03 -1.60 0.24 0.00 -0.15 0.00 0.00 55.06 53.53 3dgv s HIS 234 Cb 0.14 -1.02 1.56 0.00 1.11 0.00 0.00 32.58 34.36 3dgv s HIS 234 CO 0.84 -0.83 2.18 0.00 -0.85 0.00 0.00 174.74 176.08 3dgv h ARG 235 N 7.21 0.00 0.00 1.40 -0.00 -1.79 -2.04 114.38 119.16 3dgv h ARG 235 Ca 0.01 0.00 -0.07 0.00 -0.50 0.00 0.00 59.98 59.42 3dgv h ARG 235 Cb 0.97 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.93 3dgv h ARG 235 CO 0.31 0.03 -0.50 -0.91 0.00 0.00 0.00 179.97 178.90 3dgv h ASN 235 N 0.00 0.00 -3.75 7.04 2.35 -1.96 -3.46 115.58 115.80 3dgv h ASN 235 Ca -0.00 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 55.25 3dgv h ASN 235 Cb 0.07 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 3dgv h ASN 235 CO 0.00 0.30 0.42 -0.51 -1.65 0.00 0.00 177.43 175.99 3dgv s ILE 236 N -3.08 3.81 -0.08 2.81 1.10 -0.77 -5.05 121.20 119.94 3dgv s ILE 236 Ca 0.04 1.79 0.01 0.00 -0.51 0.00 0.00 60.65 61.97 3dgv s ILE 236 Cb 0.07 -4.14 0.02 0.00 0.15 0.00 0.00 42.46 38.56 3dgv s ILE 236 CO 0.73 0.41 -0.08 0.00 -2.11 0.00 0.00 174.94 173.90 3dgv s ARG 237 N -1.20 1.35 0.16 3.50 1.70 -1.26 -4.77 118.95 118.43 3dgv s ARG 237 Ca 0.43 -0.23 0.03 0.00 -0.47 0.00 0.00 55.73 55.49 3dgv s ARG 237 Cb -0.29 -1.32 -0.03 0.00 -0.57 0.00 0.00 34.95 32.73 3dgv s ARG 237 CO 0.36 -0.15 0.30 0.71 -1.08 0.00 0.00 175.30 175.44 3dgv s TYR 238 N 1.28 3.48 0.48 5.89 1.51 -1.26 -4.93 117.35 123.79 3dgv s TYR 238 Ca -0.04 0.10 0.03 0.00 -1.01 0.00 0.00 57.07 56.15 3dgv s TYR 238 Cb -0.14 -1.65 0.03 0.00 -0.11 0.00 0.00 41.96 40.09 3dgv s TYR 238 CO -0.03 0.50 0.26 0.25 -1.11 0.00 0.00 175.55 175.43 3dgv n THR 239 N -0.68 0.00 -3.65 -0.71 -2.24 -0.72 -4.96 114.28 101.33 3dgv n THR 239 Ca -0.07 -1.98 -0.10 0.00 -2.27 0.00 0.00 64.05 59.62 3dgv n THR 239 Cb 0.54 0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 3dgv n THR 239 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 3dgv s HIS 240 N -2.47 -0.23 0.00 4.78 -3.43 -1.26 -0.80 115.29 111.88 3dgv s HIS 240 Ca 0.20 -0.08 0.00 0.00 -0.80 0.00 0.00 55.06 54.38 3dgv s HIS 240 Cb -0.02 0.41 0.00 0.00 -1.43 0.00 0.00 32.58 31.55 3dgv s HIS 240 CO 0.13 -0.87 0.00 0.41 -2.00 0.00 0.00 174.74 172.41 3dgv n GLY 241 N -0.33 1.78 3.83 -1.38 0.00 -1.01 -4.94 105.19 103.14 3dgv n GLY 241 Ca -0.13 -1.30 -0.31 0.00 0.00 0.00 0.00 46.02 44.28 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 0.00 5.45 0.46 1.61 1.04 -1.26 -2.66 113.70 118.34 3dgv s SER 242 Ca 0.00 1.53 0.20 0.00 0.48 0.00 0.00 55.95 58.16 3dgv s SER 242 Cb 0.00 -2.42 1.10 0.00 0.10 0.00 0.00 66.02 64.80 3dgv s SER 242 CO 0.00 -1.39 1.97 1.23 0.98 0.00 0.00 173.24 176.03 3dgv h GLY 243 N -0.68 0.00 2.00 7.32 0.00 -0.87 -1.54 103.07 109.30 3dgv h GLY 243 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3dgv h GLY 243 CO 0.58 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.98 3dgv n