#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3v n GLY 3 N 0.00 0.00 1.34 7.55 0.00 -1.26 -5.15 105.19 107.67 3h3v n GLY 3 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 3h3v n GLY 3 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h3v n GLN 4 N 0.00 -2.75 -0.78 1.61 6.02 -1.26 -4.82 117.38 115.39 3h3v n GLN 4 Ca 0.00 2.18 0.00 0.00 -0.01 0.00 0.00 57.00 59.17 3h3v n GLN 4 Cb 0.00 -3.01 0.00 0.00 1.02 0.00 0.00 30.24 28.25 3h3v n GLN 4 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3h3v n GLN 5 N -3.05 0.00 -1.77 -1.09 1.13 -1.26 -4.97 117.38 106.37 3h3v n GLN 5 Ca -0.03 0.41 -0.42 0.00 -1.94 0.00 0.00 57.00 55.02 3h3v n GLN 5 Cb 0.41 -0.38 -0.03 0.00 0.11 0.00 0.00 30.24 30.35 3h3v n GLN 5 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 3h3v s TYR 6 N 0.00 2.91 -0.19 1.08 5.04 -1.26 -5.00 117.35 119.93 3h3v s TYR 6 Ca 0.00 0.46 -0.02 0.00 -2.44 0.00 0.00 57.07 55.07 3h3v s TYR 6 Cb 0.00 -4.10 -0.00 0.00 0.35 0.00 0.00 41.96 38.21 3h3v s TYR 6 CO 0.00 -4.06 -0.11 0.45 -1.34 0.00 0.00 175.55 170.49 3h3v s SER 7 N 1.06 3.88 0.47 4.32 0.15 -1.26 -4.98 113.70 117.34 3h3v s SER 7 Ca 0.72 -0.47 0.24 0.00 0.70 0.00 0.00 55.95 57.15 3h3v s SER 7 Cb -0.48 -1.64 1.17 0.00 -1.71 0.00 0.00 66.02 63.36 3h3v s SER 7 CO 0.34 0.01 1.96 0.77 1.20 0.00 0.00 173.24 177.52 3h3v h SER 8 N 7.87 0.00 -3.67 5.45 4.64 -2.06 -3.44 113.55 122.34 3h3v h SER 8 Ca -0.41 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.36 3h3v h SER 8 Cb 1.16 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 63.43 3h3v h SER 8 CO 0.61 0.19 -0.01 0.00 -0.87 0.00 0.00 176.83 176.75 3h3v n ALA 9 N -2.29 -0.56 -0.99 5.18 0.00 -1.26 -4.96 120.51 115.63 3h3v n ALA 9 Ca -0.01 -0.22 -0.30 0.00 0.00 0.00 0.00 53.44 52.91 3h3v n ALA 9 Cb 0.33 -2.06 0.24 0.00 0.00 0.00 0.00 19.45 17.95 3h3v n ALA 9 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3h3v s PRO 10 N -3.27 -1.20 -0.20 0.00 0.04 -1.26 -5.05 135.00 124.05 3h3v s PRO 10 Ca 0.71 0.07 -0.04 0.00 0.04 0.00 0.00 61.00 61.78 3h3v s PRO 10 Cb -0.34 -1.59 0.07 0.00 0.04 0.00 0.00 34.50 32.68 3h3v s PRO 10 CO 0.52 -3.73 0.09 -1.17 0.04 0.00 0.00 177.00 172.75 3h3v s LEU 11 N -7.00 0.65 0.45 -3.56 2.96 -1.26 -5.13 118.68 105.79 3h3v s LEU 11 Ca 0.70 -0.83 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 3h3v s LEU 11 Cb -0.12 -0.37 -0.02 0.00 0.50 0.00 0.00 46.19 46.18 3h3v s LEU 11 CO 0.57 -0.36 0.06 -0.13 -1.32 0.00 0.00 176.35 175.17 3h3v s ARG 12 N 2.05 2.04 0.04 1.98 0.52 -1.26 -5.15 118.95 119.18 3h3v s ARG 12 Ca 0.03 -2.27 0.05 0.00 -0.52 0.00 0.00 55.73 53.03 3h3v s ARG 12 Cb -0.16 -1.13 -0.04 0.00 0.52 0.00 0.00 34.95 34.14 3h3v s ARG 12 CO -0.14 -0.38 -0.11 0.95 0.02 0.00 0.00 175.30 175.64 3h3v s THR 13 N -3.02 3.34 0.28 0.02 -4.23 -1.26 -5.08 115.64 105.68 3h3v s THR 13 Ca 0.17 -1.03 -0.30 0.00 -1.18 0.00 0.00 61.69 59.34 3h3v s THR 13 Cb 0.03 -2.48 -0.11 0.00 1.34 0.00 0.00 72.50 71.28 3h3v s THR 13 CO 0.09 0.29 1.55 -0.69 -0.54 0.00 0.00 174.62 175.32 3h3v s VAL 14 N -1.05 2.27 -0.09 2.29 1.01 -1.26 -4.91 120.40 118.66 3h3v s VAL 14 Ca 0.18 0.22 -0.00 0.00 0.00 0.00 0.00 61.98 62.38 3h3v s VAL 14 Cb -0.11 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 3h3v s VAL 14 CO 0.09 0.04 -0.09 0.29 0.00 0.00 0.00 175.10 175.42 3h3v n LYS 15 N 2.27 0.22 -4.34 2.72 4.76 -1.26 -5.05 118.16 117.49 3h3v n LYS 15 Ca 0.08 0.06 -0.21 0.00 -2.87 0.00 0.00 58.31 55.37 3h3v n LYS 15 Cb 0.38 -1.12 -0.11 0.00 -1.84 0.00 0.00 35.03 32.35 3h3v n LYS 15 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3h3v s GLU 16 N -2.18 1.31 -0.24 1.97 2.02 -1.26 -4.18 118.70 116.13 3h3v s GLU 16 Ca -0.13 -1.47 0.00 0.00 0.02 0.00 0.00 54.97 53.39 3h3v s GLU 16 Cb 0.04 -1.30 0.07 0.00 0.10 0.00 0.00 34.13 33.04 3h3v s GLU 16 CO 0.20 0.25 -0.01 0.08 0.02 0.00 0.00 175.26 175.80 3h3v s VAL 17 N -2.31 1.33 -0.40 2.63 1.01 -0.67 -4.96 120.40 117.03 3h3v s VAL 17 Ca 0.18 -1.21 -0.17 0.00 0.00 0.00 0.00 61.98 60.78 3h3v s VAL 17 Cb -0.04 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.64 3h3v s VAL 17 CO 0.07 -0.22 0.45 -1.10 0.00 0.00 0.00 175.10 174.30 3h3v s GLN 18 N 1.47 3.25 -0.06 2.72 -1.52 -1.26 -0.72 119.66 123.53 3h3v s GLN 18 Ca -0.02 -0.60 -0.19 0.00 -1.95 0.00 0.00 55.36 52.60 3h3v s GLN 18 Cb -0.18 -3.92 -0.05 0.00 -0.22 0.00 0.00 33.01 28.64 3h3v s GLN 18 CO -0.09 -0.78 0.51 -0.06 -0.25 0.00 0.00 175.29 174.62 3h3v s PHE 19 N 2.20 3.60 0.00 0.91 2.99 -0.19 -5.03 117.98 122.45 3h3v s PHE 19 Ca 0.14 1.01 0.00 0.00 0.00 0.00 0.00 56.93 58.08 3h3v s PHE 19 Cb -0.17 -2.54 0.00 0.00 0.00 0.00 0.00 43.02 40.31 3h3v s PHE 19 CO 0.14 0.29 0.00 0.41 -0.00 0.00 0.00 175.22 176.06 3h3v n GLY 20 N 2.80 3.42 3.25 4.36 0.00 -1.25 -3.49 105.19 114.28 3h3v n GLY 20 Ca -0.08 -1.11 -0.23 0.00 0.00 0.00 0.00 46.02 44.61 3h3v n GLY 20 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3v s LEU 21 N 0.00 2.27 0.17 0.99 1.43 0.50 -4.32 118.68 119.73 3h3v s LEU 21 Ca 0.00 -0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 52.16 3h3v s LEU 21 Cb 0.00 -0.81 -0.08 0.00 0.03 0.00 0.00 46.19 45.34 3h3v s LEU 21 CO 0.00 0.04 1.11 -0.36 0.23 0.00 0.00 176.35 177.37 3h3v s PHE 22 N -1.13 3.58 -0.01 0.29 0.40 -1.26 -4.75 117.98 115.09 3h3v s PHE 22 Ca 0.05 1.58 -0.21 0.00 -0.60 0.00 0.00 56.93 57.74 3h3v s PHE 22 Cb -0.10 -3.29 -0.05 0.00 0.51 0.00 0.00 43.02 40.09 3h3v s PHE 22 CO 0.03 -0.67 0.63 -1.54 0.70 0.00 0.00 175.22 174.38 3h3v s SER 23 N -0.04 6.99 0.00 1.36 1.04 -1.26 -4.92 113.70 116.88 3h3v s SER 23 Ca 0.50 1.19 0.00 0.00 0.48 0.00 0.00 55.95 58.12 3h3v s SER 23 Cb -0.30 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.44 3h3v s SER 23 CO 0.35 0.05 0.76 -0.81 0.98 0.00 0.00 173.24 174.57 3h3v n PRO 24 N 2.96 0.00 -0.13 4.02 -0.04 -1.26 -0.64 135.00 139.91 3h3v n PRO 24 Ca -0.05 0.27 -0.20 0.00 -0.04 0.00 0.00 63.50 63.48 3h3v n PRO 24 Cb 0.51 -1.72 -0.12 0.00 -0.04 0.00 0.00 33.50 32.13 3h3v n PRO 24 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3h3v n GLU 25 N -1.26 0.64 -0.22 0.54 4.71 -1.26 -4.06 120.64 119.72 3h3v n GLU 25 Ca 0.00 0.17 -0.00 0.00 -0.01 0.00 0.00 57.16 57.31 3h3v n GLU 25 Cb 0.22 -1.51 0.11 0.00 -1.01 0.00 0.00 31.44 29.25 3h3v n GLU 25 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 3h3v h GLU 26 N -0.15 0.56 -0.91 3.49 4.81 -1.27 0.38 114.58 121.49 3h3v h GLU 26 Ca -0.60 -0.03 0.22 0.00 -0.13 0.00 0.00 59.36 58.82 3h3v h GLU 26 Cb 1.86 -0.13 -0.12 0.00 0.63 0.00 0.00 28.75 30.99 3h3v h GLU 26 CO -0.14 0.37 0.42 0.28 -0.73 0.00 0.00 179.01 179.20 3h3v h VAL 27 N 0.57 0.49 0.21 0.32 2.07 -1.60 0.27 116.25 118.57 3h3v h VAL 27 Ca 0.32 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 3h3v h VAL 27 Cb 0.30 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 3h3v h VAL 27 CO -0.24 0.08 -0.10 0.03 0.02 0.00 0.00 177.57 177.36 3h3v h ARG 28 N 0.42 -0.27 -0.76 1.57 3.08 -0.57 -1.75 114.38 116.10 3h3v h ARG 28 Ca 0.57 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.71 3h3v h ARG 28 Cb 1.07 0.06 -0.10 0.00 0.08 0.00 0.00 29.97 31.08 3h3v h ARG 28 CO -0.52 0.08 -0.54 0.00 -1.07 0.00 0.00 179.97 177.92 3h3v h ALA 29 N 0.01 -0.59 0.23 0.04 0.00 0.22 -2.47 119.26 116.69 3h3v h ALA 29 Ca -0.03 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3h3v h ALA 29 Cb 0.47 1.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 3h3v h ALA 29 CO 0.05 -0.94 -0.19 0.82 0.00 0.00 0.00 179.25 178.98 3h3v h ILE 30 N -0.12 0.59 -1.30 0.00 2.04 -0.65 -3.45 117.51 114.62 3h3v h ILE 30 Ca 0.12 0.00 -0.71 0.00 1.00 0.00 0.00 64.86 65.27 3h3v h ILE 30 Cb 0.44 0.59 0.08 0.00 -0.74 0.00 0.00 36.82 37.18 3h3v h ILE 30 CO -0.78 0.00 -0.04 -0.24 0.00 0.00 0.00 178.15 177.09 3h3v n SER 31 N -5.32 0.06 -0.24 1.72 2.88 -0.66 -4.86 113.62 107.21 3h3v n SER 31 Ca -0.08 1.15 0.04 0.00 -1.33 0.00 0.00 58.87 58.64 3h3v n SER 31 Cb 0.23 -1.02 0.02 0.00 -0.75 0.00 0.00 64.21 62.68 3h3v n SER 31 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3h3v n VAL 32 N 1.07 0.00 -3.93 2.46 0.24 -0.70 -4.96 118.33 112.52 3h3v n VAL 32 Ca 0.18 -0.47 -0.15 0.00 -2.04 0.00 0.00 64.34 61.85 3h3v n VAL 32 Cb 0.18 1.13 -0.15 0.00 -1.47 0.00 0.00 33.84 33.52 3h3v n VAL 32 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h3v s ALA 33 N -0.82 0.23 0.03 2.33 0.00 -1.26 -4.64 121.76 117.63 3h3v s ALA 33 Ca 0.08 0.10 -0.26 0.00 0.00 0.00 0.00 51.96 51.87 3h3v s ALA 33 Cb 0.06 -0.21 -0.17 0.00 0.00 0.00 0.00 23.12 22.80 3h3v s ALA 33 CO 0.13 -0.03 1.40 0.87 0.00 0.00 0.00 175.76 178.12 3h3v h LYS 34 N 6.84 -0.40 -4.20 0.00 6.56 -1.86 -3.14 116.57 120.36 3h3v h LYS 34 Ca -0.37 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.24 3h3v h LYS 34 Cb 1.16 0.09 0.00 0.00 -0.57 0.00 0.00 32.23 32.91 3h3v h LYS 34 CO 0.49 -0.13 -0.05 -0.89 -2.06 0.00 0.00 179.45 176.81 3h3v n ILE 35 N -5.18 -5.88 -0.08 1.86 5.41 -1.24 -4.18 119.36 110.08 3h3v n ILE 35 Ca -0.10 -0.01 -0.11 0.00 1.00 0.00 0.00 62.75 63.53 3h3v n ILE 35 Cb 0.25 -5.34 -0.10 0.00 -0.71 0.00 0.00 39.64 33.74 3h3v n ILE 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 3h3v n ARG 36 N -1.21 0.95 -2.73 0.38 1.74 -1.24 -4.70 116.66 109.85 3h3v n ARG 36 Ca 0.01 0.06 -0.37 0.00 -0.77 0.00 0.00 57.85 56.79 3h3v n ARG 36 Cb 0.45 -1.38 -0.06 0.00 -1.02 0.00 0.00 32.46 30.46 3h3v n ARG 36 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3h3v s PHE 37 N -2.37 3.58 -0.06 -1.55 0.40 -1.26 -4.99 117.98 111.73 3h3v s PHE 37 Ca -0.18 1.74 -0.10 0.00 -0.60 0.00 0.00 56.93 57.79 3h3v s PHE 37 Cb 0.06 -2.97 -0.30 0.00 0.51 0.00 0.00 43.02 40.32 3h3v s PHE 37 CO 0.50 0.01 0.62 -1.00 0.70 0.00 0.00 175.22 176.05 3h3v h PRO 38 N 2.97 0.37 -6.75 0.24 0.13 -1.91 -3.28 132.00 123.77 3h3v h PRO 38 Ca -0.47 -0.64 -0.54 0.00 -0.87 0.00 0.00 66.00 63.48 3h3v h PRO 38 Cb 1.20 0.24 0.21 0.00 0.13 0.00 0.00 31.00 32.77 3h3v h PRO 38 CO 0.64 1.30 -0.56 0.39 -0.23 0.00 0.00 178.00 179.54 3h3v n GLU 39 N -3.57 -0.17 0.06 0.86 1.02 -1.26 -4.71 120.64 112.88 3h3v n GLU 39 Ca -0.26 -0.01 -0.12 0.00 -0.02 0.00 0.00 57.16 56.76 3h3v n GLU 39 Cb 1.07 -1.84 -0.08 0.00 -0.02 0.00 0.00 31.44 30.57 3h3v n GLU 39 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3h3v h THR 40 N -1.32 0.97 0.00 2.62 2.02 -1.92 -3.31 112.91 111.96 3h3v h THR 40 Ca -0.44 -1.02 0.00 0.00 0.77 0.00 0.00 66.41 65.72 3h3v h THR 40 Cb 1.29 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 69.25 3h3v h THR 40 CO 0.36 0.22 0.00 1.15 0.37 0.00 0.00 175.52 177.62 3h3v n MET 41 N -4.95 0.00 -3.17 6.66 0.00 -1.26 -4.15 117.12 110.25 3h3v n MET 41 Ca -0.08 0.00 -0.06 0.00 0.00 0.00 0.00 57.70 57.55 3h3v n MET 41 Cb 0.26 0.00 0.01 0.00 0.00 0.00 0.00 33.22 33.49 3h3v n MET 41 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 3h3v n ASP 42 N 0.00 -6.64 -3.14 3.17 8.00 -1.26 -4.51 116.55 112.16 3h3v n ASP 42 Ca 0.00 0.46 -0.14 0.00 0.71 0.00 0.00 54.79 55.82 3h3v n ASP 42 Cb 0.00 -2.22 -0.02 0.00 -0.02 0.00 0.00 41.12 38.86 3h3v n ASP 42 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 3h3v n GLU 43 N 0.93 0.88 -1.41 -1.24 0.28 -0.92 -2.77 120.64 116.39 3h3v n GLU 43 Ca -0.01 -0.98 0.00 0.00 -0.16 0.00 0.00 57.16 56.01 3h3v n GLU 43 Cb 0.46 -2.27 0.00 0.00 1.43 0.00 0.00 31.44 31.06 3h3v n GLU 43 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 3h3v n THR 44 N 4.92 -0.10 0.00 3.84 -1.04 -1.26 -3.85 114.28 116.79 3h3v n THR 44 Ca 0.23 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.24 3h3v n THR 44 Cb 0.11 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 66.74 3h3v n THR 44 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h3v n GLN 45 N -0.78 0.00 -1.58 -2.82 6.02 -1.11 -4.91 117.38 112.20 3h3v n GLN 45 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.56 3h3v n GLN 45 Cb 0.36 -1.82 -0.03 0.00 1.02 0.00 0.00 30.24 29.77 3h3v n GLN 45 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 3h3v n THR 46 N -1.35 0.26 -1.65 5.09 -1.04 -1.25 -4.83 114.28 109.51 3h3v n THR 46 Ca 0.00 -0.50 -0.49 0.00 -2.04 0.00 0.00 64.05 61.02 3h3v n THR 46 Cb 0.00 -2.51 -0.05 0.00 -1.82 0.00 0.00 70.33 65.95 3h3v n THR 46 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3h3v n ARG 47 N 8.76 1.92 0.00 -2.82 1.74 -1.26 -2.17 116.66 122.83 3h3v n ARG 47 Ca 0.32 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 58.09 3h3v n ARG 47 Cb 0.44 -2.60 0.00 0.00 -1.02 0.00 0.00 32.46 29.28 3h3v n ARG 47 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h3v n ALA 48 N 7.20 0.00 -3.29 7.54 0.00 -1.26 -4.95 120.51 125.74 3h3v n ALA 48 Ca 0.26 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.57 3h3v n ALA 48 Cb 0.28 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.62 3h3v n ALA 48 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3h3v s LYS 49 N -0.17 0.38 0.12 0.00 1.02 -1.26 -4.18 119.74 115.65 3h3v s LYS 49 Ca 0.00 0.49 -0.11 0.00 0.02 0.00 0.00 55.97 56.37 3h3v s LYS 49 Cb 0.00 0.16 -0.06 0.00 -0.52 0.00 0.00 37.83 37.40 3h3v s LYS 49 CO 0.00 -0.06 0.47 0.42 -0.92 0.00 0.00 175.35 175.26 3h3v s ILE 50 N 0.33 4.99 -1.01 2.17 1.01 -1.26 -4.81 121.20 122.63 3h3v s ILE 50 Ca -0.01 0.57 0.00 0.00 0.00 0.00 0.00 60.65 61.20 3h3v s ILE 50 Cb -0.03 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.76 