SER 244 N -3.91 0.18 0.00 0.19 3.41 0.11 -2.78 113.62 110.83 3dgv n SER 244 Ca -0.02 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 3dgv n SER 244 Cb 0.30 -0.58 0.59 0.00 -0.26 0.00 0.00 64.21 64.26 3dgv n SER 244 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dgv n GLU 245 N -1.69 0.35 -2.36 4.33 1.02 -0.58 -4.79 120.64 116.92 3dgv n GLU 245 Ca 0.04 0.06 -0.24 0.00 -0.02 0.00 0.00 57.16 57.00 3dgv n GLU 245 Cb 0.23 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.28 3dgv n GLU 245 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3dgv n SER 246 N -1.27 1.02 0.20 1.62 3.41 -1.12 -5.02 113.62 112.48 3dgv n SER 246 Ca 0.11 -1.96 -0.15 0.00 -0.26 0.00 0.00 58.87 56.62 3dgv n SER 246 Cb 0.18 -0.72 -0.07 0.00 -0.26 0.00 0.00 64.21 63.33 3dgv n SER 246 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3dgv h LEU 247 N 0.00 -0.78 -9.31 1.04 4.07 -1.89 -3.44 115.31 105.00 3dgv h LEU 247 Ca -0.35 0.07 -0.60 0.00 0.08 0.00 0.00 57.88 57.08 3dgv h LEU 247 Cb 1.19 0.26 -0.13 0.00 1.08 0.00 0.00 40.66 43.06 3dgv h LEU 247 CO 0.34 -0.42 -0.73 -0.72 -1.08 0.00 0.00 178.44 175.83 3dgv s TYR 248 N -6.05 2.48 1.11 1.13 1.13 -1.26 -5.15 117.35 110.75 3dgv s TYR 248 Ca -0.16 -0.28 -0.17 0.00 -1.41 0.00 0.00 57.07 55.04 3dgv s TYR 248 Cb 0.06 -1.13 0.25 0.00 -1.10 0.00 0.00 41.96 40.04 3dgv s TYR 248 CO 0.64 0.62 1.14 -0.51 -2.51 0.00 0.00 175.55 174.93 3dgv s LEU 249 N -3.32 1.25 -0.51 -3.49 1.43 -1.26 -4.88 118.68 107.89 3dgv s LEU 249 Ca 0.28 0.67 0.07 0.00 -1.03 0.00 0.00 54.13 54.13 3dgv s LEU 249 Cb -0.06 -2.57 0.19 0.00 0.03 0.00 0.00 46.19 43.78 3dgv s LEU 249 CO 0.16 -3.64 0.72 0.00 0.23 0.00 0.00 176.35 173.82 3dgv s ALA 250 N -3.17 -2.07 0.70 4.21 0.00 -0.02 -4.42 121.76 117.00 3dgv s ALA 250 Ca 0.70 -0.43 -0.11 0.00 0.00 0.00 0.00 51.96 52.12 3dgv s ALA 250 Cb -0.10 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.32 3dgv s ALA 250 CO 0.55 -2.24 1.06 -1.25 0.00 0.00 0.00 175.76 173.89 3dgv s PRO 251 N 0.89 2.90 0.00 0.00 0.04 -1.26 -4.03 135.00 133.54 3dgv s PRO 251 Ca 0.30 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.23 3dgv s PRO 251 Cb -0.00 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.55 3dgv s PRO 251 CO -0.05 -1.11 0.00 0.41 0.04 0.00 0.00 177.00 176.29 3dgv n GLY 252 N -2.08 0.76 3.80 0.56 0.00 -1.26 -4.47 105.19 102.49 3dgv n GLY 252 Ca 0.07 0.00 -0.33 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 -1.72 2.29 0.07 -0.02 0.00 -1.14 -0.86 107.32 105.94 3dgv s GLY 253 Ca 0.00 0.49 -0.13 0.00 0.00 0.00 0.00 44.72 45.07 3dgv s GLY 253 CO 0.00 0.81 1.15 1.48 0.00 0.00 0.00 173.10 176.53 3dgv h SER 254 N 0.89 0.85 -0.80 1.64 4.64 -1.90 -2.78 113.55 116.09 3dgv h SER 254 Ca -0.48 -0.75 -0.03 0.00 -0.47 0.00 0.00 61.79 60.06 3dgv h SER 254 Cb 1.22 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 63.01 3dgv h SER 254 CO 0.58 1.55 0.37 -2.24 -0.87 0.00 0.00 176.83 176.23 3dgv h ASP 255 N 0.30 1.05 -0.40 4.97 3.04 -1.94 0.27 116.42 123.71 3dgv h ASP 255 Ca -0.16 -0.14 -0.00 0.00 -3.24 0.00 0.00 57.03 53.48 3dgv h ASP 255 Cb 1.83 -0.27 -0.02 0.00 -1.04 0.00 0.00 39.33 39.83 3dgv h ASP 255 CO 0.22 0.90 0.24 0.44 -2.04 0.00 0.00 179.24 178.99 3dgv h ASP 256 N 1.13 0.49 -0.27 4.15 3.32 -1.96 -0.28 116.42 123.00 3dgv h ASP 256 Ca 0.27 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.26 3dgv h ASP 256 Cb 0.13 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 3dgv h ASP 256 CO -0.03 0.41 0.17 -0.25 -1.72 0.00 0.00 179.24 177.82 3dgv h TRP 257 N 0.52 0.34 0.00 4.55 7.01 -0.98 -0.82 115.95 126.57 3dgv h TRP 257 Ca 0.14 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.15 3dgv h TRP 257 Cb 0.02 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 26.96 3dgv h TRP 257 CO -0.03 0.22 0.00 0.97 -2.79 0.00 0.00 178.44 176.81 3dgv h ILE 258 N 0.36 0.00 -0.20 2.65 2.10 -0.48 -2.89 117.51 119.05 3dgv h ILE 258 Ca 0.10 -0.82 -0.10 0.00 1.08 0.00 0.00 64.86 65.12 3dgv h ILE 258 Cb -0.03 1.81 -0.00 0.00 -1.09 0.00 0.00 36.82 37.51 3dgv h ILE 258 CO -0.02 0.00 -0.25 0.22 -1.08 0.00 0.00 178.15 177.02 3dgv h TYR 259 N 0.00 0.63 0.00 2.19 3.20 -0.45 -2.28 116.97 120.26 3dgv h TYR 259 Ca 0.00 -0.20 0.00 0.00 3.14 0.00 0.00 58.73 61.67 3dgv h TYR 259 Cb 0.85 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.99 3dgv h TYR 259 CO 0.00 0.90 0.00 -0.25 -1.64 0.00 0.00 178.16 177.17 3dgv n ASP 260 N -4.39 0.00 -0.52 -2.11 8.00 -0.37 -1.35 116.55 115.81 3dgv n ASP 260 Ca -0.05 -0.93 0.10 0.00 0.71 0.00 0.00 54.79 54.61 3dgv n ASP 260 Cb 0.44 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.55 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 -0.90 2.05 0.00 0.64 7.94 -1.07 -4.98 117.00 120.68 3dgv n LEU 261 Ca 0.15 -0.80 0.00 0.00 -1.11 0.00 0.00 56.01 54.25 3dgv n LEU 261 Cb 0.07 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.02 3dgv n LEU 261 CO 0.11 0.38 0.00 0.61 -1.11 0.00 0.00 177.39 177.38 3dgv n GLY 262 N 1.32 1.12 3.55 -3.96 0.00 -0.46 -5.07 105.19 101.70 3dgv n GLY 262 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.00 4.34 0.10 -0.61 1.09 -0.88 -4.90 121.20 118.35 3dgv s ILE 263 Ca 0.00 0.59 -0.15 0.00 -1.10 0.00 0.00 60.65 59.99 3dgv s ILE 263 Cb 0.00 -4.54 -0.07 0.00 -1.06 0.00 0.00 42.46 36.79 3dgv s ILE 263 CO 0.00 -1.05 1.46 0.50 -0.10 0.00 0.00 174.94 175.74 3dgv h LYS 264 N 9.27 0.70 -4.82 2.79 3.64 -1.84 -3.37 116.57 122.94 3dgv h LYS 264 Ca -0.25 -0.33 -0.71 0.00 -1.27 0.00 0.00 60.65 58.09 3dgv h LYS 264 Cb 1.07 -0.01 -0.19 0.00 -0.41 0.00 0.00 32.23 32.69 3dgv h LYS 264 CO 1.09 0.93 0.81 0.71 -2.27 0.00 0.00 179.45 180.72 3dgv s TYR 265 N -4.52 3.27 -0.14 1.91 2.02 -1.25 -4.96 117.35 113.69 3dgv s TYR 265 Ca -0.13 -1.59 -0.00 0.00 -0.37 0.00 