3h3v s ILE 50 CO -0.01 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.75 3h3v n GLY 51 N 0.70 0.00 0.00 6.18 0.00 -1.26 -3.65 105.19 107.15 3h3v n GLY 51 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3h3v n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3v n GLY 52 N 0.21 1.23 3.74 -0.02 0.00 -1.26 -4.49 105.19 104.60 3h3v n GLY 52 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3h3v n GLY 52 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h3v s LEU 53 N -1.43 2.71 0.01 0.99 0.20 -1.24 -3.60 118.68 116.31 3h3v s LEU 53 Ca 0.00 -1.38 0.00 0.00 0.69 0.00 0.00 54.13 53.44 3h3v s LEU 53 Cb 0.00 -1.02 0.00 0.00 -0.43 0.00 0.00 46.19 44.74 3h3v s LEU 53 CO 0.00 -0.71 0.00 0.59 -0.29 0.00 0.00 176.35 175.94 3h3v n ASN 54 N -1.26 -1.77 -4.20 3.68 5.03 -1.26 -4.07 115.26 111.41 3h3v n ASN 54 Ca -0.09 1.15 -0.32 0.00 0.87 0.00 0.00 54.58 56.20 3h3v n ASN 54 Cb 0.66 -2.19 -0.05 0.00 -1.02 0.00 0.00 39.78 37.17 3h3v n ASN 54 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3h3v n ASP 55 N 1.92 -0.83 -0.10 6.41 2.03 -1.25 -4.51 116.55 120.21 3h3v n ASP 55 Ca 0.00 -1.12 0.00 0.00 0.52 0.00 0.00 54.79 54.19 3h3v n ASP 55 Cb 0.00 -2.38 0.00 0.00 -0.72 0.00 0.00 41.12 38.02 3h3v n ASP 55 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3h3v n PRO 56 N -4.41 0.80 0.00 -0.67 -0.02 -1.26 -4.35 135.00 125.09 3h3v n PRO 56 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 3h3v n PRO 56 Cb 0.62 -1.08 0.00 0.00 -0.02 0.00 0.00 33.50 33.02 3h3v n PRO 56 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h3v n ARG 57 N -0.38 0.00 -0.31 -0.52 1.74 -1.26 -4.74 116.66 111.19 3h3v n ARG 57 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 3h3v n ARG 57 Cb 0.04 0.00 0.18 0.00 -1.02 0.00 0.00 32.46 31.66 3h3v n ARG 57 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3h3v n LEU 58 N 0.00 0.00 -4.06 0.55 4.77 -1.26 -4.36 117.00 112.64 3h3v n LEU 58 Ca 0.00 -0.52 -0.23 0.00 -0.03 0.00 0.00 56.01 55.23 3h3v n LEU 58 Cb 0.00 -0.71 0.13 0.00 -2.33 0.00 0.00 43.42 40.51 3h3v n LEU 58 CO 0.00 -2.40 -0.39 0.61 -1.33 0.00 0.00 177.39 173.88 3h3v n GLY 59 N -2.72 -2.44 3.17 -0.72 0.00 -1.26 -4.30 105.19 96.92 3h3v n GLY 59 Ca 0.08 -0.66 -0.24 0.00 0.00 0.00 0.00 46.02 45.19 3h3v n GLY 59 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h3v n SER 60 N -0.47 1.42 0.00 1.61 3.41 -1.26 -3.90 113.62 114.43 3h3v n SER 60 Ca 0.03 -3.04 0.00 0.00 -0.26 0.00 0.00 58.87 55.60 3h3v n SER 60 Cb 0.44 0.91 0.00 0.00 -0.26 0.00 0.00 64.21 65.30 3h3v n SER 60 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3h3v n ILE 61 N -0.89 0.00 -0.78 -1.33 5.41 -1.26 -4.73 119.36 115.77 3h3v n ILE 61 Ca -0.07 0.00 -0.00 0.00 1.00 0.00 0.00 62.75 63.68 3h3v n ILE 61 Cb 0.58 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 39.51 3h3v n ILE 61 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3h3v n ASP 62 N 0.00 -0.13 -3.91 4.38 8.00 -1.26 -2.50 116.55 121.13 3h3v n ASP 62 Ca 0.00 0.06 -0.31 0.00 0.71 0.00 0.00 54.79 55.25 3h3v n ASP 62 Cb 0.00 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 40.97 3h3v n ASP 62 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3h3v n ARG 63 N -0.34 -1.89 -3.83 -1.24 1.74 -1.26 -4.97 116.66 104.87 3h3v n ARG 63 Ca 0.00 0.34 -0.26 0.00 -0.77 0.00 0.00 57.85 57.15 3h3v n ARG 63 Cb 0.07 -3.98 -0.17 0.00 -1.02 0.00 0.00 32.46 27.36 3h3v n ARG 63 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3h3v s ASN 64 N -3.93 2.41 0.14 0.55 0.01 -1.04 -5.05 114.94 108.02 3h3v s ASN 64 Ca 0.24 -0.48 -0.14 0.00 -0.71 0.00 0.00 52.86 51.77 3h3v s ASN 64 Cb -0.10 -0.72 0.10 0.00 0.41 0.00 0.00 41.25 40.94 3h3v s ASN 64 CO 0.90 -0.20 1.04 0.18 -1.51 0.00 0.00 177.10 177.52 3h3v n LEU 65 N 4.99 -0.51 -1.73 0.60 4.77 -1.26 -4.64 117.00 119.22 3h3v n LEU 65 Ca -0.10 1.18 -0.18 0.00 -0.03 0.00 0.00 56.01 56.88 3h3v n LEU 65 Cb 0.49 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 3h3v n LEU 65 CO 0.14 -1.03 -0.09 0.29 -1.33 0.00 0.00 177.39 175.38 3h3v n LYS 66 N -4.95 0.00 0.00 3.23 5.02 -1.26 -3.12 118.16 117.08 3h3v n LYS 66 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 3h3v n LYS 66 Cb 0.24 -0.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.86 3h3v n LYS 66 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h3v n GLN 68 N 0.00 -1.53 0.00 0.00 6.02 -1.26 -2.31 117.38 118.30 3h3v n GLN 68 Ca 0.00 1.06 0.00 0.00 -0.01 0.00 0.00 57.00 58.05 3h3v n GLN 68 Cb 0.00 -4.98 0.00 0.00 1.02 0.00 0.00 30.24 26.28 3h3v n GLN 68 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 3h3v n THR 69 N -2.65 0.00 0.05 5.09 -1.04 -1.26 -4.62 114.28 109.85 3h3v n THR 69 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 3h3v n THR 69 Cb 0.57 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 69.09 3h3v n THR 69 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h3v n GLN 71 N -1.24 0.00 0.00 0.00 10.64 -1.25 -4.70 117.38 120.83 3h3v n GLN 71 Ca -0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 3h3v n GLN 71 Cb 0.55 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.93 3h3v n GLN 71 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 3h3v n GLU 72 N 11.89 0.00 -1.84 2.61 -0.58 -1.26 -4.70 120.64 126.77 3h3v n GLU 72 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3h3v n GLU 72 Cb 0.00 -0.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.69 3h3v n GLU 72 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h3v n GLY 73 N 0.00 -3.53 7.00 0.62 0.00 -1.18 -4.62 105.19 103.48 3h3v n GLY 73 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 3h3v n GLY 73 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3h3v n MET 74 N 0.89 0.00 -1.56 1.61 2.81 -1.26 -4.33 117.12 115.28 3h3v n MET 74 Ca 0.00 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.48 3h3v n MET 74 Cb 0.00 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.47 3h3v n MET 74 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3h3v n ASN 75 N 4.48 2.69 0.00 7.83 2.85 -1.26 -1.47 115.26 130.37 3h3v n ASN 75 Ca 0.00 -0.05 0.00 0.00 -0.11 0.00 0.00 54.58 54.42 3h3v n ASN 75 Cb 0.00 -1.52 0.00 0.00 1.24 0.00 0.00 39.78 39.50 3h3v n ASN 75 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 3h3v n GLU 76 N 8.80 0.00 -2.98 1.20 4.07 -1.26 -5.00 120.64 125.46 3h3v n GLU 76 Ca 0.35 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 57.01 3h3v n GLU 76 Cb 0.45 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.79 3h3v n GLU 76 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3h3v n PRO 78 N 6.94 -2.65 -1.55 0.00 -0.04 -1.26 -4.82 135.00 131.62 3h3v n PRO 78 Ca -0.03 -0.33 -0.31 0.00 -0.04 0.00 0.00 63.50 62.79 3h3v n PRO 78 Cb 0.45 -0.43 0.06 0.00 -0.04 0.00 0.00 33.50 33.53 3h3v n PRO 78 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3h3v s GLY 79 N -2.24 1.76 -0.32 0.55 0.00 -1.26 -4.83 107.32 100.98 3h3v s GLY 79 Ca 0.15 0.21 0.02 0.00 0.00 0.00 0.00 44.72 45.10 3h3v s GLY 79 CO 0.13 0.53 0.05 0.30 0.00 0.00 0.00 173.10 174.11 3h3v s HIS 80 N -2.89 2.84 0.55 1.90 3.76 -1.26 -4.93 115.29 115.27 3h3v s HIS 80 Ca 0.60 -2.38 -0.21 0.00 -0.15 0.00 0.00 55.06 52.92 3h3v s HIS 80 Cb -0.16 -2.31 -0.06 0.00 1.11 0.00 0.00 32.58 31.17 3h3v s HIS 80 CO 0.52 -0.90 1.16 1.19 -0.85 0.00 0.00 174.74 175.86 3h3v n PHE 81 N 4.52 1.58 -4.01 1.40 3.01 -1.26 -4.25 117.46 118.46 3h3v n PHE 81 Ca -0.00 0.45 -0.00 0.00 1.01 0.00 0.00 57.45 58.90 3h3v n PHE 81 Cb 0.42 -2.26 -0.00 0.00 -0.01 0.00 0.00 39.48 37.63 3h3v n PHE 81 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3h3v n GLY 82 N 1.02 4.11 0.00 1.37 0.00 -0.98 -1.71 105.19 109.00 3h3v n GLY 82 Ca 0.12 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.17 3h3v n GLY 82 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3h3v n HIS 83 N -0.01 -0.67 -3.56 1.61 1.44 -1.19 0.65 115.22 113.50 3h3v n HIS 83 Ca -0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 3h3v n HIS 83 Cb 0.01 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.06 3h3v n HIS 83 CO 0.00 0.00 0.00 -1.50 -2.81 0.00 0.00 176.34 172.03 3h3v s ILE 84 N -2.72 -0.17 -0.45 0.61 2.07 -0.60 -4.26 121.20 115.69 3h3v s ILE 84 Ca 0.00 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 58.96 3h3v s ILE 84 Cb 0.00 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.62 3h3v s ILE 84 CO 0.00 0.00 1.05 -1.81 -1.91 0.00 0.00 174.94 172.27 3h3v s ASP 85 N 1.70 6.62 0.85 4.50 1.01 -1.26 -1.54 116.67 128.55 3h3v s ASP 85 Ca -0.07 0.43 -0.11 0.00 0.71 0.00 0.00 52.55 53.51 3h3v s ASP 85 Cb -0.04 -2.51 0.10 0.00 1.01 0.00 0.00 42.92 41.48 3h3v s ASP 85 CO -0.15 -1.12 1.09 -0.76 0.21 0.00 0.00 175.17 174.44 3h3v s LEU 86 N 4.07 2.53 -0.12 1.23 1.43 -1.19 -4.98 118.68 121.66 3h3v s LEU 86 Ca 0.43 1.59 -0.17 0.00 -1.03 0.00 0.00 54.13 54.95 3h3v s LEU 86 Cb -0.09 -4.11 -0.15 0.00 0.03 0.00 0.00 46.19 41.87 3h3v s LEU 86 CO 0.27 -2.40 0.46 0.00 0.23 0.00 0.00 176.35 174.91 3h3v h ALA 87 N -1.38 -0.01 -2.17 4.21 0.00 -1.89 -3.47 119.26 114.54 3h3v h ALA 87 Ca -0.47 -0.29 -0.49 0.00 0.00 0.00 0.00 54.91 53.66 3h3v h ALA 87 Cb 1.27 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.92 3h3v h ALA 87 CO 0.54 -0.01 -0.72 0.15 0.00 0.00 0.00 179.25 179.21 3h3v s LYS 88 N -1.99 1.45 0.39 0.00 1.02 -1.26 -5.07 119.74 114.28 3h3v s LYS 88 Ca -0.11 -1.68 -0.27 0.00 0.02 0.00 0.00 55.97 53.93 3h3v s LYS 88 Cb -0.02 -1.22 -0.09 0.00 -0.52 0.00 0.00 37.83 35.98 3h3v s LYS 88 CO 0.40 0.15 1.34 -1.25 -0.92 0.00 0.00 175.35 175.07 3h3v s PRO 89 N -3.66 4.05 0.11 -1.68 0.04 -1.26 -4.95 135.00 127.65 3h3v s PRO 89 Ca 0.26 2.25 0.05 0.00 0.04 0.00 0.00 61.00 63.60 3h3v s PRO 89 Cb 0.00 -2.85 -0.04 0.00 0.04 0.00 0.00 34.50 31.66 3h3v s PRO 89 CO 0.10 -0.45 -0.13 0.08 0.04 0.00 0.00 177.00 176.63 3h3v s VAL 90 N -1.21 1.18 0.00 -0.36 1.01 -1.11 -4.66 120.40 115.24 3h3v s VAL 90 Ca 0.55 -1.63 0.00 0.00 0.00 0.00 0.00 61.98 60.89 3h3v s VAL 90 Cb -0.40 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.57 3h3v s VAL 90 CO 0.52 -0.43 0.00 0.49 0.00 0.00 0.00 175.10 175.68 3h3v n PHE 91 N 0.65 -2.28 -3.72 5.22 3.72 -1.26 -0.74 117.46 119.04 3h3v n PHE 91 Ca -0.16 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 56.94 3h3v n PHE 91 Cb 0.57 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.98 3h3v n PHE 91 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3h3v s HIS 92 N -0.66 2.05 0.00 1.38 5.65 -1.23 -4.27 115.29 118.21 3h3v s HIS 92 Ca 0.00 -2.48 0.00 0.00 0.25 0.00 0.00 55.06 52.83 3h3v s HIS 92 Cb 0.00 -1.92 0.00 0.00 -1.18 0.00 0.00 32.58 29.48 3h3v s HIS 92 CO 0.00 -0.77 0.00 0.28 -0.65 0.00 0.00 174.74 173.60 3h3v n VAL 93 N 3.45 0.00 -0.01 0.89 0.31 -1.26 0.35 118.33 122.06 3h3v n VAL 93 Ca 0.10 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.36 3h3v n VAL 93 Cb 0.35 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.15 3h3v n VAL 93 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h3v n GLY 94 N -0.47 -1.04 0.09 2.92 0.00 -1.26 -4.13 105.19 101.30 3h3v n GLY 94 Ca 0.00 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.09 3h3v n GLY 94 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h3v n PHE 95 N -3.00 0.80 -0.29 1.61 0.99 1.08 -3.85 117.46 114.80 3h3v n PHE 95 Ca -0.16 0.23 0.11 0.00 -0.00 0.00 0.00 57.45 57.63 3h3v n PHE 95 Cb 1.01 -0.85 0.27 0.00 -1.00 0.00 0.00 39.48 38.91 3h3v n PHE 95 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 3h3v h ILE 96 N 0.00 0.45 -0.78 4.37 2.04 -1.62 0.28 117.51 122.26 3h3v h ILE 96 Ca 0.00 -0.11 0.15 0.00 1.00 0.00 0.00 64.86 65.89 3h3v h ILE 96 Cb 0.73 0.10 -0.10 0.00 -0.74 0.00 0.00 36.82 36.81 3h3v h ILE 96 CO 0.00 0.06 0.34 0.00 0.00 0.00 0.00 178.15 178.55 3h3v h ALA 97 N 1.70 1.12 0.16 1.87 0.00 -1.84 -2.49 119.26 119.79 3h3v h ALA 97 Ca 0.52 0.11 -0.29 0.00 0.00 0.00 0.00 54.91 55.25 3h3v h ALA 97 Cb 0.97 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.83 3h3v h ALA 97 CO -0.55 -0.18 -1.38 -0.22 0.00 0.00 0.00 179.25 176.91 3h3v h LYS 98 N 0.49 0.35 -0.77 0.00 3.64 -0.88 -3.13 116.57 116.26 3h3v h LYS 98 Ca 0.43 -0.59 0.20 0.00 -1.27 0.00 0.00 60.65 59.42 3h3v h LYS 98 Cb 0.65 0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.65 3h3v h LYS 98 CO -0.40 1.28 0.54 0.82 -2.27 0.00 0.00 179.45 179.43 3h3v h ILE 99 N -0.14 0.66 0.29 2.00 2.04 -0.45 0.59 117.51 122.50 3h3v h ILE 99 Ca -0.27 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 3h3v h ILE 99 Cb 1.89 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 3h3v h ILE 99 CO 0.15 0.03 -0.14 0.50 0.00 0.00 0.00 178.15 178.69 3h3v h LYS 100 N 0.14 -0.37 -0.53 2.37 3.11 -1.54 -2.93 116.57 116.81 3h3v h LYS 100 Ca 0.38 0.03 0.15 0.00 -2.81 0.00 0.00 60.65 58.40 3h3v h LYS 100 Cb 1.29 0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 32.58 3h3v h LYS 100 CO -0.06 -0.25 0.70 0.87 -2.81 0.00 0.00 179.45 177.91 3h3v h LYS 101 N -0.70 0.00 0.01 1.90 1.57 -1.25 -0.35 116.57 117.75 3h3v h LYS 101 Ca -0.04 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 3h3v h LYS 101 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3h3v h LYS 101 CO 0.06 0.00 -0.13 0.28 -0.57 0.00 0.00 179.45 179.09 3h3v h VAL 102 N 0.00 1.62 -0.65 0.50 2.07 -0.91 -3.28 116.25 115.59 3h3v h VAL 102 Ca 0.25 -2.00 0.14 0.00 0.82 0.00 0.00 66.70 65.92 3h3v h VAL 102 Cb 1.64 2.94 -0.04 0.00 -1.52 0.00 0.00 31.29 34.32 3h3v h VAL 102 CO -0.00 0.53 0.45 0.00 0.02 0.00 0.00 177.57 178.57 3h3v n GLU 104 N -4.44 0.18 -0.05 0.00 1.02 -1.12 -2.66 120.64 113.57 3h3v n GLU 104 Ca 0.12 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 3h3v n GLU 104 Cb 0.53 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.32 3h3v n GLU 104 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h3v s VAL 106 N -2.81 1.95 0.30 0.00 1.01 -0.97 -2.67 120.40 117.21 3h3v s VAL 106 Ca -0.07 -2.09 -0.07 0.00 0.00 0.00 0.00 61.98 59.74 3h3v s VAL 106 Cb 0.08 -2.00 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 3h3v s VAL 106 CO 0.72 -0.39 0.60 0.00 0.00 0.00 0.00 175.10 176.03 3h3v s MET 108 N -3.43 1.71 0.00 0.00 1.00 -1.26 -2.10 119.30 115.21 3h3v s MET 108 Ca 0.46 -0.75 0.00 0.00 0.00 0.00 0.00 55.69 55.41 3h3v s MET 108 Cb -0.11 -2.22 0.00 0.00 0.00 0.00 0.00 34.83 32.50 3h3v s MET 108 CO 0.28 -1.49 0.00 0.72 0.00 0.00 0.00 175.02 174.53 3h3v n HIS 109 N -2.97 0.00 -0.05 -0.03 8.25 -1.26 -4.21 115.22 114.95 3h3v n HIS 109 Ca 0.13 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.51 3h3v n HIS 109 Cb 0.60 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.69 3h3v n HIS 109 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h3v n GLY 111 N 2.06 1.75 3.43 0.00 0.00 -0.89 -4.82 105.19 106.72 3h3v n GLY 111 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 3h3v n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h3v s LYS 112 N -0.50 1.56 0.99 1.61 2.20 -1.26 -3.64 119.74 120.71 3h3v s LYS 112 Ca 0.00 -1.66 -0.16 0.00 -0.36 0.00 0.00 55.97 53.79 3h3v s LYS 112 Cb 0.00 -1.66 -0.02 0.00 -1.51 0.00 0.00 37.83 34.64 3h3v s LYS 112 CO 0.00 0.32 -0.10 1.28 -0.36 0.00 0.00 175.35 176.49 3h3v n LEU 113 N -0.31 -2.22 -1.11 5.43 4.77 -1.26 -2.49 117.00 119.80 3h3v n LEU 113 Ca -0.08 0.19 0.02 0.00 -0.03 0.00 0.00 56.01 56.11 3h3v n LEU 113 Cb 0.59 -1.00 0.24 0.00 -2.33 0.00 0.00 43.42 40.91 3h3v n LEU 113 CO 0.35 -4.07 0.75 0.18 -1.33 0.00 0.00 177.39 173.27 3h3v n LEU 114 N 0.16 4.22 -3.15 2.23 4.77 -1.09 -4.77 117.00 119.38 3h3v n LEU 114 Ca 0.03 -3.34 0.04 0.00 -0.03 0.00 0.00 56.01 52.71 3h3v n LEU 114 Cb 0.57 -0.60 -0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3h3v n LEU 114 CO 0.51 0.92 0.24 -0.76 -1.33 0.00 0.00 177.39 176.97 3h3v s LEU 115 N -3.02 -1.23 0.62 2.23 1.43 -1.26 -4.87 118.68 112.58 3h3v s LEU 115 Ca 0.44 0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 53.84 3h3v s LEU 115 Cb 0.38 1.85 0.06 0.00 0.03 0.00 0.00 46.19 48.51 3h3v s LEU 115 CO 0.06 -0.23 0.87 -1.81 0.23 0.00 0.00 176.35 175.47 3h3v s ASP 116 N 2.87 4.96 0.00 2.29 1.01 -1.26 -4.91 116.67 121.63 3h3v s ASP 116 Ca 0.15 -0.03 0.01 0.00 0.71 0.00 0.00 52.55 53.39 3h3v s ASP 116 Cb -0.09 -0.68 0.07 0.00 1.01 0.00 0.00 42.92 43.23 3h3v s ASP 116 CO -0.23 -1.40 0.79 -0.62 0.21 0.00 0.00 175.17 173.92 3h3v n GLU 117 N -2.56 0.02 -0.02 8.23 4.71 -1.26 -0.27 120.64 129.49 3h3v n GLU 117 Ca 0.10 0.22 -0.13 0.00 -0.01 0.00 0.00 57.16 57.34 3h3v n GLU 117 Cb 0.60 -1.50 -0.00 0.00 -1.01 0.00 0.00 31.44 29.53 3h3v n GLU 117 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3h3v h HIS 118 N 0.00 0.89 -3.43 -0.32 3.86 -2.00 -3.42 115.15 110.73 3h3v h HIS 118 Ca 0.00 -0.34 -0.54 0.00 -1.16 0.00 0.00 60.37 58.32 3h3v h HIS 118 Cb 0.01 -0.16 -0.04 0.00 1.06 0.00 0.00 27.41 28.28 3h3v h HIS 118 CO 0.00 1.13 0.14 1.21 0.86 0.00 0.00 177.93 181.27 3h3v s ASN 119 N -6.97 7.22 0.01 2.45 3.84 0.63 -4.80 114.94 117.31 3h3v s ASN 119 Ca -0.09 1.45 -0.19 0.00 0.21 0.00 0.00 52.86 54.25 3h3v s ASN 119 Cb 0.10 -2.46 -0.25 0.00 -0.55 0.00 0.00 41.25 38.09 3h3v s ASN 119 CO 0.87 0.06 1.08 -0.08 -2.79 0.00 0.00 177.10 176.24 3h3v h GLU 120 N 5.39 0.45 -0.24 0.43 4.81 -1.84 -2.98 114.58 120.61 3h3v h GLU 120 Ca -0.45 -0.54 0.07 0.00 -0.13 0.00 0.00 59.36 58.32 3h3v h GLU 120 Cb 1.21 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.74 3h3v h GLU 120 CO 0.70 1.19 0.17 -0.07 -0.73 0.00 0.00 179.01 180.26 3h3v h LEU 121 N -0.04 0.00 -0.18 1.64 3.38 -1.95 -1.62 115.31 116.53 3h3v h LEU 121 Ca -0.11 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 3h3v h LEU 121 Cb 1.48 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.23 3h3v h LEU 121 CO 0.15 0.00 -0.23 -0.03 0.09 0.00 0.00 178.44 178.41 3h3v h MET 122 N 0.00 0.48 0.16 1.13 4.05 -1.87 -3.23 114.93 115.64 3h3v h MET 122 Ca 0.11 -0.27 0.01 0.00 -0.28 0.00 0.00 59.70 59.27 3h3v h MET 122 Cb 0.45 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 31.22 3h3v h MET 122 CO -0.00 0.86 -0.49 0.00 0.23 0.00 0.00 176.91 177.51 3h3v h ARG 123 N 0.14 -0.72 -1.08 0.39 3.08 -1.13 0.13 114.38 115.18 3h3v h ARG 123 Ca 0.02 0.05 0.36 0.00 0.07 0.00 0.00 59.98 60.48 3h3v h ARG 123 Cb 0.80 0.16 -0.15 0.00 0.08 0.00 0.00 29.97 30.87 3h3v h ARG 123 CO 0.06 -0.48 0.64 1.96 -1.07 0.00 0.00 179.97 181.07 3h3v h GLN 124 N -0.75 0.21 -0.15 0.04 4.20 -1.61 0.86 115.11 117.91 3h3v h GLN 124 Ca -0.00 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 3h3v h GLN 124 Cb 0.75 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 3h3v h GLN 124 CO -0.25 0.14 -0.05 0.00 -0.67 0.00 0.00 178.83 178.00 3h3v h ALA 125 N 1.80 0.21 0.00 3.87 0.00 -1.13 -2.48 119.26 121.53 3h3v h ALA 125 Ca 0.76 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.42 3h3v h ALA 125 Cb 1.97 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.71 3h3v h ALA 125 CO -0.57 -0.02 0.00 1.28 0.00 0.00 0.00 179.25 179.95 3h3v n LEU 126 N -4.67 0.00 -0.07 0.00 4.77 0.29 -2.28 117.00 115.03 3h3v n LEU 126 Ca -0.06 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.84 3h3v n LEU 126 Cb 0.27 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.28 3h3v n LEU 126 CO 0.37 0.00 -0.96 0.00 -1.33 0.00 0.00 177.39 175.47 3h3v n ALA 127 N -0.73 1.68 -1.58 -1.18 0.00 -0.35 -4.88 120.51 113.47 3h3v n ALA 127 Ca 0.05 -0.76 -0.14 0.00 0.00 0.00 0.00 53.44 52.60 3h3v n ALA 127 Cb 0.03 0.05 -0.07 0.00 0.00 0.00 0.00 19.45 19.46 3h3v n ALA 127 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3h3v s ILE 128 N -2.31 3.02 -0.20 0.00 1.01 -0.97 -4.87 121.20 116.88 3h3v s ILE 128 Ca -0.13 -0.02 -0.29 0.00 0.00 0.00 0.00 60.65 60.21 3h3v s ILE 128 Cb 0.05 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 3h3v s ILE 128 CO 0.45 -0.05 1.81 -0.54 0.00 0.00 0.00 174.94 176.61 3h3v s LYS 129 N 8.83 3.64 0.00 2.79 1.02 -1.26 -4.10 119.74 130.66 3h3v s LYS 129 Ca 0.91 1.82 0.00 0.00 0.02 0.00 0.00 55.97 58.73 3h3v s LYS 129 Cb -0.12 -4.15 0.00 0.00 -0.52 0.00 0.00 37.83 33.04 3h3v s LYS 129 CO 0.08 -1.50 0.00 -3.47 -0.92 0.00 0.00 175.35 169.54 3h3v n ASP 130 N 9.26 0.00 -0.40 2.83 -0.08 -1.26 -4.96 116.55 121.94 3h3v n ASP 130 Ca 0.22 0.00 0.36 0.00 -1.51 0.00 0.00 54.79 53.86 3h3v n ASP 130 Cb 0.45 0.00 0.55 0.00 2.34 0.00 0.00 41.12 44.46 3h3v n ASP 130 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3h3v n SER 131 N 0.00 0.00 -0.11 1.67 7.64 -1.26 -0.99 113.62 120.57 3h3v n SER 131 Ca 0.00 0.78 -0.22 0.00 1.01 0.00 0.00 58.87 60.44 3h3v n SER 131 Cb 0.00 -0.33 -0.12 0.00 -1.01 0.00 0.00 64.21 62.75 3h3v n SER 131 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3h3v n LYS 132 N -3.36 0.64 0.17 1.43 5.02 -1.26 -3.61 118.16 117.19 3h3v n LYS 132 Ca 0.30 0.24 0.04 0.00 -2.02 0.00 0.00 58.31 56.87 3h3v n LYS 132 Cb 1.60 -1.56 0.24 0.00 -0.02 0.00 0.00 35.03 35.28 3h3v n LYS 132 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3h3v h LYS 133 N -0.35 0.00 0.60 1.97 1.57 -1.52 -1.73 116.57 117.11 3h3v h LYS 133 Ca -0.57 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.18 3h3v h LYS 133 Cb 1.79 0.00 0.01 0.00 0.08 0.00 0.00 32.23 34.11 3h3v h LYS 133 CO -0.16 0.43 -0.29 -0.09 -0.57 0.00 0.00 179.45 178.76 3h3v h ARG 134 N 0.00 -0.78 0.00 3.15 2.43 -1.21 -0.66 114.38 117.31 3h3v h ARG 134 Ca -0.00 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3h3v h ARG 134 Cb 1.05 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 3h3v h ARG 134 CO 0.06 -0.50 0.00 0.34 -1.51 0.00 0.00 179.97 178.35 3h3v n PHE 135 N -5.32 0.00 -0.09 2.20 7.35 -1.22 0.03 117.46 120.41 3h3v n PHE 135 Ca -0.10 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.41 3h3v n PHE 135 Cb 0.33 -0.23 -0.10 0.00 0.35 0.00 0.00 39.48 39.83 3h3v n PHE 135 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3h3v h ALA 136 N 2.30 0.19 0.07 3.13 0.00 -0.87 -3.30 119.26 120.77 3h3v h ALA 136 Ca 0.00 -0.99 -0.00 0.00 0.00 0.00 0.00 54.91 53.92 3h3v h ALA 136 Cb 0.05 0.59 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3h3v h ALA 136 CO 0.00 0.56 -0.03 0.00 0.00 0.00 0.00 179.25 179.78 3h3v h ALA 137 N -0.51 -0.09 -0.37 0.00 0.00 -0.04 -2.72 119.26 115.54 3h3v h ALA 137 Ca -0.25 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.46 3h3v h ALA 137 Cb 1.12 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 3h3v h ALA 137 CO -0.15 -0.30 -0.22 -0.89 0.00 0.00 0.00 179.25 177.69 3h3v n ILE 138 N -4.90 -0.25 -0.20 0.00 5.41 0.11 -0.50 119.36 119.02 3h3v n ILE 138 Ca -0.09 1.70 0.01 0.00 1.00 0.00 0.00 62.75 65.38 3h3v n ILE 138 Cb 0.26 -2.18 0.12 0.00 -0.71 0.00 0.00 39.64 37.12 3h3v n ILE 138 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 176.55 176.30 3h3v h TRP 139 N 0.00 0.17 -0.71 1.39 7.01 -1.64 0.19 115.95 122.36 3h3v h TRP 139 Ca 0.06 0.04 0.14 0.00 2.11 0.00 0.00 58.89 61.23 3h3v h TRP 139 Cb 0.15 0.02 -0.05 0.00 -2.10 0.00 0.00 29.16 27.19 3h3v h TRP 139 CO -0.89 -0.06 0.48 1.15 -2.79 0.00 0.00 178.44 176.33 3h3v h THR 140 N 0.23 0.82 0.03 2.65 2.02 -0.45 -2.51 112.91 115.69 3h3v h THR 140 Ca 0.33 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.37 3h3v h THR 140 Cb 0.51 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 3h3v h THR 140 CO -0.44 0.07 -0.01 -0.07 0.37 0.00 0.00 175.52 175.44 3h3v h LEU 141 N 0.40 -0.03 -0.94 2.58 3.38 0.78 -3.39 115.31 118.09 3h3v h LEU 141 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3h3v h LEU 141 Cb 0.78 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3h3v h LEU 141 CO -0.10 0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.51 3h3v h LYS 143 N 0.02 0.00 0.00 0.00 2.10 -1.59 -3.37 116.57 113.72 3h3v h LYS 143 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3h3v h LYS 143 Cb 0.46 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 3h3v h LYS 143 CO 0.00 0.00 -0.04 1.15 -2.00 0.00 0.00 179.45 178.56 3h3v h THR 144 N 0.00 0.00 -2.41 0.07 2.02 -1.82 -3.45 112.91 107.32 3h3v h THR 144 Ca 0.00 -0.82 -0.54 0.00 0.77 0.00 0.00 66.41 65.82 3h3v h THR 144 Cb 0.79 0.00 0.04 0.00 -1.74 0.00 0.00 68.15 67.24 3h3v h THR 144 CO 0.00 0.00 1.10 1.17 0.37 0.00 0.00 175.52 178.16 3h3v n LYS 145 N -4.26 2.68 -0.78 6.66 4.81 -1.26 -4.88 118.16 121.13 3h3v n LYS 145 Ca -0.01 0.98 0.04 0.00 -0.87 0.00 0.00 58.31 58.45 3h3v n LYS 145 Cb 0.02 -2.86 0.18 0.00 0.02 0.00 0.00 35.03 32.39 3h3v n LYS 145 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 3h3v n MET 146 N 5.79 1.59 -3.66 1.64 2.81 -1.26 -4.93 117.12 119.10 3h3v n MET 146 Ca 0.19 -3.26 -0.28 0.00 -1.81 0.00 0.00 57.70 52.54 3h3v n MET 146 Cb 0.36 -1.53 -0.16 0.00 -0.71 0.00 0.00 33.22 31.18 3h3v n MET 146 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3h3v s VAL 147 N -3.06 0.30 -0.96 2.03 1.01 -1.26 0.56 120.40 119.02 3h3v s VAL 147 Ca 0.38 -0.62 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 3h3v s VAL 147 Cb 0.37 -0.99 -0.06 0.00 0.00 0.00 0.00 36.38 35.70 3h3v s VAL 147 CO -0.07 -0.40 2.15 0.00 0.00 0.00 0.00 175.10 176.77 3h3v n GLU 149 N 4.48 0.00 -0.00 0.00 1.02 -1.26 -2.83 120.64 122.04 3h3v n GLU 149 Ca 0.47 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.63 3h3v n GLU 149 Cb 0.17 -0.65 -0.02 0.00 -0.02 0.00 0.00 31.44 30.92 3h3v n GLU 149 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3h3v n THR 150 N -1.57 0.00 -3.72 2.62 -1.04 -1.26 -4.65 114.28 104.66 3h3v n THR 150 Ca -0.01 -0.30 -0.12 0.00 -2.04 0.00 0.00 64.05 61.58 3h3v n THR 150 Cb 0.36 0.79 -0.10 0.00 -1.82 0.00 0.00 70.33 69.56 3h3v n THR 150 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3h3v s ASP 151 N -1.71 -0.48 0.01 8.00 1.01 -1.26 -2.57 116.67 119.67 3h3v s ASP 151 Ca 0.00 0.89 -0.03 0.00 0.71 0.00 0.00 52.55 54.13 3h3v s ASP 151 Cb 0.02 0.86 -0.01 0.00 1.01 0.00 0.00 42.92 44.81 3h3v s ASP 151 CO 0.14 -0.16 0.04 -0.69 0.21 0.00 0.00 175.17 174.70 3h3v s VAL 152 N 0.55 0.08 -0.57 -1.27 1.01 -0.24 -4.92 120.40 115.05 3h3v s VAL 152 Ca -0.03 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.04 3h3v s VAL 152 Cb -0.04 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 3h3v s VAL 152 CO -0.03 -0.36 1.94 -2.16 0.00 0.00 0.00 175.10 174.49 3h3v s PRO 153 N -1.12 2.60 0.00 2.72 0.04 -1.26 -1.32 135.00 136.67 3h3v s PRO 153 Ca -0.12 0.81 0.00 0.00 0.04 0.00 0.00 61.00 61.73 3h3v s PRO 153 Cb -0.07 -4.40 0.00 0.00 0.04 0.00 0.00 34.50 30.06 3h3v s PRO 153 CO -0.00 -2.74 0.00 -1.13 0.04 0.00 0.00 177.00 173.17 3h3v n SER 154 N 13.04 -0.65 -0.21 6.66 3.41 -1.25 -4.79 113.62 129.82 3h3v n SER 154 Ca 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 