0.00 57.07 54.98 3dgv s TYR 265 Cb 0.09 -4.22 0.03 0.00 -0.40 0.00 0.00 41.96 37.45 3dgv s TYR 265 CO 0.82 -1.41 -0.10 0.45 -1.57 0.00 0.00 175.55 173.74 3dgv s SER 266 N 3.30 2.53 0.07 2.29 0.15 -1.26 -0.36 113.70 120.42 3dgv s SER 266 Ca 0.32 -0.45 0.03 0.00 0.70 0.00 0.00 55.95 56.56 3dgv s SER 266 Cb -0.05 -1.02 -0.03 0.00 -1.71 0.00 0.00 66.02 63.21 3dgv s SER 266 CO -0.08 -0.10 -0.10 -0.36 1.20 0.00 0.00 173.24 173.80 3dgv s PHE 267 N 1.59 0.92 -0.11 3.44 0.08 0.63 -4.26 117.98 120.27 3dgv s PHE 267 Ca 0.04 -0.56 0.01 0.00 0.12 0.00 0.00 56.93 56.54 3dgv s PHE 267 Cb -0.13 -0.53 -0.02 0.00 -0.57 0.00 0.00 43.02 41.78 3dgv s PHE 267 CO -0.09 -0.03 -0.15 0.99 -0.10 0.00 0.00 175.22 175.84 3dgv s THR 268 N -1.81 2.94 -0.22 0.64 2.01 -0.18 -0.93 115.64 118.09 3dgv s THR 268 Ca -0.02 -0.72 -0.13 0.00 0.31 0.00 0.00 61.69 61.14 3dgv s THR 268 Cb -0.07 -2.21 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 3dgv s THR 268 CO 0.00 0.54 0.25 -0.36 -0.69 0.00 0.00 174.62 174.37 3dgv s PHE 269 N 0.12 3.34 -0.41 4.92 0.40 -0.39 -0.74 117.98 125.22 3dgv s PHE 269 Ca -0.07 0.38 -0.16 0.00 -0.60 0.00 0.00 56.93 56.48 3dgv s PHE 269 Cb -0.15 -2.37 0.02 0.00 0.51 0.00 0.00 43.02 41.03 3dgv s PHE 269 CO 0.05 0.04 0.34 -1.21 0.70 0.00 0.00 175.22 175.14 3dgv s GLU 270 N 1.15 3.03 0.05 0.44 0.41 0.35 -0.42 118.70 123.70 3dgv s GLU 270 Ca 0.12 -0.93 -0.01 0.00 -0.41 0.00 0.00 54.97 53.75 3dgv s GLU 270 Cb -0.14 -3.97 0.01 0.00 -1.78 0.00 0.00 34.13 28.25 3dgv s GLU 270 CO 0.06 -0.77 0.06 1.28 -0.49 0.00 0.00 175.26 175.40 3dgv n LEU 271 N 5.29 0.00 -4.68 1.80 4.77 0.36 -1.61 117.00 122.94 3dgv n LEU 271 Ca -0.10 -0.09 -0.30 0.00 -0.03 0.00 0.00 56.01 55.49 3dgv n LEU 271 Cb 0.47 -0.05 0.16 0.00 -2.33 0.00 0.00 43.42 41.67 3dgv n LEU 271 CO 0.42 -0.54 0.66 -0.13 -1.33 0.00 0.00 177.39 176.47 3dgv s ARG 272 N -2.93 1.03 0.00 3.23 0.52 -1.26 -2.20 118.95 117.33 3dgv s ARG 272 Ca 0.04 1.19 0.00 0.00 -0.52 0.00 0.00 55.73 56.43 3dgv s ARG 272 Cb -0.00 -1.76 0.00 0.00 0.52 0.00 0.00 34.95 33.71 3dgv s ARG 272 CO 0.03 -2.50 0.00 -0.40 0.02 0.00 0.00 175.30 172.44 3dgv n ASP 273 N -4.11 0.00 -0.40 0.23 5.68 -1.26 -4.62 116.55 112.07 3dgv n ASP 273 Ca 0.09 0.00 0.08 0.00 -0.50 0.00 0.00 54.79 54.45 3dgv n ASP 273 Cb 0.53 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.52 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 1.64 0.00 0.11 4.76 -1.26 0.17 118.16 123.58 3dgv n LYS 274 Ca 0.00 -0.91 0.00 0.00 -2.87 0.00 0.00 58.31 54.53 3dgv n LYS 274 Cb 0.00 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 31.92 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 1.10 0.59 0.18 0.72 0.00 -1.26 -4.86 105.19 101.65 3dgv n GLY 275 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.08 0.00 1.61 3.64 -1.92 -3.29 116.57 116.53 3dgv h LYS 276 