3h3v n SER 154 Cb 0.52 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.48 3h3v n SER 154 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h3v n GLU 155 N -0.65 1.04 0.00 4.33 1.02 -1.26 -4.46 120.64 120.66 3h3v n GLU 155 Ca 0.00 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 3h3v n GLU 155 Cb 0.00 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 3h3v n GLU 155 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3h3v n ASP 156 N -0.28 0.00 -4.49 1.62 8.00 -1.26 -5.11 116.55 115.02 3h3v n ASP 156 Ca 0.00 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.21 3h3v n ASP 156 Cb 0.11 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.09 3h3v n ASP 156 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3h3v s ASP 157 N -0.33 3.93 -0.02 -2.24 1.01 -1.26 -4.99 116.67 112.78 3h3v s ASP 157 Ca 0.00 -0.52 0.01 0.00 0.71 0.00 0.00 52.55 52.76 3h3v s ASP 157 Cb 0.00 -0.59 0.07 0.00 1.01 0.00 0.00 42.92 43.41 3h3v s ASP 157 CO 0.00 0.19 0.69 -0.81 0.21 0.00 0.00 175.17 175.45 3h3v n PRO 158 N 0.91 1.33 0.00 8.23 -0.04 -1.26 -2.53 135.00 141.64 3h3v n PRO 158 Ca -0.15 -0.28 0.06 0.00 -0.04 0.00 0.00 63.50 63.08 3h3v n PRO 158 Cb 0.53 -1.48 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 3h3v n PRO 158 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3h3v n THR 159 N -0.00 0.00 -3.72 0.52 -1.04 -1.26 -4.82 114.28 103.96 3h3v n THR 159 Ca 0.03 -0.30 -0.29 0.00 -2.04 0.00 0.00 64.05 61.44 3h3v n THR 159 Cb 0.29 1.07 -0.12 0.00 -1.82 0.00 0.00 70.33 69.75 3h3v n THR 159 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3h3v s GLN 160 N -1.80 1.59 -0.66 -2.82 -0.21 -1.05 -5.07 119.66 109.64 3h3v s GLN 160 Ca 0.07 -2.45 -0.26 0.00 0.02 0.00 0.00 55.36 52.74 3h3v s GLN 160 Cb 0.09 -2.53 -0.03 0.00 1.00 0.00 0.00 33.01 31.54 3h3v s GLN 160 CO 0.38 -1.24 1.95 -0.51 -2.12 0.00 0.00 175.29 173.76 3h3v s LEU 161 N -0.27 3.27 0.85 2.90 1.43 -1.26 -3.93 118.68 121.66 3h3v s LEU 161 Ca 0.23 0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 53.43 3h3v s LEU 161 Cb -0.13 -2.53 0.10 0.00 0.03 0.00 0.00 46.19 43.66 3h3v s LEU 161 CO -0.09 -2.55 1.09 -0.69 0.23 0.00 0.00 176.35 174.35 3h3v s VAL 162 N 9.78 2.88 0.28 -1.59 1.01 -0.43 -4.67 120.40 127.66 3h3v s VAL 162 Ca 0.72 0.28 0.08 0.00 0.00 0.00 0.00 61.98 63.07 3h3v s VAL 162 Cb -0.12 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 3h3v s VAL 162 CO 0.17 -0.37 0.11 -0.94 0.00 0.00 0.00 175.10 174.06 3h3v s SER 163 N -3.58 4.95 0.00 3.32 1.04 -1.26 -1.08 113.70 117.08 3h3v s SER 163 Ca 0.62 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 56.53 3h3v s SER 163 Cb -0.17 -1.02 0.00 0.00 0.10 0.00 0.00 66.02 64.93 3h3v s SER 163 CO 0.56 -0.08 0.00 -2.11 0.98 0.00 0.00 173.24 172.59 3h3v n ARG 164 N -1.06 0.00 -1.46 4.02 1.85 -1.06 -4.96 116.66 113.98 3h3v n ARG 164 Ca -0.06 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.46 3h3v n ARG 164 Cb 0.59 0.00 0.08 0.00 -1.05 0.00 0.00 32.46 32.08 3h3v n ARG 164 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 3h3v s GLY 165 N 0.00 2.13 0.00 2.89 0.00 -1.26 -4.94 107.32 106.14 3h3v s GLY 165 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 44.72 45.38 3h3v s GLY 165 CO 0.00 1.04 0.00 0.61 0.00 0.00 0.00 173.10 174.75 3h3v n GLY 166 N -0.15 1.48 3.10 0.20 0.00 -1.26 -4.13 105.19 104.42 3h3v n GLY 166 Ca 0.12 -1.65 -0.00 0.00 0.00 0.00 0.00 46.02 44.49 3h3v n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3v n GLY 168 N 1.49 1.69 3.08 0.00 0.00 -1.13 -4.49 105.19 105.83 3h3v n GLY 168 Ca -0.01 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 3h3v n GLY 168 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h3v n ASN 169 N 0.64 -1.33 -4.77 1.61 3.02 -1.26 -3.14 115.26 110.03 3h3v n ASN 169 Ca 0.16 0.99 -0.36 0.00 -0.03 0.00 0.00 54.58 55.34 3h3v n ASN 169 Cb 0.58 -0.86 -0.00 0.00 -0.61 0.00 0.00 39.78 38.89 3h3v n ASN 169 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3h3v s THR 170 N -0.99 3.10 -0.18 3.41 2.01 -1.26 -3.01 115.64 118.72 3h3v s THR 170 Ca 0.58 0.77 -0.03 0.00 0.31 0.00 0.00 61.69 63.33 3h3v s THR 170 Cb -0.81 -3.37 -0.01 0.00 0.01 0.00 0.00 72.50 68.32 3h3v s THR 170 CO 0.52 -0.06 -0.07 -1.10 -0.69 0.00 0.00 174.62 173.21 3h3v s GLN 171 N -2.92 3.41 0.23 4.92 -0.21 0.19 -4.96 119.66 120.33 3h3v s GLN 171 Ca 0.67 -0.63 -0.30 0.00 0.02 0.00 0.00 55.36 55.12 3h3v s GLN 171 Cb -0.27 -2.86 -0.09 0.00 1.00 0.00 0.00 33.01 30.78 3h3v s GLN 171 CO 0.32 -0.00 1.32 -1.25 -2.12 0.00 0.00 175.29 173.56 3h3v s PRO 172 N 0.95 4.38 -0.01 2.91 0.04 -1.26 -4.74 135.00 137.28 3h3v s PRO 172 Ca -0.01 2.11 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 3h3v s PRO 172 Cb -0.15 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 3h3v s PRO 172 CO 0.00 -0.24 1.24 0.99 0.04 0.00 0.00 177.00 179.02 3h3v s THR 173 N -0.19 4.08 0.04 1.26 2.01 -0.97 -4.75 115.64 117.12 3h3v s THR 173 Ca 0.55 1.45 -0.09 0.00 0.31 0.00 0.00 61.69 63.91 3h3v s THR 173 Cb -0.38 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.15 3h3v s THR 173 CO 0.42 0.03 0.35 -0.63 -0.69 0.00 0.00 174.62 174.10 3h3v s ILE 174 N 1.89 5.17 0.08 1.82 1.01 -1.26 -2.73 121.20 127.17 3h3v s ILE 174 Ca 0.58 0.41 0.04 0.00 0.00 0.00 0.00 60.65 61.69 3h3v s ILE 174 Cb -0.27 -3.62 -0.03 0.00 0.01 0.00 0.00 42.46 38.55 3h3v s ILE 174 CO 0.25 0.37 -0.11 0.00 0.00 0.00 0.00 174.94 175.45 3h3v s ARG 175 N -1.70 0.80 0.10 2.79 1.70 0.15 -4.97 118.95 117.82 3h3v s ARG 175 Ca 0.29 -1.03 -0.14 0.00 -0.47 0.00 0.00 55.73 54.39 3h3v s ARG 175 Cb -0.14 -0.62 -0.06 0.00 -0.57 0.00 0.00 34.95 33.55 3h3v s ARG 175 CO 0.16 0.12 0.49 0.21 -1.08 0.00 0.00 175.30 175.20 3h3v s LYS 176 N -2.21 3.94 -0.17 3.89 2.20 -1.26 -1.55 119.74 124.58 3h3v s LYS 176 Ca 0.00 0.43 -0.04 0.00 -0.36 0.00 0.00 55.97 56.00 3h3v s LYS 176 Cb -0.07 -3.03 0.08 0.00 -1.51 0.00 0.00 37.83 33.31 3h3v s LYS 176 CO 0.01 0.55 0.23 0.34 -0.36 0.00 0.00 175.35 176.12 3h3v s ASP 177 N -1.56 1.00 0.72 1.43 -1.08 -0.38 -4.97 116.67 111.84 3h3v s ASP 177 Ca 0.33 0.06 0.00 0.00 -0.52 0.00 0.00 52.55 52.43 3h3v s ASP 177 Cb -0.15 0.47 0.00 0.00 -1.46 0.00 0.00 42.92 41.78 3h3v s ASP 177 CO 0.18 -0.29 0.00 0.61 0.52 0.00 0.00 175.17 176.19 3h3v n GLY 178 N 5.33 0.97 0.40 2.66 0.00 -1.26 0.07 105.19 113.35 3h3v n GLY 178 Ca -0.05 0.64 0.07 0.00 0.00 0.00 0.00 46.02 46.69 3h3v n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h3v n LEU 179 N 0.00 2.41 -4.01 0.99 4.77 -1.26 -4.99 117.00 114.92 3h3v n LEU 179 Ca 0.00 -3.40 -0.08 0.00 -0.03 0.00 0.00 56.01 52.50 3h3v n LEU 179 Cb 0.00 -0.45 -0.10 0.00 -2.33 0.00 0.00 43.42 40.54 3h3v n LEU 179 CO 0.00 1.04 -0.33 -0.54 -1.33 0.00 0.00 177.39 176.23 3h3v s LYS 180 N -2.87 0.48 -0.17 3.23 1.02 0.11 -4.91 119.74 116.63 3h3v s LYS 180 Ca 0.34 -0.86 -0.05 0.00 0.02 0.00 0.00 55.97 55.42 3h3v s LYS 180 Cb 0.32 0.17 -0.03 0.00 -0.52 0.00 0.00 37.83 37.77 3h3v s LYS 180 CO -0.03 -0.09 -0.01 -0.51 -0.92 0.00 0.00 175.35 173.80 3h3v s LEU 181 N -2.14 3.41 0.06 3.17 1.43 -1.26 -1.24 118.68 122.11 3h3v s LEU 181 Ca -0.05 -0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.03 3h3v s LEU 181 Cb -0.02 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 3h3v s LEU 181 CO -0.05 0.16 -0.16 -0.69 0.23 0.00 0.00 176.35 175.84 3h3v s VAL 182 N 0.43 1.25 -0.07 -1.59 1.01 -0.59 -0.82 120.40 120.01 3h3v s VAL 182 Ca -0.02 -1.23 -0.12 0.00 0.00 0.00 0.00 61.98 60.61 3h3v s VAL 182 Cb -0.14 -1.16 0.03 0.00 0.00 0.00 0.00 36.38 35.11 3h3v s VAL 182 CO 0.02 -0.09 0.30 -0.83 0.00 0.00 0.00 175.10 174.50 3h3v s GLY 183 N -1.53 -0.18 0.02 4.51 0.00 -1.18 0.33 107.32 109.30 3h3v s GLY 183 Ca 0.01 0.58 -0.16 0.00 0.00 0.00 0.00 44.72 45.16 3h3v s GLY 183 CO 0.02 0.43 0.45 -1.35 0.00 0.00 0.00 173.10 172.65 3h3v s SER 184 N -0.54 6.87 -0.55 1.64 1.04 -1.11 -3.21 113.70 117.85 3h3v s SER 184 Ca -0.06 1.04 -0.11 0.00 0.48 0.00 0.00 55.95 57.30 3h3v s SER 184 Cb -0.04 -2.28 0.14 0.00 0.10 0.00 0.00 66.02 63.94 3h3v s SER 184 CO 0.02 0.31 0.45 0.26 0.98 0.00 0.00 173.24 175.26 3h3v s TRP 185 N -1.09 3.44 0.02 5.02 0.51 -1.22 -2.28 118.94 123.33 3h3v s TRP 185 Ca 0.25 -1.86 -0.13 0.00 -2.12 0.00 0.00 56.10 52.24 3h3v s TRP 185 Cb -0.17 -3.58 0.02 0.00 -0.81 0.00 0.00 33.47 28.93 3h3v s TRP 185 CO 0.15 -0.98 0.29 0.21 -0.51 0.00 0.00 176.95 176.10 3h3v s LYS 186 N 1.10 0.72 -0.03 4.98 2.20 -1.26 -4.15 119.74 123.29 3h3v s LYS 186 Ca 0.08 -0.39 -0.20 0.00 -0.36 0.00 0.00 55.97 55.11 3h3v s LYS 186 Cb -0.24 0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 36.34 3h3v s LYS 186 CO -0.01 -0.21 0.56 -0.51 -0.36 0.00 0.00 175.35 174.82 3h3v s ASP 195 N -1.73 6.90 0.00 1.43 1.01 -1.26 -5.06 116.67 117.97 3h3v s ASP 195 Ca -0.09 1.07 0.00 0.00 0.71 0.00 0.00 52.55 54.24 3h3v s ASP 195 Cb -0.03 -2.34 0.00 0.00 1.01 0.00 0.00 42.92 41.56 3h3v s ASP 195 CO 0.00 0.08 0.00 1.21 0.21 0.00 0.00 175.17 176.67 3h3v n GLU 196 N 2.95 0.00 -2.09 8.23 2.13 -1.26 -5.06 120.64 125.54 3h3v n GLU 196 Ca -0.07 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.38 3h3v n GLU 196 Cb 0.51 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.23 3h3v n GLU 196 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 3h3v s PRO 197 N -4.04 3.43 -0.53 5.31 0.04 -1.26 -4.98 135.00 132.97 3h3v s PRO 197 Ca 0.00 1.89 0.06 0.00 0.04 0.00 0.00 61.00 62.99 3h3v s PRO 197 Cb 0.00 -2.25 0.21 0.00 0.04 0.00 0.00 34.50 32.50 3h3v s PRO 197 CO 0.00 -0.85 0.52 0.39 0.04 0.00 0.00 177.00 177.10 3h3v n GLU 198 N -0.88 1.26 -2.55 4.56 1.02 -1.26 -4.98 120.64 117.80 3h3v n GLU 198 Ca 0.10 -3.84 -0.41 0.00 -0.02 0.00 0.00 57.16 52.99 3h3v n GLU 198 Cb 0.48 -1.82 -0.04 0.00 -0.02 0.00 0.00 31.44 30.04 3h3v n GLU 198 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3h3v s LEU 199 N -1.23 4.48 0.02 -4.62 1.43 -1.26 -3.38 118.68 114.12 3h3v s LEU 199 Ca 0.33 2.02 -0.11 0.00 -1.03 0.00 0.00 54.13 55.34 3h3v s LEU 199 Cb 0.08 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.72 3h3v s LEU 199 CO -0.12 -0.21 0.24 0.00 0.23 0.00 0.00 176.35 176.49 3h3v s ARG 200 N -0.18 0.67 -0.04 1.70 1.70 -1.20 -5.02 118.95 116.59 3h3v s ARG 200 Ca 0.50 -0.43 -0.30 0.00 -0.47 0.00 0.00 55.73 55.02 3h3v s ARG 200 Cb -0.28 0.29 -0.02 0.00 -0.57 0.00 0.00 34.95 34.36 3h3v s ARG 200 CO 0.33 -0.19 1.01 0.08 -1.08 0.00 0.00 175.30 175.45 3h3v s VAL 201 N -1.98 4.76 -0.59 4.99 1.01 -1.26 -3.07 120.40 124.26 3h3v s VAL 201 Ca -0.09 2.00 -0.26 0.00 0.00 0.00 0.00 61.98 63.62 3h3v s VAL 201 Cb -0.03 -4.28 0.04 0.00 0.00 0.00 0.00 36.38 32.10 3h3v s VAL 201 CO -0.00 0.09 1.09 -0.76 0.00 0.00 0.00 175.10 175.52 3h3v s LEU 202 N 1.45 3.72 0.33 3.92 1.43 -0.00 -5.00 118.68 124.53 3h3v s LEU 202 Ca 0.51 -0.18 -0.29 0.00 -1.03 0.00 0.00 54.13 53.14 3h3v s LEU 202 Cb -0.21 -2.94 -0.10 0.00 0.03 0.00 0.00 46.19 42.97 3h3v s LEU 202 CO 0.24 -1.42 1.37 -0.94 0.23 0.00 0.00 176.35 175.83 3h3v s SER 203 N 3.03 6.66 0.15 2.29 1.04 -1.26 -4.54 113.70 121.06 3h3v s SER 203 Ca 0.36 2.76 -0.18 0.00 0.48 0.00 0.00 55.95 59.38 3h3v s SER 203 Cb -0.10 -2.65 0.05 0.00 0.10 0.00 0.00 66.02 63.42 3h3v s SER 203 CO 0.21 -0.64 1.69 0.74 0.98 0.00 0.00 173.24 176.23 3h3v h THR 204 N 3.11 0.72 -0.95 2.02 2.02 -1.95 0.86 112.91 118.74 3h3v h THR 204 Ca -0.49 -0.01 0.25 0.00 0.77 0.00 0.00 66.41 66.93 3h3v h THR 204 Cb 1.23 0.67 -0.06 0.00 -1.74 0.00 0.00 68.15 68.25 3h3v h THR 204 CO 0.67 0.01 0.65 -0.33 0.37 0.00 0.00 175.52 176.89 3h3v h GLU 205 N 0.04 0.23 0.14 6.66 3.07 -1.91 0.40 114.58 123.21 3h3v h GLU 205 Ca 0.16 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.99 3h3v h GLU 205 Cb 0.23 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 3h3v h GLU 205 CO -0.30 0.15 -0.07 1.49 -1.40 0.00 0.00 179.01 178.88 3h3v h GLU 206 N 0.24 -0.19 -0.12 2.33 4.81 -1.26 -2.99 114.58 117.40 3h3v h GLU 206 Ca 0.49 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.75 3h3v h GLU 206 Cb 1.51 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.92 3h3v h GLU 206 CO -0.13 0.26 0.01 0.82 -0.73 0.00 0.00 179.01 179.24 3h3v h ILE 207 N -0.84 0.93 -0.69 2.32 1.08 0.04 -1.09 117.51 119.26 3h3v h ILE 207 Ca -0.02 -0.02 0.14 0.00 -0.39 0.00 0.00 64.86 64.57 3h3v h ILE 207 Cb 0.54 0.87 -0.13 0.00 -3.07 0.00 0.00 36.82 35.03 3h3v h ILE 207 CO 0.03 0.01 -0.12 0.25 -0.69 0.00 0.00 178.15 177.63 3h3v h LEU 208 N 0.05 -0.54 0.42 1.44 6.46 -0.36 -0.62 115.31 122.15 3h3v h LEU 208 Ca 0.06 0.20 -0.02 0.00 -0.12 0.00 0.00 57.88 57.99 3h3v h LEU 208 Cb 0.06 0.39 0.00 0.00 -0.73 0.00 0.00 40.66 40.39 3h3v h LEU 208 CO -0.09 -0.21 -0.20 -1.13 -0.62 0.00 0.00 178.44 176.19 3h3v h ASN 209 N 0.03 -0.48 -0.94 1.25 -0.73 -1.26 -1.31 115.58 112.15 3h3v h ASN 209 Ca 0.34 -0.08 0.27 0.00 1.87 0.00 0.00 56.30 58.70 3h3v h ASN 209 Cb 0.55 0.12 -0.14 0.00 0.27 0.00 0.00 38.32 39.12 3h3v h ASN 209 CO -0.68 -0.19 0.41 0.40 -0.37 0.00 0.00 177.43 177.01 3h3v h ILE 210 N -0.78 0.35 0.01 2.57 2.04 -0.58 0.16 117.51 121.27 3h3v h ILE 210 Ca -0.06 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 3h3v h ILE 210 Cb 0.54 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.63 3h3v h ILE 210 CO 0.10 0.06 -0.00 -0.26 0.00 0.00 0.00 178.15 178.04 3h3v h PHE 211 N 0.31 -0.01 -0.82 1.37 -1.00 -0.92 -3.03 116.94 112.85 3h3v h PHE 211 Ca 0.63 -0.00 0.18 0.00 2.81 0.00 0.00 57.97 61.59 3h3v h PHE 211 Cb 1.33 0.00 -0.11 0.00 3.61 0.00 0.00 35.95 40.78 3h3v h PHE 211 CO -0.13 0.26 0.30 0.87 -1.61 0.00 0.00 178.31 177.99 3h3v h LYS 212 N -0.28 0.35 -0.04 1.51 1.57 0.46 0.54 116.57 120.67 3h3v h LYS 212 Ca -0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3h3v h LYS 212 Cb 0.28 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3h3v h LYS 212 CO 0.00 0.23 0.00 0.72 -0.57 0.00 0.00 179.45 179.83 3h3v n HIS 213 N -5.08 0.00 -2.67 -1.35 8.25 -0.55 -4.82 115.22 109.01 3h3v n HIS 213 Ca 0.18 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.23 3h3v n HIS 213 Cb 0.54 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.60 3h3v n HIS 213 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3h3v s ILE 214 N -1.95 4.04 0.55 1.59 1.01 0.19 -4.59 121.20 122.04 3h3v s ILE 214 Ca 0.00 1.92 -0.19 0.00 0.00 0.00 0.00 60.65 62.38 3h3v s ILE 214 Cb 0.00 -4.22 -0.08 0.00 0.01 0.00 0.00 42.46 38.16 3h3v s ILE 214 CO 0.00 0.40 0.68 -0.24 0.00 0.00 0.00 174.94 175.78 3h3v n SER 215 N 1.87 -0.38 -0.02 3.58 2.88 -1.24 -4.79 113.62 115.52 3h3v n SER 215 Ca -0.00 0.80 -0.08 0.00 -1.33 0.00 0.00 58.87 58.26 3h3v n SER 215 Cb 0.47 -1.23 0.10 0.00 -0.75 0.00 0.00 64.21 62.79 3h3v n SER 215 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 3h3v h VAL 216 N 0.49 1.30 -0.00 2.46 2.07 -1.95 0.63 116.25 121.24 3h3v h VAL 216 Ca -0.46 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 65.51 3h3v h VAL 216 Cb 1.39 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 3h3v h VAL 216 CO 0.49 0.49 -0.28 0.29 0.02 0.00 0.00 177.57 178.58 3h3v n LYS 217 N -4.03 0.10 0.05 1.57 5.02 -1.26 -3.14 118.16 116.47 3h3v n LYS 217 Ca -0.02 -0.04 -0.17 0.00 -2.02 0.00 0.00 58.31 56.07 3h3v n LYS 217 Cb 0.51 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.88 3h3v n LYS 217 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3h3v h ASP 218 N 0.10 0.37 0.00 4.39 3.32 -1.75 -2.83 116.42 120.01 3h3v h ASP 218 Ca 0.00 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.51 3h3v h ASP 218 Cb 0.49 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3h3v h ASP 218 CO 0.00 1.46 0.00 0.49 -1.72 0.00 0.00 179.24 179.47 3h3v n PHE 219 N -3.43 0.00 0.00 4.55 0.99 0.16 -2.26 117.46 117.47 3h3v n PHE 219 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.27 3h3v n PHE 219 Cb 1.04 -0.11 0.00 0.00 -1.00 0.00 0.00 39.48 39.42 3h3v n PHE 219 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 3h3v n THR 220 N -1.22 0.00 -0.33 4.37 -1.04 -1.22 0.52 114.28 115.36 3h3v n THR 220 Ca 0.00 0.41 0.28 0.00 -2.04 0.00 0.00 64.05 62.71 3h3v n THR 220 Cb 0.00 -0.56 0.52 0.00 -1.82 0.00 0.00 70.33 68.48 3h3v n THR 220 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 3h3v h SER 221 N 0.00 0.15 -3.47 8.00 4.64 -1.38 -3.20 113.55 118.28 3h3v h SER 221 Ca 0.00 0.26 -0.69 0.00 -0.47 0.00 0.00 61.79 60.89 3h3v h SER 221 Cb 0.00 0.32 -0.19 0.00 -0.31 0.00 0.00 62.40 62.22 3h3v h SER 221 CO 0.00 -0.42 -0.15 -0.76 -0.87 0.00 0.00 176.83 174.63 3h3v s LEU 222 N -10.62 4.92 0.00 5.97 1.43 0.18 -4.41 118.68 116.15 3h3v s LEU 222 Ca -0.10 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 3h3v s LEU 222 Cb 0.33 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 44.15 3h3v s LEU 222 CO 0.78 -0.65 0.00 0.61 0.23 0.00 0.00 176.35 177.32 3h3v n GLY 223 N 5.12 0.00 3.40 -3.19 0.00 -1.21 -4.76 105.19 104.55 3h3v n GLY 223 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 3h3v n GLY 223 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h3v s PHE 224 N 0.00 1.75 -0.05 1.61 0.40 -1.25 -4.39 117.98 116.05 3h3v s PHE 224 Ca 0.00 -1.12 0.03 0.00 -0.60 0.00 0.00 56.93 55.24 3h3v s PHE 224 Cb 0.00 -1.09 0.00 0.00 0.51 0.00 0.00 43.02 42.45 3h3v s PHE 224 CO 0.00 -0.21 -0.14 1.21 0.70 0.00 0.00 175.22 176.78 3h3v s ASN 225 N -3.43 1.87 0.49 1.36 2.47 -0.72 -4.02 114.94 112.97 3h3v s ASN 225 Ca 0.35 -0.31 0.16 0.00 0.42 0.00 0.00 52.86 53.48 3h3v s ASN 225 Cb 0.07 -0.65 1.17 0.00 -1.45 0.00 0.00 41.25 40.40 3h3v s ASN 225 CO 0.15 0.10 2.09 -0.08 -3.72 0.00 0.00 177.10 175.63 3h3v h GLU 226 N 6.53 0.00 0.00 0.43 4.81 -1.90 -2.45 114.58 122.00 3h3v h GLU 226 Ca -0.32 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.75 3h3v h GLU 226 Cb 1.18 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 3h3v h GLU 226 CO 0.48 0.08 -1.79 0.28 -0.73 0.00 0.00 179.01 177.33 3h3v n VAL 227 N -4.43 0.62 -0.06 0.32 0.31 -1.26 -4.83 118.33 109.00 3h3v n VAL 227 Ca -0.03 -0.47 -0.08 0.00 -0.01 0.00 0.00 64.34 63.75 3h3v n VAL 227 Cb 0.15 -0.43 -0.06 0.00 -0.91 0.00 0.00 33.84 32.59 3h3v n VAL 227 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3h3v n PHE 228 N -2.32 0.00 -3.43 3.52 0.99 -1.22 -4.93 117.46 110.07 3h3v n PHE 228 Ca -0.15 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.02 3h3v n PHE 228 Cb 0.75 -0.50 -0.11 0.00 -1.00 0.00 0.00 39.48 38.63 3h3v n PHE 228 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 3h3v s SER 229 N -5.12 1.89 -0.23 4.37 1.04 -0.94 -0.37 113.70 114.34 3h3v s SER 229 Ca -0.16 -2.89 -0.26 0.00 0.48 0.00 0.00 55.95 53.12 3h3v s SER 229 Cb 0.04 -0.47 -0.00 0.00 0.10 0.00 0.00 66.02 65.69 3h3v s SER 229 CO 0.31 -0.20 0.91 -0.13 0.98 0.00 0.00 173.24 175.12 3h3v s ARG 230 N 0.25 4.23 0.21 4.02 0.52 -1.12 -1.76 118.95 125.30 3h3v s ARG 230 Ca 0.29 1.12 -0.01 0.00 -0.52 0.00 0.00 55.73 56.62 3h3v s ARG 230 Cb -0.03 -3.63 0.47 0.00 0.52 0.00 0.00 34.95 32.28 3h3v s ARG 230 CO -0.15 -0.53 1.08 -2.30 0.02 0.00 0.00 175.30 173.42 3h3v n PRO 231 N 6.01 -0.06 0.00 3.54 -0.02 -1.26 0.18 135.00 143.39 3h3v n PRO 231 Ca 0.08 1.04 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 3h3v n PRO 231 Cb 0.47 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 3h3v n PRO 231 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3h3v n GLU 232 N -4.98 0.00 -0.01 -0.52 0.28 -1.26 -1.02 120.64 113.13 3h3v n GLU 232 Ca 0.15 0.00 0.09 0.00 -0.16 0.00 0.00 57.16 57.23 3h3v n GLU 232 Cb 0.48 -1.42 -0.14 0.00 1.43 0.00 0.00 31.44 31.79 3h3v n GLU 232 CO 0.00 0.00 0.00 0.91 -0.16 0.00 0.00 177.13 177.88 3h3v n TRP 233 N -0.80 0.00 0.26 -1.84 8.01 0.48 -4.33 117.44 119.22 3h3v n TRP 233 Ca 0.00 0.00 0.15 0.00 -1.31 0.00 0.00 57.50 56.34 3h3v n TRP 233 Cb 0.00 -0.44 0.80 0.00 -2.01 0.00 0.00 31.31 29.66 3h3v n TRP 233 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.69 177.20 3h3v h MET 234 N 0.00 0.00 -5.02 -0.99 2.86 -1.22 -3.37 114.93 107.18 3h3v h MET 234 Ca -0.02 0.00 -0.63 0.00 -2.06 0.00 0.00 59.70 56.99 3h3v h MET 234 Cb 0.90 0.00 -0.17 0.00 0.06 0.00 0.00 31.60 32.39 3h3v h MET 234 CO 0.00 0.00 -0.54 0.42 1.06 0.00 0.00 176.91 177.85 3h3v s ILE 235 N -3.83 5.07 -0.17 -1.22 1.01 -1.26 -3.50 121.20 117.30 3h3v s ILE 235 Ca -0.03 0.08 -0.27 0.00 0.00 0.00 0.00 60.65 60.43 3h3v s ILE 235 Cb 0.09 -3.37 -0.01 0.00 0.01 0.00 0.00 42.46 39.17 3h3v s ILE 235 CO 0.27 0.33 0.91 -0.76 0.00 0.00 0.00 174.94 175.69 3h3v s LEU 236 N 1.31 4.17 -0.16 2.97 1.43 0.08 -4.91 118.68 123.56 3h3v s LEU 236 Ca 0.07 1.28 -0.15 0.00 -1.03 0.00 0.00 54.13 54.29 3h3v s LEU 236 Cb -0.14 -3.36 -0.06 0.00 0.03 0.00 0.00 46.19 42.66 3h3v s LEU 236 CO 0.06 -0.47 -0.31 0.41 0.23 0.00 0.00 176.35 176.26 3h3v n THR 237 N 4.86 1.45 -4.05 5.49 -1.04 -1.26 -2.77 114.28 116.97 3h3v n THR 237 Ca 0.07 0.09 -0.33 0.00 -2.04 0.00 0.00 64.05 61.84 3h3v n THR 237 Cb 0.48 -2.20 -0.07 0.00 -1.82 0.00 0.00 70.33 66.72 3h3v n THR 237 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h3v s LEU 239 N -1.69 3.49 -0.00 0.00 2.96 -0.59 -4.90 118.68 117.94 3h3v s LEU 239 Ca 0.23 -1.12 -0.30 0.00 -0.22 0.00 0.00 54.13 52.72 3h3v s LEU 239 Cb -0.12 -1.66 -0.07 0.00 0.50 0.00 0.00 46.19 44.84 3h3v s LEU 239 CO 0.14 -0.19 1.83 -2.16 -1.32 0.00 0.00 176.35 174.65 3h3v s PRO 240 N 1.25 4.15 -0.74 0.98 0.04 -1.26 -1.55 135.00 137.87 3h3v s PRO 240 Ca -0.04 2.42 -0.14 0.00 0.04 0.00 0.00 61.00 63.29 3h3v s PRO 240 Cb -0.18 -4.09 0.19 0.00 0.04 0.00 0.00 34.50 30.46 3h3v s PRO 240 CO -0.03 -0.91 0.68 0.08 0.04 0.00 0.00 177.00 176.85 3h3v s VAL 241 N 4.30 5.37 0.17 -0.36 1.01 0.21 -4.89 120.40 126.20 3h3v s VAL 241 Ca 0.82 -2.28 -0.32 0.00 0.00 0.00 0.00 61.98 60.19 3h3v s VAL 241 Cb -0.38 -4.35 -0.16 0.00 0.00 0.00 0.00 36.38 31.48 3h3v s VAL 241 CO 0.36 -0.98 1.06 -0.81 0.00 0.00 0.00 175.10 174.73 3h3v n PRO 242 N 4.23 0.92 -1.64 2.72 -0.04 -1.26 -2.31 135.00 137.62 3h3v n PRO 242 Ca 0.07 0.33 -0.30 0.00 -0.04 0.00 0.00 63.50 63.56 3h3v n PRO 242 Cb 0.45 -1.75 0.09 0.00 -0.04 0.00 0.00 33.50 32.24 3h3v n PRO 242 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3h3v s PRO 243 N -0.55 2.14 0.00 0.54 0.04 -1.26 -4.85 135.00 131.06 3h3v s PRO 243 Ca 0.72 0.54 0.00 0.00 0.04 0.00 0.00 61.00 62.30 3h3v s PRO 243 Cb -0.89 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 31.72 3h3v s PRO 243 CO 0.54 -1.56 0.23 -0.35 0.04 0.00 0.00 177.00 175.90 3h3v n PRO 244 N -3.37 0.00 0.00 0.56 -0.04 -1.26 -1.13 135.00 129.75 3h3v n PRO 244 Ca 0.07 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.76 3h3v n PRO 244 Cb 0.57 -0.41 0.00 0.00 -0.04 0.00 0.00 33.50 33.62 3h3v n PRO 244 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3h3v n PRO 245 N -1.20 0.00 -0.02 0.54 -0.02 -1.26 0.18 135.00 133.21 3h3v n PRO 245 Ca 0.00 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.50 3h3v n PRO 245 Cb 0.00 -1.28 -0.09 0.00 -0.02 0.00 0.00 33.50 32.11 3h3v n PRO 245 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3h3v n VAL 246 N -0.34 0.23 -3.11 -1.45 0.31 -0.29 -4.65 118.33 109.03 3h3v n VAL 246 Ca 0.00 -0.32 -0.17 0.00 -0.01 0.00 0.00 64.34 63.85 3h3v n VAL 246 Cb 0.00 -0.07 -0.02 0.00 -0.91 0.00 0.00 33.84 32.84 3h3v n VAL 246 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 3h3v n ARG 247 N -2.05 0.99 -1.27 5.55 1.85 0.47 -5.01 116.66 117.19 3h3v n ARG 247 Ca -0.07 -3.34 -0.34 0.00 -1.00 0.00 0.00 57.85 53.10 3h3v n ARG 247 Cb 0.47 -1.63 0.11 0.00 -1.05 0.00 0.00 32.46 30.36 3h3v n ARG 247 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 3h3v n PRO 248 N 0.24 0.43 -0.03 2.89 -0.04 -0.32 -4.43 135.00 133.74 3h3v n PRO 248 Ca 0.23 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.90 3h3v n PRO 248 Cb 0.68 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 3h3v n PRO 248 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3h3v n SER 249 N -2.86 0.00 -2.70 3.54 3.41 -1.26 -3.53 113.62 110.22 3h3v n SER 249 Ca 0.14 -0.30 -0.07 0.00 -0.26 0.00 0.00 58.87 58.38 3h3v n SER 249 Cb 0.50 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.54 3h3v n SER 249 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3h3v n ILE 250 N -0.57 0.00 -1.87 -1.33 5.41 -0.54 -4.84 119.36 115.62 3h3v n ILE 250 Ca 0.00 -1.29 -0.43 0.00 1.00 0.00 0.00 62.75 62.03 3h3v n ILE 250 Cb 0.00 1.13 -0.03 0.00 -0.71 0.00 0.00 39.64 40.03 3h3v n ILE 250 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3h3v s SER 251 N -0.97 5.83 -1.04 4.38 1.04 -1.19 -4.26 113.70 117.49 3h3v s SER 251 Ca 0.19 1.60 -0.23 0.00 0.48 0.00 0.00 55.95 57.99 3h3v s SER 251 Cb 0.30 -2.52 -0.01 0.00 0.10 0.00 0.00 66.02 63.89 3h3v s SER 251 CO -0.08 -1.71 1.77 -0.36 0.98 0.00 0.00 173.24 173.84 3h3v s PHE 252 N 7.05 2.19 0.00 5.02 0.40 -1.23 -4.70 117.98 126.71 3h3v s PHE 252 Ca 0.86 -0.16 0.00 0.00 -0.60 0.00 0.00 56.93 57.03 3h3v s PHE 252 Cb -0.27 -4.33 0.00 0.00 0.51 0.00 0.00 43.02 38.93 3h3v s PHE 252 CO 0.34 -1.71 0.00 0.09 0.70 0.00 0.00 175.22 174.64 3h3v n ASN 253 N 11.74 0.00 0.00 1.36 3.02 -1.26 -4.29 115.26 125.83 3h3v n ASN 253 Ca 0.40 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.95 3h3v n ASN 253 Cb 0.48 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 3h3v n ASN 253 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3h3v n GLU 254 N 0.00 0.00 -0.40 3.52 1.02 -1.26 -4.95 120.64 118.56 3h3v n GLU 254 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3h3v n GLU 254 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3h3v n GLU 254 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3h3v n SER 255 N -0.98 4.42 -4.10 1.62 3.41 -1.26 -4.83 113.62 111.89 3h3v n SER 255 Ca 0.00 -2.17 -0.17 0.00 -0.26 0.00 0.00 58.87 56.28 3h3v n SER 255 Cb 0.00 -0.93 -0.12 0.00 -0.26 0.00 0.00 64.21 62.90 3h3v n SER 255 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3h3v s GLN 256 N 0.31 0.70 0.00 4.33 -0.21 -1.26 -5.08 119.66 118.45 3h3v s GLN 256 Ca 0.00 -0.75 0.00 0.00 0.02 0.00 0.00 55.36 54.63 3h3v s GLN 256 Cb 0.00 -0.61 0.00 0.00 1.00 0.00 0.00 33.01 33.40 3h3v s GLN 256 CO 0.00 0.14 0.00 0.54 -2.12 0.00 0.00 175.29 173.85 3h3v n ARG 257 N 1.69 2.19 0.00 2.91 1.74 -1.26 -4.08 116.66 119.85 3h3v n ARG 257 Ca -0.20 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 3h3v n ARG 257 Cb 0.55 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.99 3h3v n ARG 257 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h3v n GLY 258 N 1.45 -0.56 3.62 -0.13 0.00 -1.26 -3.17 105.19 105.14 3h3v n GLY 258 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.53 3h3v n GLY 258 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3v n GLU 259 N 0.00 1.54 -0.87 1.61 -0.58 -1.26 -1.46 120.64 119.62 3h3v n GLU 259 Ca 0.00 0.55 -0.30 0.00 -0.42 0.00 0.00 57.16 56.99 3h3v n GLU 259 Cb 0.00 -2.22 0.16 0.00 -0.57 0.00 0.00 31.44 28.81 3h3v n GLU 259 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3h3v s ASP 260 N 0.54 2.98 0.09 1.62 -1.08 -1.23 -4.94 116.67 114.65 3h3v s ASP 260 Ca 0.80 1.88 -0.32 0.00 -0.52 0.00 0.00 52.55 54.39 3h3v s ASP 260 Cb -0.83 -2.44 -0.14 0.00 -1.46 0.00 0.00 42.92 38.04 3h3v s ASP 260 CO 0.45 -3.01 1.61 0.44 0.52 0.00 0.00 175.17 175.17 3h3v h ASP 261 N -1.81 -0.99 -0.54 -0.34 3.32 -1.92 -2.90 116.42 111.25 3h3v h ASP 261 Ca -0.48 0.08 0.09 0.00 0.02 0.00 0.00 57.03 56.74 3h3v h ASP 261 Cb 1.28 0.32 -0.07 0.00 0.22 0.00 0.00 39.33 41.08 3h3v h ASP 261 CO 0.47 -0.53 0.14 -0.07 -1.72 0.00 0.00 179.24 177.54 3h3v h LEU 262 N -0.80 0.08 -1.19 1.55 3.38 -1.93 -0.32 115.31 116.07 3h3v h LEU 262 Ca -0.04 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3h3v h LEU 262 Cb 0.70 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3h3v h LEU 262 CO -0.03 0.06 0.60 0.74 0.09 0.00 0.00 178.44 179.90 3h3v h THR 263 N 0.29 0.00 0.03 0.22 2.02 -1.81 0.29 112.91 113.96 3h3v h THR 263 Ca 0.27 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 67.24 3h3v h THR 263 Cb 0.35 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 3h3v h THR 263 CO -0.32 0.00 -1.12 -0.26 0.37 0.00 0.00 175.52 174.20 3h3v h PHE 264 N 0.00 0.10 -0.80 3.16 0.05 -1.05 -2.95 116.94 115.45 3h3v h PHE 264 Ca 0.00 -0.07 0.17 0.00 3.82 0.00 0.00 57.97 61.89 3h3v h PHE 264 Cb 1.20 -0.00 -0.11 0.00 2.00 0.00 0.00 35.95 39.03 3h3v h PHE 264 CO 0.00 1.44 0.29 -0.22 -0.18 0.00 0.00 178.31 179.64 3h3v h LYS 265 N -0.82 0.37 0.43 1.51 1.63 -0.35 0.99 116.57 120.33 3h3v h LYS 265 Ca -0.29 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.47 3h3v h LYS 265 Cb 1.37 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.92 3h3v h LYS 265 CO -0.11 0.24 -0.21 -0.07 -3.45 0.00 0.00 179.45 175.85 3h3v h LEU 266 N 0.38 -0.49 -1.00 5.20 3.38 -1.44 0.25 115.31 121.59 3h3v h LEU 266 Ca 0.46 -0.08 0.23 0.00 0.09 0.00 0.00 57.88 58.59 3h3v h LEU 266 Cb 0.80 0.13 -0.19 0.00 0.09 0.00 0.00 40.66 41.48 3h3v h LEU 266 CO -0.48 -0.20 -0.14 0.00 0.09 0.00 0.00 178.44 177.70 3h3v n ALA 267 N -2.46 0.35 0.48 1.53 0.00 0.64 0.10 120.51 121.15 3h3v n ALA 267 Ca -0.11 1.09 -0.19 0.00 0.00 0.00 0.00 53.44 54.23 3h3v n ALA 267 Cb 0.28 -0.71 -0.09 0.00 0.00 0.00 0.00 19.45 18.94 3h3v n ALA 267 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3h3v h ASP 268 N 0.00 -1.03 -0.84 0.00 3.32 0.13 -1.57 116.42 116.44 3h3v h ASP 268 Ca 0.53 0.04 0.21 0.00 0.02 0.00 0.00 57.03 57.82 3h3v h ASP 268 Cb 0.93 0.27 -0.15 0.00 0.22 0.00 0.00 39.33 40.60 3h3v h ASP 268 CO -0.99 -0.72 0.05 0.40 -1.72 0.00 0.00 179.24 176.26 3h3v h ILE 269 N -1.25 0.26 0.20 0.35 2.04 0.31 -0.04 117.51 119.38 3h3v h ILE 269 Ca -0.12 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 3h3v h ILE 269 Cb 0.93 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 3h3v h ILE 269 CO 0.20 0.02 -0.14 0.25 0.00 0.00 0.00 178.15 178.48 3h3v h LEU 270 N 0.11 -0.36 -0.90 1.44 5.85 0.90 -1.17 115.31 121.16 3h3v h LEU 270 Ca 0.48 0.02 0.13 0.00 0.84 0.00 0.00 57.88 59.36 3h3v h LEU 270 Cb 0.91 0.11 -0.14 0.00 0.37 0.00 0.00 40.66 41.91 3h3v h LEU 270 CO -0.72 -0.20 -0.42 0.11 -0.34 0.00 0.00 178.44 176.87 3h3v h LYS 271 N -0.32 -0.05 -0.42 1.25 1.57 -0.35 0.82 116.57 119.07 3h3v h LYS 271 Ca -0.03 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.88 3h3v h LYS 271 Cb 0.26 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3h3v h LYS 271 CO 0.01 -0.03 0.33 0.00 -0.57 0.00 0.00 179.45 179.19 3h3v h ALA 272 N 1.12 2.31 0.22 3.86 0.00 -0.97 -1.91 119.26 123.90 3h3v h ALA 272 Ca 0.29 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3h3v h ALA 272 Cb 0.56 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3h3v h ALA 272 CO -0.91 -0.54 -0.11 -0.97 0.00 0.00 0.00 179.25 176.72 3h3v h ASN 273 N 0.00 -0.26 -0.88 0.00 -1.24 0.19 -3.24 115.58 110.15 3h3v h ASN 273 Ca 0.20 -0.12 0.24 0.00 0.71 0.00 0.00 56.30 57.33 3h3v h ASN 273 Cb 0.85 0.07 -0.14 0.00 0.73 0.00 0.00 38.32 39.83 3h3v h ASN 273 CO -0.00 0.25 0.27 0.40 -1.29 0.00 0.00 177.43 177.06 3h3v h ILE 274 N -1.03 0.33 -0.74 2.57 2.04 -0.66 0.41 117.51 120.43 3h3v h ILE 274 Ca -0.03 -0.08 0.12 0.00 1.00 0.00 0.00 64.86 65.87 3h3v h ILE 274 Cb 0.36 0.08 -0.08 0.00 -0.74 0.00 0.00 36.82 36.44 3h3v h ILE 274 CO 0.05 0.04 0.34 0.77 0.00 0.00 0.00 178.15 179.35 3h3v h SER 275 N 0.23 0.39 0.61 1.72 4.64 -1.46 -1.87 113.55 117.82 3h3v h SER 275 Ca 0.56 0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.94 3h3v h SER 275 Cb 1.13 0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3h3v h SER 275 CO -0.64 0.19 -0.36 0.25 -0.87 0.00 0.00 176.83 175.40 3h3v h LEU 276 N 0.53 -0.90 -0.67 5.97 5.85 -0.22 -2.99 115.31 122.88 3h3v h LEU 276 Ca 0.38 0.05 0.09 0.00 0.84 0.00 0.00 57.88 59.24 3h3v h LEU 276 Cb 0.50 0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.72 3h3v h LEU 276 CO -0.33 -0.57 0.31 -0.08 -0.34 0.00 0.00 178.44 177.43 3h3v h GLU 277 N -0.92 0.52 0.00 1.25 4.81 -1.23 0.11 114.58 119.11 3h3v h GLU 277 Ca -0.08 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 3h3v h GLU 277 Cb 0.74 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.00 3h3v h GLU 277 CO 0.09 0.34 0.00 2.41 -0.73 0.00 0.00 179.01 181.12 3h3v n THR 278 N -4.91 0.00 0.11 0.32 -1.04 -0.73 -1.29 114.28 106.74 3h3v n THR 278 Ca 0.10 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.15 3h3v n THR 278 Cb 0.27 -0.66 -0.06 0.00 -1.82 0.00 0.00 70.33 68.07 3h3v n THR 278 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h3v n LEU 279 N -0.86 0.12 0.08 -4.42 4.77 -0.01 -4.13 117.00 112.54 3h3v n LEU 279 Ca 0.07 -0.15 0.11 0.00 -0.03 0.00 0.00 56.01 56.01 3h3v n LEU 279 Cb 0.03 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 3h3v n LEU 279 CO 0.05 0.03 -0.13 -0.62 -1.33 0.00 0.00 177.39 175.39 3h3v n GLU 280 N -1.60 0.62 -0.82 3.23 1.02 -0.41 -3.56 120.64 119.11 3h3v n GLU 280 Ca -0.01 0.07 0.01 0.00 -0.02 0.00 0.00 57.16 57.21 3h3v n GLU 280 Cb 0.19 -1.77 0.18 0.00 -0.02 0.00 0.00 31.44 30.02 3h3v n GLU 280 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3h3v n HIS 281 N -2.61 0.47 -2.73 -0.32 8.25 -0.97 -4.95 115.22 112.36 3h3v n HIS 281 Ca -0.01 -1.62 0.00 0.00 -0.26 0.00 0.00 57.72 55.83 3h3v n HIS 281 Cb 0.56 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 31.39 3h3v n HIS 281 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3h3v n ASN 282 N -1.06 0.00 -4.52 0.41 2.85 -1.25 -5.01 115.26 106.68 3h3v n ASN 282 Ca 0.24 -0.57 -0.27 0.00 -0.11 0.00 0.00 54.58 53.87 3h3v n ASN 282 Cb 0.75 0.00 -0.14 0.00 1.24 0.00 0.00 39.78 41.63 3h3v n ASN 282 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3h3v n GLY 283 N 0.00 -0.29 3.34 8.20 0.00 -1.26 -4.83 105.19 110.35 3h3v n GLY 283 Ca 0.00 0.47 -0.46 0.00 0.00 0.00 0.00 46.02 46.03 3h3v n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3v s ALA 284 N 8.06 4.33 -0.44 4.61 0.00 -1.23 -4.86 121.76 132.23 3h3v s ALA 284 Ca 1.17 -3.52 -0.05 0.00 0.00 0.00 0.00 51.96 49.57 3h3v s ALA 284 Cb -0.65 -3.57 -0.11 0.00 0.00 0.00 0.00 23.12 18.79 3h3v s ALA 284 CO 0.37 -2.28 2.26 -0.35 0.00 0.00 0.00 175.76 175.76 3h3v n PRO 285 N 3.57 1.64 0.00 0.00 -0.04 -1.26 -4.83 135.00 134.08 3h3v n PRO 285 Ca 0.19 -1.01 0.00 0.00 -0.04 0.00 0.00 63.50 62.64 3h3v n PRO 285 Cb 0.44 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 3h3v n PRO 285 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3h3v n HIS 286 N 3.37 0.00 -1.58 0.54 8.25 -1.26 -1.02 115.22 123.52 3h3v n HIS 286 Ca 0.35 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.48 3h3v n HIS 286 Cb 0.36 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.53 3h3v n HIS 286 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3h3v n HIS 287 N 0.00 3.12 -0.47 4.41 8.25 -1.26 -3.32 115.22 125.95 3h3v n HIS 287 Ca 0.00 -2.79 0.00 0.00 -0.26 0.00 0.00 57.72 54.67 3h3v n HIS 287 Cb 0.00 -1.15 0.00 0.00 1.12 0.00 0.00 29.99 29.96 3h3v n HIS 287 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h3v n ALA 288 N -0.82 1.35 -0.12 -1.41 0.00 -0.19 -4.56 120.51 114.76 3h3v n ALA 288 Ca 0.57 -0.32 -0.18 0.00 0.00 0.00 0.00 53.44 53.51 3h3v n ALA 288 Cb 0.68 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.02 3h3v n ALA 288 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3h3v n ILE 289 N -0.03 1.37 0.32 0.00 3.06 -1.21 -4.01 119.36 118.87 3h3v n ILE 289 Ca 0.00 -0.51 0.04 0.00 -2.50 0.00 0.00 62.75 59.79 3h3v n ILE 289 Cb 0.14 -1.40 0.20 0.00 0.54 0.00 0.00 39.64 39.12 3h3v n ILE 289 CO 0.00 0.00 0.00 -1.84 -2.50 0.00 0.00 176.55 172.21 3h3v n GLU 290 N -3.30 0.01 0.00 9.51 0.28 -1.25 0.66 120.64 126.54 3h3v n GLU 290 Ca -0.43 0.33 0.13 0.00 -0.16 0.00 0.00 57.16 57.04 3h3v n GLU 290 Cb 0.94 -1.50 0.47 0.00 1.43 0.00 0.00 31.44 32.78 3h3v n GLU 290 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3h3v n GLU 291 N -1.49 0.32 0.00 3.44 1.02 -1.26 -3.42 120.64 119.26 3h3v n GLU 291 Ca 0.02 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 3h3v n GLU 291 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 3h3v n GLU 291 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h3v n ALA 292 N -1.22 1.74 0.09 0.62 0.00 0.21 -4.56 120.51 117.38 3h3v n ALA 292 Ca 0.10 -0.19 0.04 0.00 0.00 0.00 0.00 53.44 53.39 3h3v n ALA 292 Cb 0.32 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.75 3h3v n ALA 292 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3h3v h GLU 293 N 0.00 0.00 0.00 0.00 4.81 -1.11 -3.20 114.58 115.08 3h3v h GLU 293 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3h3v h GLU 293 Cb 0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.43 3h3v h GLU 293 CO 0.00 0.26 0.00 0.66 -0.73 0.00 0.00 179.01 179.20 3h3v h SER 294 N 0.00 0.00 0.03 1.04 4.64 -1.80 -2.79 113.55 114.67 3h3v h SER 294 Ca -0.08 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.07 3h3v h SER 294 Cb 1.38 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.48 3h3v h SER 294 CO 0.04 0.00 -0.69 0.25 -0.87 0.00 0.00 176.83 175.55 3h3v h LEU 295 N 0.00 0.57 -0.97 5.97 5.85 -1.82 -2.83 115.31 122.08 3h3v h LEU 295 Ca 0.00 -0.79 -0.07 0.00 0.84 0.00 0.00 57.88 57.86 3h3v h LEU 295 Cb 0.51 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 3h3v h LEU 295 CO 0.00 1.29 -0.02 0.25 -0.34 0.00 0.00 178.44 179.62 3h3v h LEU 296 N -0.09 0.70 -1.91 2.25 5.85 -1.63 0.83 115.31 121.31 3h3v h LEU 296 Ca -0.09 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.46 3h3v h LEU 296 Cb 1.42 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.26 3h3v h LEU 296 CO 0.14 0.78 0.00 -0.61 -0.34 0.00 0.00 178.44 178.40 3h3v h GLN 297 N 0.68 0.00 0.00 1.25 5.75 -1.53 -2.50 115.11 118.76 3h3v h GLN 297 Ca 0.13 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 3h3v h GLN 297 Cb 0.44 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.99 3h3v h GLN 297 CO 0.02 0.00 0.00 0.34 -2.65 0.00 0.00 178.83 176.54 3h3v n PHE 298 N -3.00 0.00 -0.22 3.99 7.35 0.17 -3.30 117.46 122.45 3h3v n PHE 298 Ca -0.01 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.68 3h3v n PHE 298 Cb 0.21 -0.41 0.06 0.00 0.35 0.00 0.00 39.48 39.70 3h3v n PHE 298 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 3h3v h HIS 299 N 0.00 -0.40 0.00 -5.13 3.86 -1.31 0.99 115.15 113.16 3h3v h HIS 299 Ca 0.00 0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3h3v h HIS 299 Cb 0.00 0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.75 3h3v h HIS 299 CO 0.00 -0.29 0.00 0.28 0.86 0.00 0.00 177.93 178.78 3h3v n VAL 300 N -5.45 0.48 -0.09 2.45 0.31 -0.94 0.01 118.33 115.11 3h3v n VAL 300 Ca 0.08 0.12 -0.15 0.00 -0.01 0.00 0.00 64.34 64.38 3h3v n VAL 300 Cb 0.34 -0.88 -0.08 0.00 -0.91 0.00 0.00 33.84 32.31 3h3v n VAL 300 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h3v h ALA 301 N 2.73 0.16 0.43 3.52 0.00 0.87 -3.40 119.26 123.57 3h3v h ALA 301 Ca 0.00 -0.92 -0.01 0.00 0.00 0.00 0.00 54.91 53.98 3h3v h ALA 301 Cb 0.11 0.62 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3h3v h ALA 301 CO 0.00 0.60 -0.39 1.15 0.00 0.00 0.00 179.25 180.61 3h3v h THR 302 N -1.00 0.20 -1.39 0.00 2.02 -0.02 -0.34 112.91 112.38 3h3v h THR 302 Ca -0.21 0.00 0.40 0.00 0.77 0.00 0.00 66.41 67.37 3h3v h THR 302 Cb 0.99 0.20 -0.06 0.00 -1.74 0.00 0.00 68.15 67.55 3h3v h THR 302 CO -0.13 0.00 1.02 0.00 0.37 0.00 0.00 175.52 176.78 3h3v n TYR 303 N -5.50 0.00 -0.10 3.16 9.36 0.10 -0.05 117.16 124.14 3h3v n TYR 303 Ca -0.11 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 60.96 3h3v n TYR 303 Cb 0.39 -0.35 -0.09 0.00 -0.63 0.00 0.00 39.34 38.67 3h3v n TYR 303 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 3h3v n MET 304 N -3.34 0.47 -3.86 2.98 2.81 -1.02 -2.54 117.12 112.63 3h3v n MET 304 Ca 0.31 0.13 -0.16 0.00 -1.81 0.00 0.00 57.70 56.17 3h3v n MET 304 Cb 1.44 -1.35 -0.16 0.00 -0.71 0.00 0.00 33.22 32.43 3h3v n MET 304 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3h3v s ASP 305 N -6.04 0.23 -0.15 7.83 -1.08 0.93 -0.08 