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3dgv h LYS 276 Cb 0.00 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3dgv h LYS 276 CO 0.00 -0.06 -1.02 0.66 -2.27 0.00 0.00 179.45 176.77 3dgv n TYR 277 N -5.29 0.00 0.00 1.91 4.01 -1.26 -4.39 117.16 112.14 3dgv n TYR 277 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3dgv n TYR 277 Cb 0.21 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 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 1.71 3.52 0.18 2.72 0.00 -1.24 -0.70 105.19 111.38 3dgv n GLY 278 Ca -0.00 0.18 0.07 0.00 0.00 0.00 0.00 46.02 46.26 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 -0.36 1.61 0.04 -1.92 -3.34 116.94 112.97 3dgv h PHE 279 Ca 0.00 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.52 3dgv h PHE 279 Cb 0.00 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.06 3dgv h PHE 279 CO 0.00 0.33 0.10 1.28 -0.60 0.00 0.00 178.31 179.42 3dgv n LEU 280 N -3.29 5.88 -4.65 1.54 4.32 0.12 -4.63 117.00 116.29 3dgv n LEU 280 Ca 0.01 -3.21 -0.43 0.00 -0.02 0.00 0.00 56.01 52.37 3dgv n LEU 280 Cb 0.59 -1.21 -0.02 0.00 -1.62 0.00 0.00 43.42 41.16 3dgv n LEU 280 CO 0.37 1.40 1.25 -0.22 -1.22 0.00 0.00 177.39 178.97 3dgv s LEU 281 N -0.98 4.19 0.72 2.23 2.96 -1.25 -4.88 118.68 121.66 3dgv s LEU 281 Ca 0.38 1.89 -0.16 0.00 -0.22 0.00 0.00 54.13 56.02 3dgv s LEU 281 Cb 0.23 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.39 3dgv s LEU 281 CO -0.05 -0.92 1.03 -2.65 -1.32 0.00 0.00 176.35 172.44 3dgv n PRO 282 N 7.01 0.57 0.24 0.98 -0.02 -1.26 -4.89 135.00 137.63 3dgv n PRO 282 Ca 0.16 0.25 0.09 0.00 -2.02 0.00 0.00 63.50 61.98 3dgv n PRO 282 Cb 0.44 -2.28 0.60 0.00 -0.02 0.00 0.00 33.50 32.24 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 -0.19 0.00 0.00 -0.52 5.08 -1.93 -1.78 114.58 115.24 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 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 3dgv h GLU 283 CO 0.48 0.17 0.00 -1.13 -1.00 0.00 0.00 179.01 177.53 3dgv n SER 284 N -3.97 0.00 -0.71 1.42 3.41 -1.26 -1.55 113.62 110.96 3dgv n SER 284 Ca -0.02 -0.03 0.10 0.00 -0.26 0.00 0.00 58.87 58.67 3dgv n SER 284 Cb 0.26 -0.18 0.06 0.00 -0.26 0.00 0.00 64.21 64.08 3dgv n SER 284 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3dgv n TYR 285 N -1.18 0.00 -0.16 7.33 4.01 -0.67 -4.48 117.16 122.01 3dgv n TYR 285 Ca 0.06 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.71 3dgv n TYR 285 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.10 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 3.47 1.22 0.28 -0.72 2.04 -1.44 -2.20 117.51 120.16 3dgv h ILE 286 Ca 0.00 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.10 3dgv h ILE 286 Cb 0.81 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 3dgv h ILE 286 CO 0.00 0.27 -0.14 -0.09 0.00 0.00 0.00 178.15 178.19 3dgv h ARG 287 N 0.61 -0.36 -0.45 2.37 2.43 -1.78 -0.53 114.38 116.67 3dgv h ARG 287 Ca 0.15 0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.43 3dgv h ARG 287 Cb 0.27 0.08 -0.08 0.00 -0.42 0.00 0.00 29.97 29.82 3dgv h ARG 287 CO -0.00 -0.11 -0.06 -1.35 -1.51 0.00 0.00 179.97 176.93 3dgv h PRO 288 N -0.57 0.04 -0.24 0.20 0.11 -1.82 0.44 132.00 130.16 3dgv h PRO 288 Ca -0.04 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3dgv h PRO 288 Cb 0.42 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 3dgv h PRO 288 CO 0.06 0.03 -0.07 1.15 -0.21 0.00 0.00 178.00 178.96 3dgv h THR 289 N 0.05 1.29 -0.00 -1.15 2.02 -1.31 -1.59 112.91 112.21 3dgv h THR 289 Ca 0.22 -1.10 -0.22 0.00 0.77 0.00 0.00 66.41 66.09 3dgv h THR 289 Cb 0.33 1.52 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 3dgv h THR 289 CO -0.42 0.34 -0.91 0.00 0.37 0.00 0.00 175.52 174.89 3dgv h SER 291 N 0.20 -1.15 -0.01 0.00 0.02 -0.06 -1.07 113.55 111.47 3dgv h SER 291 Ca -0.07 0.12 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 3dgv h SER 291 Cb 1.55 0.43 -0.01 0.00 0.14 0.00 0.00 62.40 64.50 3dgv h SER 291 CO 0.15 -0.38 -0.13 1.05 -1.14 0.00 0.00 176.83 176.38 3dgv h GLU 292 N -0.50 0.30 0.00 3.45 4.11 -1.23 -1.56 114.58 119.15 3dgv h GLU 292 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.36 59.36 3dgv h GLU 292 Cb 0.52 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3dgv h GLU 292 CO -0.23 0.44 0.00 0.00 0.07 0.00 0.00 179.01 179.29 3dgv h ALA 293 N 1.58 1.00 -0.05 1.06 0.00 -1.17 -2.80 119.26 118.88 3dgv h ALA 293 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.71 3dgv h ALA 293 Cb 0.41 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.22 3dgv h ALA 293 CO 0.02 0.00 -0.95 1.25 0.00 0.00 0.00 179.25 179.57 3dgv h LEU 294 N 0.00 0.93 -1.23 0.00 5.85 -0.15 -2.62 115.31 118.09 3dgv h LEU 294 Ca 0.00 -0.70 -0.07 0.00 0.84 0.00 0.00 57.88 57.95 3dgv h LEU 294 Cb 0.82 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 3dgv h LEU 294 CO 0.00 1.50 -0.34 -0.37 -0.34 0.00 0.00 178.44 178.89 3dgv h VAL 295 N 0.44 0.99 -0.33 1.05 -1.51 -1.43 0.14 116.25 115.59 3dgv h VAL 295 Ca -0.10 -1.28 -0.16 0.00 -1.23 0.00 0.00 66.70 63.93 3dgv h VAL 295 Cb 1.60 1.75 -0.01 0.00 -2.13 0.00 0.00 31.29 32.50 3dgv h VAL 295 CO 0.19 0.33 -0.42 0.00 -1.23 0.00 0.00 177.57 176.44 3dgv h ALA 296 N 1.66 0.62 -0.28 5.19 0.00 -1.51 0.74 119.26 125.68 3dgv h ALA 296 Ca -0.00 -0.46 -0.18 0.00 0.00 0.00 0.00 54.91 54.26 3dgv h ALA 296 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3dgv h ALA 296 CO 0.04 0.67 -0.53 0.28 0.00 0.00 0.00 179.25 179.72 3dgv h VAL 297 N 0.68 1.28 -0.59 0.00 2.07 -1.07 -0.68 116.25 117.94 3dgv h VAL 297 Ca 0.05 -1.72 0.06 0.00 0.82 0.00 0.00 66.70 65.92 3dgv h VAL 297 Cb 1.00 1.65 -0.06 0.00 -1.52 0.00 0.00 31.29 32.36 3dgv h VAL 297 CO 0.10 0.56 0.29 0.00 0.02 0.00 0.00 177.57 178.53 3dgv h ALA 298 N 0.67 0.77 -0.24 1.67 0.00 -0.67 -0.48 119.26 120.98 3dgv h ALA 298 Ca 0.01 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3dgv h ALA 298 Cb 1.14 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3dgv h ALA 298 CO 0.12 -0.08 0.07 -0.22 0.00 0.00 0.00 179.25 179.14 3dgv h LYS 299 N 0.53 0.38 -0.53 0.00 1.63 -0.60 -2.39 116.57 115.60 3dgv h LYS 299 Ca 0.27 -0.08 -0.04 0.00 -0.85 0.00 0.00 60.65 59.95 3dgv h LYS 299 Cb 0.22 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.77 3dgv h LYS 299 CO -0.21 0.47 0.19 0.82 -3.45 0.00 0.00 179.45 177.27 3dgv h ILE 300 N 0.22 1.20 -0.02 2.00 2.04 -0.92 -2.47 117.51 119.57 3dgv h ILE 300 Ca 0.08 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.26 3dgv h ILE 300 Cb 0.25 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3dgv h ILE 300 CO -0.00 0.26 0.00 0.00 0.00 0.00 0.00 178.15 178.41 3dgv h ALA 301 N 1.44 0.03 -0.33 1.87 0.00 -0.90 -1.68 119.26 119.68 3dgv h ALA 301 Ca 0.18 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3dgv h ALA 301 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3dgv h ALA 301 CO -0.01 -0.34 -0.05 0.66 0.00 0.00 0.00 179.25 179.51 3dgv h SER 302 N -0.22 0.51 -0.19 0.00 4.64 -1.35 0.22 113.55 117.16 3dgv h SER 302 Ca 0.01 -0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 61.17 3dgv h SER 302 Cb 0.27 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 3dgv h SER 302 CO 0.00 0.62 -0.01 -0.74 -0.87 0.00 0.00 176.83 175.83 3dgv h HIS 303 N 0.51 0.48 -0.27 4.77 6.17 -1.30 -2.77 115.15 122.73 3dgv h HIS 303 Ca 0.10 -0.04 -0.04 0.00 0.71 0.00 0.00 60.37 61.09 3dgv h HIS 303 Cb 0.41 -0.14 -0.01 0.00 2.52 0.00 0.00 27.41 30.18 3dgv h HIS 303 CO 0.01 0.49 -0.01 0.28 0.71 0.00 0.00 177.93 179.41 3dgv h VAL 304 N 0.45 1.26 -0.50 5.26 2.07 -0.01 -2.92 116.25 121.87 3dgv h VAL 304 Ca 0.10 -0.94 -0.07 0.00 0.82 0.00 0.00 66.70 66.61 3dgv h VAL 304 Cb 0.31 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 3dgv h VAL 304 CO 0.01 0.30 0.01 -0.37 0.02 0.00 0.00 177.57 177.54 3dgv h VAL 305 N 0.26 1.25 0.00 2.57 -1.51 -1.25 -0.00 116.25 117.57 3dgv h VAL 305 Ca 0.08 -1.01 -0.01 0.00 -1.23 0.00 0.00 66.70 64.53 3dgv h VAL 305 Cb 0.43 0.85 -0.00 0.00 -2.13 0.00 0.00 31.29 30.44 3dgv h VAL 305 CO 0.02 0.36 -0.04 0.11 -1.23 0.00 0.00 177.57 176.78 3dgv h LYS 306 N 0.78 0.00 0.00 5.19 1.57 -1.43 -3.04 116.57 119.64 3dgv h LYS 306 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3dgv h LYS 306 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 3dgv h LYS 306 CO 0.02 0.04 -0.00 0.09 -0.57 0.00 0.00 179.45 179.03 3dgv n ASN 307 N -3.45 2.02 0.00 0.86 4.13 -0.78 -5.12 115.26 112.92 3dgv n ASN 307 Ca -0.02 -2.10 0.00 0.00 1.68 0.00 0.00 54.58 54.14 3dgv n ASN 307 Cb 0.16 -0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.35 3dgv n ASN 307 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09