116.67 118.31 3h3v s ASP 305 Ca -0.26 0.00 0.18 0.00 -0.52 0.00 0.00 52.55 51.96 3h3v s ASP 305 Cb 0.07 -0.14 0.45 0.00 -1.46 0.00 0.00 42.92 41.85 3h3v s ASP 305 CO 0.43 -0.11 1.17 -3.20 0.52 0.00 0.00 175.17 173.98 3h3v n ASN 306 N 4.09 1.91 -2.59 -0.34 2.85 -1.25 -3.44 115.26 116.48 3h3v n ASN 306 Ca -0.27 -2.78 -0.12 0.00 -0.11 0.00 0.00 54.58 51.31 3h3v n ASN 306 Cb 0.51 -0.41 0.03 0.00 1.24 0.00 0.00 39.78 41.15 3h3v n ASN 306 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3h3v n ASP 307 N -0.35 2.59 -2.85 1.20 8.00 -1.26 -4.93 116.55 118.95 3h3v n ASP 307 Ca 0.15 -2.84 -0.12 0.00 0.71 0.00 0.00 54.79 52.70 3h3v n ASP 307 Cb 0.93 -0.47 0.09 0.00 -0.02 0.00 0.00 41.12 41.64 3h3v n ASP 307 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3h3v n ILE 308 N -0.40 0.00 -0.05 0.53 5.41 -1.26 -5.03 119.36 118.56 3h3v n ILE 308 Ca 0.19 -0.30 -0.21 0.00 1.00 0.00 0.00 62.75 63.43 3h3v n ILE 308 Cb 0.81 -1.46 -0.13 0.00 -0.71 0.00 0.00 39.64 38.14 3h3v n ILE 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h3v n ALA 309 N -3.54 1.04 -1.39 -1.39 0.00 -1.26 -4.53 120.51 109.44 3h3v n ALA 309 Ca -0.09 -0.74 -0.41 0.00 0.00 0.00 0.00 53.44 52.20 3h3v n ALA 309 Cb 0.24 -0.47 -0.05 0.00 0.00 0.00 0.00 19.45 19.17 3h3v n ALA 309 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3v n GLY 310 N 1.97 2.48 0.00 0.00 0.00 -1.26 -4.87 105.19 103.50 3h3v n GLY 310 Ca -0.37 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.44 3h3v n GLY 310 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h3v n GLN 311 N 7.17 0.00 0.00 1.61 6.02 -1.26 -4.80 117.38 126.12 3h3v n GLN 311 Ca 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 3h3v n GLN 311 Cb 0.41 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.67 3h3v n GLN 311 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 3h3v n PRO 312 N -0.09 0.00 0.09 -1.09 -0.02 -1.26 -4.74 135.00 127.89 3h3v n PRO 312 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.61 3h3v n PRO 312 Cb 0.00 0.00 0.38 0.00 -0.02 0.00 0.00 33.50 33.86 3h3v n PRO 312 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3h3v n GLN 313 N 0.00 0.25 -3.24 -0.52 1.13 -1.26 -4.97 117.38 108.77 3h3v n GLN 313 Ca 0.00 0.19 -0.07 0.00 -1.94 0.00 0.00 57.00 55.18 3h3v n GLN 313 Cb 0.00 -1.77 0.00 0.00 0.11 0.00 0.00 30.24 28.58 3h3v n GLN 313 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3h3v n ALA 314 N -1.78 -2.59 -1.99 -1.58 0.00 -1.26 -4.86 120.51 106.45 3h3v n ALA 314 Ca 0.05 -0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.06 3h3v n ALA 314 Cb 0.43 -1.39 -0.04 0.00 0.00 0.00 0.00 19.45 18.44 3h3v n ALA 314 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3h3v s LEU 315 N -4.17 4.52 0.24 0.00 1.43 -1.26 -4.69 118.68 114.75 3h3v s LEU 315 Ca 0.01 2.09 -0.30 0.00 -1.03 0.00 0.00 54.13 54.91 3h3v s LEU 315 Cb -0.00 -3.61 -0.09 0.00 0.03 0.00 0.00 46.19 42.52 3h3v s LEU 315 CO 0.79 -0.16 1.27 -1.58 0.23 0.00 0.00 176.35 176.90 3h3v s GLN 316 N -0.62 4.42 -1.00 1.70 0.74 0.76 -4.75 119.66 120.93 3h3v s GLN 316 Ca 0.47 2.04 -0.27 0.00 0.05 0.00 0.00 55.36 57.66 3h3v s GLN 316 Cb -0.29 -3.17 -0.24 0.00 1.10 0.00 0.00 33.01 30.41 3h3v s GLN 316 CO 0.35 -0.17 2.59 1.17 -0.55 0.00 0.00 175.29 178.69 3h3v n LYS 317 N 2.05 0.00 0.00 1.67 4.81 -1.26 -2.09 118.16 123.34 3h3v n LYS 317 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 3h3v n LYS 317 Cb 0.43 -1.41 0.00 0.00 0.02 0.00 0.00 35.03 34.07 3h3v n LYS 317 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3h3v n SER 318 N 9.59 0.00 0.00 3.14 3.41 -1.26 -4.86 113.62 123.64 3h3v n SER 318 Ca 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 3h3v n SER 318 Cb 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 3h3v n SER 318 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h3v n GLY 319 N 0.00 0.00 3.64 5.00 0.00 -0.89 -4.92 105.19 108.02 3h3v n GLY 319 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3h3v n GLY 319 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h3v s ARG 320 N -1.56 4.19 0.02 1.61 3.52 -1.17 -4.84 118.95 120.72 3h3v s ARG 320 Ca 0.00 0.89 -0.04 0.00 -0.13 0.00 0.00 55.73 56.45 3h3v s ARG 320 Cb 0.00 -3.63 -0.01 0.00 -1.56 0.00 0.00 34.95 29.75 3h3v s ARG 320 CO 0.00 -0.47 0.40 -2.30 -0.81 0.00 0.00 175.30 172.12 3h3v n PRO 321 N 5.84 -0.05 0.00 5.12 -0.02 -1.26 -0.17 135.00 144.46 3h3v n PRO 321 Ca 0.04 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 3h3v n PRO 321 Cb 0.48 -0.60 0.00 0.00 -0.02 0.00 0.00 33.50 33.36 3h3v n PRO 321 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3h3v n VAL 322 N -3.07 0.00 -2.25 -1.45 0.31 -1.26 -4.10 118.33 106.50 3h3v n VAL 322 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.94 3h3v n VAL 322 Cb 0.03 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.93 3h3v n VAL 322 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3h3v s LYS 323 N -1.27 2.89 0.89 5.55 1.02 -1.26 -4.87 119.74 122.68 3h3v s LYS 323 Ca 0.00 0.31 -0.11 0.00 0.02 0.00 0.00 55.97 56.19 3h3v s LYS 323 Cb 0.00 -4.29 0.13 0.00 -0.52 0.00 0.00 37.83 33.15 3h3v s LYS 323 CO 0.00 -2.45 1.11 -1.54 -0.92 0.00 0.00 175.35 171.55 3h3v s SER 324 N 6.24 3.31 0.21 2.83 1.04 -1.26 -4.74 113.70 121.33 3h3v s SER 324 Ca 0.55 1.92 -0.10 0.00 0.48 0.00 0.00 55.95 58.79 3h3v s SER 324 Cb -0.11 -2.48 0.17 0.00 0.10 0.00 0.00 66.02 63.70 3h3v s SER 324 CO 0.19 -2.81 1.87 0.40 0.98 0.00 0.00 173.24 173.87 3h3v h ILE 325 N -1.67 1.16 -0.91 -1.02 2.04 -1.23 -0.81 117.51 115.07 3h3v h ILE 325 Ca -0.46 -0.33 0.21 0.00 1.00 0.00 0.00 64.86 65.28 3h3v h ILE 325 Cb 1.26 0.11 -0.12 0.00 -0.74 0.00 0.00 36.82 37.34 3h3v h ILE 325 CO 0.47 0.18 0.45 0.08 0.00 0.00 0.00 178.15 179.33 3h3v h ARG 326 N 0.96 0.49 0.00 2.37 0.11 -0.79 0.41 114.38 117.93 3h3v h ARG 326 Ca 0.28 -0.03 -0.01 0.00 0.10 0.00 0.00 59.98 60.32 3h3v h ARG 326 Cb -0.07 -0.11 -0.00 0.00 1.11 0.00 0.00 29.97 30.90 3h3v h ARG 326 CO -0.08 0.33 -0.03 0.00 0.10 0.00 0.00 179.97 180.29 3h3v h ALA 327 N 1.67 1.26 0.00 0.08 0.00 -1.37 -2.03 119.26 118.87 3h3v h ALA 327 Ca 0.55 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.38 3h3v h ALA 327 Cb 0.99 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3h3v h ALA 327 CO -0.47 0.04 -0.26 0.00 0.00 0.00 0.00 179.25 178.56 3h3v h ARG 328 N 0.00 0.00 0.00 0.00 3.08 -0.08 -3.31 114.38 114.07 3h3v h ARG 328 Ca -0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 3h3v h ARG 328 Cb 0.12 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 3h3v h ARG 328 CO 0.00 0.26 -2.20 1.28 -1.07 0.00 0.00 179.97 178.24 3h3v n LEU 329 N -3.21 0.00 -4.59 3.04 4.77 -0.82 -3.03 117.00 113.16 3h3v n LEU 329 Ca 0.02 0.00 -0.60 0.00 -0.03 0.00 0.00 56.01 55.40 3h3v n LEU 329 Cb 0.59 0.25 -0.08 0.00 -2.33 0.00 0.00 43.42 41.85 3h3v n LEU 329 CO 0.36 0.25 0.83 1.17 -1.33 0.00 0.00 177.39 178.67 3h3v n LYS 330 N -2.51 0.28 -0.60 3.23 4.81 -0.88 -4.13 118.16 118.36 3h3v n LYS 330 Ca -0.19 0.10 -0.21 0.00 -0.87 0.00 0.00 58.31 57.15 3h3v n LYS 330 Cb 0.87 -1.64 0.02 0.00 0.02 0.00 0.00 35.03 34.30 3h3v n LYS 330 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h3v n GLY 331 N 2.49 -2.41 1.87 3.14 0.00 -1.26 -3.82 105.19 105.19 3h3v n GLY 331 Ca 0.23 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3h3v n GLY 331 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3h3v n LYS 332 N 1.26 -3.60 -1.09 1.61 3.00 -1.26 -4.30 118.16 113.78 3h3v n LYS 332 Ca 0.00 2.55 -0.03 0.00 -0.00 0.00 0.00 58.31 60.83 3h3v n LYS 332 Cb 0.30 -2.95 -0.01 0.00 0.00 0.00 0.00 35.03 32.37 3h3v n LYS 332 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3h3v n GLU 333 N 1.49 -1.37 -3.73 1.64 -0.58 -1.26 -4.81 120.64 112.02 3h3v n GLU 333 Ca 0.00 0.50 -0.20 0.00 -0.42 0.00 0.00 57.16 57.04 3h3v n GLU 333 Cb 0.00 -4.61 -0.18 0.00 -0.57 0.00 0.00 31.44 26.09 3h3v n GLU 333 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3h3v s GLY 334 N -2.17 0.27 0.00 0.62 0.00 -1.25 -4.81 107.32 99.98 3h3v s GLY 334 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.83 3h3v s GLY 334 CO 0.00 1.18 0.00 -2.13 0.00 0.00 0.00 173.10 172.15 3h3v n ARG 335 N 5.04 0.00 0.00 2.90 3.00 -1.17 -2.07 116.66 124.36 3h3v n ARG 335 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.76 3h3v n ARG 335 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.96 3h3v n ARG 335 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 3h3v n ILE 336 N 0.00 0.00 0.28 5.15 2.08 -1.26 -0.07 119.36 125.54 3h3v n ILE 336 Ca 0.00 0.70 0.16 0.00 0.56 0.00 0.00 62.75 64.17 3h3v n ILE 336 Cb 0.00 -1.67 0.81 0.00 -0.75 0.00 0.00 39.64 38.03 3h3v n ILE 336 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 3h3v h ARG 337 N 0.00 0.00 0.00 0.38 2.43 -1.75 -0.15 114.38 115.30 3h3v h ARG 337 Ca 0.00 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 3h3v h ARG 337 Cb 0.00 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 3h3v h ARG 337 CO 0.00 0.07 -1.13 0.78 -1.51 0.00 0.00 179.97 178.18 3h3v h GLY 338 N 0.97 0.01 -0.35 2.80 0.00 -1.51 -3.36 103.07 101.63 3h3v h GLY 338 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.30 3h3v h GLY 338 CO 0.01 0.02 -0.43 0.70 0.00 0.00 0.00 176.54 176.84 3h3v n ASN 339 N -4.43 1.09 -0.02 0.19 3.02 -0.13 -4.32 115.26 110.66 3h3v n ASN 339 Ca -0.29 -1.05 -0.04 0.00 -0.03 0.00 0.00 54.58 53.17 3h3v n ASN 339 Cb 0.67 0.70 -0.02 0.00 -0.61 0.00 0.00 39.78 40.52 3h3v n ASN 339 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3h3v n LEU 340 N -0.67 2.36 0.10 3.41 4.77 0.89 -4.53 117.00 123.33 3h3v n LEU 340 Ca 0.04 -0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.14 3h3v n LEU 340 Cb 0.25 -0.16 0.45 0.00 -2.33 0.00 0.00 43.42 41.63 3h3v n LEU 340 CO 0.21 0.47 0.87 0.23 -1.33 0.00 0.00 177.39 177.84 3h3v n MET 341 N -2.78 0.20 -3.48 3.23 2.81 -0.12 -4.57 117.12 112.41 3h3v n MET 341 Ca -0.09 0.28 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 3h3v n MET 341 Cb 0.59 -1.80 -0.04 0.00 -0.71 0.00 0.00 33.22 31.26 3h3v n MET 341 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3h3v s GLY 342 N -3.50 -0.25 0.51 3.03 0.00 -1.26 -5.04 107.32 100.82 3h3v s GLY 342 Ca 0.08 2.95 0.00 0.00 0.00 0.00 0.00 44.72 47.75 3h3v s GLY 342 CO 0.50 3.09 0.01 0.28 0.00 0.00 0.00 173.10 176.97 3h3v n LYS 343 N 4.82 0.76 -3.46 2.90 5.02 -1.26 -3.81 118.16 123.13 3h3v n LYS 343 Ca -0.11 -3.72 -0.30 0.00 -2.02 0.00 0.00 58.31 52.16 3h3v n LYS 343 Cb 0.53 1.03 -0.04 0.00 -0.02 0.00 0.00 35.03 36.53 3h3v n LYS 343 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3h3v s ARG 344 N -3.83 3.66 0.35 1.97 0.52 -1.26 -5.09 118.95 115.27 3h3v s ARG 344 Ca 0.01 0.03 0.04 0.00 -0.52 0.00 0.00 55.73 55.29 3h3v s ARG 344 Cb 0.00 -2.70 -0.06 0.00 0.52 0.00 0.00 34.95 32.70 3h3v s ARG 344 CO 0.01 0.31 0.05 0.14 0.02 0.00 0.00 175.30 175.83 3h3v s VAL 345 N -1.91 1.31 0.43 3.52 -7.23 -1.26 -5.15 120.40 110.11 3h3v s VAL 345 Ca 0.44 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.69 3h3v s VAL 345 Cb -0.11 -2.80 -0.00 0.00 0.56 0.00 0.00 36.38 34.03 3h3v s VAL 345 CO 0.26 0.00 0.48 -1.81 -0.31 0.00 0.00 175.10 173.72 3h3v s ASP 346 N -3.54 5.29 -1.07 4.85 1.01 -1.26 -4.68 116.67 117.27 3h3v s ASP 346 Ca 0.35 -0.63 -0.12 0.00 0.71 0.00 0.00 52.55 52.86 3h3v s ASP 346 Cb 0.09 -0.53 -0.04 0.00 1.01 0.00 0.00 42.92 43.44 3h3v s ASP 346 CO 0.16 -0.75 0.86 0.49 0.21 0.00 0.00 175.17 176.14 3h3v n PHE 347 N -1.72 -2.26 -3.70 4.23 3.01 -1.26 -4.84 117.46 110.92 3h3v n PHE 347 Ca 0.06 0.71 -0.14 0.00 1.01 0.00 0.00 57.45 59.08 3h3v n PHE 347 Cb 0.61 -3.84 -0.09 0.00 -0.01 0.00 0.00 39.48 36.15 3h3v n PHE 347 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3h3v s SER 348 N -3.40 -0.43 0.14 4.37 1.04 -1.26 -1.76 113.70 112.40 3h3v s SER 348 Ca 0.45 0.66 -0.01 0.00 0.48 0.00 0.00 55.95 57.52 3h3v s SER 348 Cb -0.10 0.71 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 3h3v s SER 348 CO 0.79 -0.32 0.08 0.00 0.98 0.00 0.00 173.24 174.77 3h3v s ALA 349 N -0.44 0.88 -0.17 5.32 0.00 0.18 -4.96 121.76 122.57 3h3v s ALA 349 Ca -0.06 -1.49 -0.21 0.00 0.00 0.00 0.00 51.96 50.20 3h3v s ALA 349 Cb -0.03 0.96 0.06 0.00 0.00 0.00 0.00 23.12 24.10 3h3v s ALA 349 CO 0.03 -0.51 0.57 0.50 0.00 0.00 0.00 175.76 176.35 3h3v s ARG 350 N -4.06 0.73 0.00 0.00 3.52 -1.26 0.02 118.95 117.90 3h3v s ARG 350 Ca 0.26 0.62 0.00 0.00 -0.13 0.00 0.00 55.73 56.49 3h3v s ARG 350 Cb 0.07 0.35 0.00 0.00 -1.56 0.00 0.00 34.95 33.82 3h3v s ARG 350 CO 0.03 -0.13 0.00 0.25 -0.81 0.00 0.00 175.30 174.65 3h3v n THR 351 N 2.33 0.00 -3.84 4.11 -2.24 -1.22 -4.98 114.28 108.44 3h3v n THR 351 Ca -0.15 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.27 3h3v n THR 351 Cb 0.56 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.71 3h3v n THR 351 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3h3v s VAL 352 N -0.70 5.26 0.07 2.28 1.01 -1.26 -3.07 120.40 123.99 3h3v s VAL 352 Ca 0.00 0.13 -0.05 0.00 0.00 0.00 0.00 61.98 62.06 3h3v s VAL 352 Cb 0.00 -3.37 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 3h3v s VAL 352 CO 0.00 0.49 0.31 0.27 0.00 0.00 0.00 175.10 176.17 3h3v s ILE 353 N 0.02 5.25 -0.12 2.22 -4.36 -0.78 -1.89 121.20 121.55 3h3v s ILE 353 Ca 0.09 0.03 -0.09 0.00 -0.26 0.00 0.00 60.65 60.42 3h3v s ILE 353 Cb -0.11 -3.61 0.04 0.00 1.25 0.00 0.00 42.46 40.03 3h3v s ILE 353 CO -0.00 0.20 0.30 -0.94 0.24 0.00 0.00 174.94 174.74 3h3v s SER 354 N -2.13 -0.33 1.11 4.36 1.04 -0.79 -4.70 113.70 112.25 3h3v s SER 354 Ca 0.34 0.62 -0.13 0.00 0.48 0.00 0.00 55.95 57.27 3h3v s SER 354 Cb -0.13 0.58 0.25 0.00 0.10 0.00 0.00 66.02 66.82 3h3v s SER 354 CO 0.22 -0.13 1.05 -0.83 0.98 0.00 0.00 173.24 174.52 3h3v s GLY 355 N 0.66 1.55 -0.30 7.32 0.00 -1.26 -3.25 107.32 112.03 3h3v s GLY 355 Ca -0.04 -0.27 -0.10 0.00 0.00 0.00 0.00 44.72 44.31 3h3v s GLY 355 CO -0.04 0.42 0.93 -0.35 0.00 0.00 0.00 173.10 174.06 3h3v s ASP 356 N -2.92 -0.71 0.00 1.64 -1.08 -1.04 -4.82 116.67 107.74 3h3v s ASP 356 Ca 0.67 0.42 -0.03 0.00 -0.52 0.00 0.00 52.55 53.10 3h3v s ASP 356 Cb -0.22 1.58 -0.13 0.00 -1.46 0.00 0.00 42.92 42.70 3h3v s ASP 356 CO 0.62 -0.13 2.37 -0.81 0.52 0.00 0.00 175.17 177.74 3h3v n PRO 357 N 5.45 1.24 0.00 4.34 -0.04 -1.26 -3.31 135.00 141.41 3h3v n PRO 357 Ca -0.05 -0.47 0.00 0.00 -0.04 0.00 0.00 63.50 62.94 3h3v n PRO 357 Cb 0.53 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 3h3v n PRO 357 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3h3v n ASN 358 N 2.23 0.00 -4.13 3.54 3.02 -1.26 -4.72 115.26 113.94 3h3v n ASN 358 Ca 0.20 -1.00 -0.31 0.00 -0.03 0.00 0.00 54.58 53.45 3h3v n ASN 358 Cb 0.58 0.00 -0.17 0.00 -0.61 0.00 0.00 39.78 39.59 3h3v n ASN 358 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3h3v s LEU 359 N 0.00 1.94 0.51 3.41 1.43 -1.21 -5.10 118.68 119.66 3h3v s LEU 359 Ca 0.00 -0.52 -0.22 0.00 -1.03 0.00 0.00 54.13 52.37 3h3v s LEU 359 Cb 0.00 -1.28 -0.07 0.00 0.03 0.00 0.00 46.19 44.87 3h3v s LEU 359 CO 0.00 0.07 1.10 -0.62 0.23 0.00 0.00 176.35 177.13 3h3v n GLU 360 N 3.99 1.36 0.00 1.70 -0.58 -1.26 -4.56 120.64 121.30 3h3v n GLU 360 Ca -0.20 0.50 0.00 0.00 -0.42 0.00 0.00 57.16 57.04 3h3v n GLU 360 Cb 0.52 -2.24 0.00 0.00 -0.57 0.00 0.00 31.44 29.14 3h3v n GLU 360 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3h3v n LEU 361 N -0.26 0.00 0.00 -4.62 7.94 -1.26 0.77 117.00 119.57 3h3v n LEU 361 Ca 0.10 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 55.02 3h3v n LEU 361 Cb 0.43 0.00 0.06 0.00 0.53 0.00 0.00 43.42 44.44 3h3v n LEU 361 CO 0.54 0.00 0.54 -0.90 -1.11 0.00 0.00 177.39 176.46 3h3v n ASP 362 N -1.76 0.00 -4.65 1.96 3.85 -1.26 -4.42 116.55 110.26 3h3v n ASP 362 Ca 0.00 0.50 -0.29 0.00 -0.71 0.00 0.00 54.79 54.29 3h3v n ASP 362 Cb 0.00 -0.50 0.14 0.00 -1.35 0.00 0.00 41.12 39.41 3h3v n ASP 362 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 3h3v s GLN 363 N -2.99 1.06 -0.30 0.11 -0.21 0.23 0.41 119.66 117.96 3h3v s GLN 363 Ca 0.01 0.14 -0.07 0.00 0.02 0.00 0.00 55.36 55.46 3h3v s GLN 363 Cb 0.02 -1.84 0.16 0.00 1.00 0.00 0.00 33.01 32.35 3h3v s GLN 363 CO 0.05 -2.22 0.70 0.54 -2.12 0.00 0.00 175.29 172.25 3h3v s VAL 364 N -3.40 -0.88 -0.12 1.09 0.11 -0.66 -4.44 120.40 112.11 3h3v s VAL 364 Ca 0.65 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.41 3h3v s VAL 364 Cb -0.12 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.71 3h3v s VAL 364 CO 0.53 0.00 1.19 -0.83 -3.33 0.00 0.00 175.10 172.66 3h3v s GLY 365 N 2.83 1.92 -0.18 6.54 0.00 0.22 -1.87 107.32 116.79 3h3v s GLY 365 Ca 0.06 0.50 -0.02 0.00 0.00 0.00 0.00 44.72 45.25 3h3v s GLY 365 CO -0.19 2.29 -0.09 0.14 0.00 0.00 0.00 173.10 175.25 3h3v s VAL 366 N 2.75 3.14 0.10 1.40 1.01 0.96 -1.76 120.40 128.00 3h3v s VAL 366 Ca 0.54 -0.59 -0.31 0.00 0.00 0.00 0.00 61.98 61.61 3h3v s VAL 366 Cb -0.22 -2.38 -0.10 0.00 0.00 0.00 0.00 36.38 33.67 3h3v s VAL 366 CO 0.17 0.47 1.87 -0.81 0.00 0.00 0.00 175.10 176.81 3h3v n PRO 367 N 4.29 2.79 -0.55 2.72 -0.04 -1.24 -0.51 135.00 142.46 3h3v n PRO 367 Ca -0.18 1.02 0.43 0.00 -0.04 0.00 0.00 63.50 64.72 3h3v n PRO 367 Cb 0.51 -2.92 0.68 0.00 -0.04 0.00 0.00 33.50 31.74 3h3v n PRO 367 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3h3v n LYS 368 N 6.07 -0.01 -0.13 0.54 4.81 -0.64 0.15 118.16 128.94 3h3v n LYS 368 Ca 0.19 1.05 -0.04 0.00 -0.87 0.00 0.00 58.31 58.64 3h3v n LYS 368 Cb 0.38 -2.25 0.03 0.00 0.02 0.00 0.00 35.03 33.21 3h3v n LYS 368 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3h3v h SER 369 N 0.00 -0.32 0.22 3.14 0.87 -1.88 -2.48 113.55 113.10 3h3v h SER 369 Ca 0.83 0.12 -0.21 0.00 -1.23 0.00 0.00 61.79 61.30 3h3v h SER 369 Cb 3.04 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 65.23 3h3v h SER 369 CO -0.20 -0.11 -0.83 0.40 -0.53 0.00 0.00 176.83 175.57 3h3v h ILE 370 N 0.04 1.37 -0.03 2.23 2.04 0.11 -3.00 117.51 120.27 3h3v h ILE 370 Ca 0.21 -2.23 0.01 0.00 1.00 0.00 0.00 64.86 63.85 3h3v h ILE 370 Cb 0.32 2.21 -0.00 0.00 -0.74 0.00 0.00 36.82 38.62 3h3v h ILE 370 CO -0.42 0.67 0.08 0.00 0.00 0.00 0.00 178.15 178.48 3h3v h ALA 371 N 0.79 1.32 0.00 1.87 0.00 -1.15 0.13 119.26 122.22 3h3v h ALA 371 Ca -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3h3v h ALA 371 Cb 1.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.23 3h3v h ALA 371 CO 0.15 -0.09 -0.96 1.63 0.00 0.00 0.00 179.25 179.98 3h3v n LYS 372 N -3.38 0.54 -0.07 0.00 5.02 -0.97 -2.93 118.16 116.38 3h3v n LYS 372 Ca -0.02 0.11 -0.09 0.00 -2.02 0.00 0.00 58.31 56.29 3h3v n LYS 372 Cb 0.16 -1.79 -0.07 0.00 -0.02 0.00 0.00 35.03 33.30 3h3v n LYS 372 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3h3v h THR 373 N 0.00 0.81 -4.26 -0.18 2.02 -0.73 -3.47 112.91 107.09 3h3v h THR 373 Ca 0.00 -1.68 -0.50 0.00 0.77 0.00 0.00 66.41 65.00 3h3v h THR 373 Cb 0.95 1.60 0.07 0.00 -1.74 0.00 0.00 68.15 69.03 3h3v h THR 373 CO 0.00 0.27 0.37 -0.76 0.37 0.00 0.00 175.52 175.78 3h3v s LEU 374 N -8.28 3.35 0.19 2.58 1.43 -0.50 -5.07 118.68 112.39 3h3v s LEU 374 Ca -0.14 1.71 -0.05 0.00 -1.03 0.00 0.00 54.13 54.63 3h3v s LEU 374 Cb 0.00 -4.51 -0.03 0.00 0.03 0.00 0.00 46.19 41.68 3h3v s LEU 374 CO 0.38 -1.24 0.21 0.28 0.23 0.00 0.00 176.35 176.21 3h3v s THR 375 N -2.72 0.03 -0.05 5.49 -1.32 -1.26 -3.63 115.64 112.18 3h3v s THR 375 Ca 0.61 -1.77 -0.01 0.00 -1.21 0.00 0.00 61.69 59.31 3h3v s THR 375 Cb -0.15 -2.26 0.03 0.00 -1.51 0.00 0.00 72.50 68.61 3h3v s THR 375 CO 0.44 -0.13 0.02 -0.47 -2.21 0.00 0.00 174.62 172.28 3h3v s TYR 376 N -4.08 0.37 -0.61 9.09 5.04 0.76 -4.87 117.35 123.04 3h3v s TYR 376 Ca 0.30 0.02 -0.27 0.00 -2.44 0.00 0.00 57.07 54.68 3h3v s TYR 376 Cb 0.05 -0.59 0.00 0.00 0.35 0.00 0.00 41.96 41.78 3h3v s TYR 376 CO 0.08 -0.23 1.57 -1.25 -1.34 0.00 0.00 175.55 174.38 3h3v s PRO 377 N 1.77 3.02 0.02 4.97 0.04 -1.26 -1.14 135.00 142.42 3h3v s PRO 377 Ca 0.01 0.38 -0.01 0.00 0.04 0.00 0.00 61.00 61.42 3h3v s PRO 377 Cb -0.13 -4.24 -0.04 0.00 0.04 0.00 0.00 34.50 30.13 3h3v s PRO 377 CO -0.03 -2.29 0.16 -2.00 0.04 0.00 0.00 177.00 172.88 3h3v s GLU 378 N 6.15 3.32 -0.32 4.56 2.12 -1.20 -4.90 118.70 128.42 3h3v s GLU 378 Ca 0.55 -0.42 -0.12 0.00 0.36 0.00 0.00 54.97 55.34 3h3v s GLU 378 Cb -0.11 -3.00 -0.03 0.00 0.26 0.00 0.00 34.13 31.24 3h3v s GLU 378 CO 0.21 0.64 0.23 0.14 -0.54 0.00 0.00 175.26 175.95 3h3v s VAL 379 N -1.36 5.29 -0.48 3.70 -7.23 -1.26 0.26 120.40 119.32 3h3v s VAL 379 Ca 0.29 -0.04 -0.35 0.00 -1.81 0.00 0.00 61.98 60.06 3h3v s VAL 379 Cb -0.13 -3.65 -0.14 0.00 0.56 0.00 0.00 36.38 33.03 3h3v s VAL 379 CO 0.21 0.09 2.28 0.52 -0.31 0.00 0.00 175.10 177.88 3h3v n VAL 380 N 5.10 0.10 -4.33 1.32 0.31 0.26 -4.87 118.33 116.22 3h3v n VAL 380 Ca -0.13 -0.23 -0.23 0.00 -0.01 0.00 0.00 64.34 63.74 3h3v n VAL 380 Cb 0.51 -1.39 -0.13 0.00 -0.91 0.00 0.00 33.84 31.92 3h3v n VAL 380 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3h3v s THR 381 N 7.82 1.53 -1.70 2.52 -1.32 -1.26 -2.30 115.64 120.93 3h3v s THR 381 Ca 1.14 -1.39 0.00 0.00 -1.21 0.00 0.00 61.69 60.23 3h3v s THR 381 Cb -0.96 -1.40 0.00 0.00 -1.51 0.00 0.00 72.50 68.63 3h3v s THR 381 CO 0.50 -0.04 0.00 -0.81 -2.21 0.00 0.00 174.62 172.05 3h3v n PRO 382 N 1.32 0.00 -0.00 7.08 -0.04 -1.26 0.58 135.00 142.67 3h3v n PRO 382 Ca -0.19 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.34 3h3v n PRO 382 Cb 0.54 -1.00 -0.11 0.00 -0.04 0.00 0.00 33.50 32.89 3h3v n PRO 382 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3h3v n TYR 383 N -0.20 0.00 -1.57 0.54 0.53 -1.26 -4.59 117.16 110.61 3h3v n TYR 383 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 3h3v n TYR 383 Cb 0.00 -0.15 0.00 0.00 -1.03 0.00 0.00 39.34 38.16 3h3v n TYR 383 CO 0.00 0.00 0.00 0.27 -1.02 0.00 0.00 176.86 176.11 3h3v n ASN 384 N -1.66 0.00 0.28 7.72 0.23 0.18 -4.86 115.26 117.15 3h3v n ASN 384 Ca 0.01 -1.00 0.11 0.00 -0.53 0.00 0.00 54.58 53.17 3h3v n ASN 384 Cb 0.32 0.00 0.53 0.00 -2.08 0.00 0.00 39.78 38.55 3h3v n ASN 384 CO 0.00 0.00 0.00 -0.29 -0.93 0.00 0.00 177.26 176.04 3h3v h ILE 385 N 2.75 0.03 0.00 1.53 -0.00 -0.12 0.07 117.51 121.77 3h3v h ILE 385 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 3h3v h ILE 385 Cb 0.94 0.41 0.00 0.00 -0.00 0.00 0.00 36.82 38.17 3h3v h ILE 385 CO 0.00 0.00 -0.26 0.44 -0.00 0.00 0.00 178.15 178.33 3h3v h ASP 386 N 0.00 0.00 -1.21 2.19 3.32 -1.89 -3.17 116.42 115.65 3h3v h ASP 386 Ca 0.04 0.00 0.42 0.00 0.02 0.00 0.00 57.03 57.51 3h3v h ASP 386 Cb 1.26 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.66 3h3v h ASP 386 CO -0.00 0.41 0.75 -0.09 -1.72 0.00 0.00 179.24 178.58 3h3v h ARG 387 N -0.55 0.09 -0.01 3.56 2.43 -1.56 0.15 114.38 118.50 3h3v h ARG 387 Ca 0.00 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 3h3v h ARG 387 Cb 0.26 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3h3v h ARG 387 CO 0.00 0.06 -0.21 -0.07 -1.51 0.00 0.00 179.97 178.24 3h3v h LEU 388 N 0.09 0.20 -1.38 3.80 4.07 -1.21 -2.47 115.31 118.40 3h3v h LEU 388 Ca 0.82 -0.75 0.25 0.00 0.08 0.00 0.00 57.88 58.29 3h3v h LEU 388 Cb 2.40 -0.06 -0.09 0.00 1.08 0.00 0.00 40.66 43.99 3h3v h LEU 388 CO -0.53 0.92 0.66 0.74 -1.08 0.00 0.00 178.44 179.16 3h3v h THR 389 N -0.50 0.55 0.73 0.22 2.02 -0.71 0.87 112.91 116.10 3h3v h THR 389 Ca -0.02 -0.14 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 3h3v h THR 389 Cb 0.95 0.11 0.01 0.00 -1.74 0.00 0.00 68.15 67.47 3h3v h THR 389 CO 0.04 0.07 -0.35 -0.61 0.37 0.00 0.00 175.52 175.04 3h3v h GLN 390 N 0.41 -0.95 -0.38 6.66 5.75 -1.25 -0.21 115.11 125.15 3h3v h GLN 390 Ca 0.57 0.06 0.06 0.00 -0.15 0.00 0.00 58.65 59.20 3h3v h GLN 390 Cb 1.44 0.22 -0.05 0.00 1.07 0.00 0.00 27.48 30.16 3h3v h GLN 390 CO -0.28 -0.61 0.08 -0.07 -2.65 0.00 0.00 178.83 175.30 3h3v h LEU 391 N -1.12 0.02 0.04 -2.39 3.38 -0.25 1.26 115.31 116.24 3h3v h LEU 391 Ca -0.10 0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.96 3h3v h LEU 391 Cb 0.78 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.56 3h3v h LEU 391 CO 0.16 0.04 -0.35 0.58 0.09 0.00 0.00 178.44 178.97 3h3v h VAL 392 N 0.20 0.26 0.00 1.22 2.07 0.69 -0.84 116.25 119.84 3h3v h VAL 392 Ca 0.18 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.62 3h3v h VAL 392 Cb 0.21 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 3h3v h VAL 392 CO -0.23 0.00 -0.39 0.03 0.02 0.00 0.00 177.57 176.99 3h3v h ARG 393 N -0.53 0.00 0.00 1.57 3.08 -0.64 -2.72 114.38 115.14 3h3v h ARG 393 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3h3v h ARG 393 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 3h3v h ARG 393 CO -0.26 0.39 0.26 -0.91 -1.07 0.00 0.00 179.97 178.38 3h3v h ASN 394 N 0.00 0.00 -4.05 7.04 2.35 0.31 -3.45 115.58 117.78 3h3v h ASN 394 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3h3v h ASN 394 Cb 0.73 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.10 3h3v h ASN 394 CO 0.05 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.44 3h3v n GLY 395 N -1.26 -1.65 1.84 2.83 0.00 -1.03 -4.38 105.19 101.54 3h3v n GLY 395 Ca -0.01 -1.53 -0.16 0.00 0.00 0.00 0.00 46.02 44.32 3h3v n GLY 395 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h3v n PRO 396 N -1.99 2.24 0.00 1.61 -0.04 -1.19 -2.85 135.00 132.78 3h3v n PRO 396 Ca 0.00 -3.07 0.00 0.00 -0.04 0.00 0.00 63.50 60.39 3h3v n PRO 396 Cb 0.00 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.40 3h3v n PRO 396 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3h3v n ASN 397 N -1.05 2.95 -4.68 3.54 4.13 -1.26 -4.92 115.26 113.96 3h3v n ASN 397 Ca 0.49 0.00 -0.31 0.00 1.68 0.00 0.00 54.58 56.44 3h3v n ASN 397 Cb 1.43 0.00 0.16 0.00 -1.54 0.00 0.00 39.78 39.83 3h3v n ASN 397 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3h3v s GLU 398 N -1.93 1.13 0.00 3.52 2.02 -1.26 -4.98 118.70 117.20 3h3v s GLU 398 Ca 0.00 1.36 0.00 0.00 0.02 0.00 0.00 54.97 56.35 3h3v s GLU 398 Cb 0.00 -1.75 0.00 0.00 0.10 0.00 0.00 34.13 32.48 3h3v s GLU 398 CO 0.00 -2.49 0.20 1.58 0.02 0.00 0.00 175.26 174.56 3h3v n HIS 399 N -4.12 0.00 -1.54 1.61 -0.00 -1.26 -4.15 115.22 105.75 3h3v n HIS 399 Ca 0.10 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.54 3h3v n HIS 399 Cb 0.53 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.43 3h3v n HIS 399 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 3h3v n PRO 400 N -0.24 0.62 0.00 1.57 -0.02 -1.26 -4.70 135.00 130.97 3h3v n PRO 400 Ca 0.00 -0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.20 3h3v n PRO 400 Cb 0.00 -2.99 0.00 0.00 -0.02 0.00 0.00 33.50 30.49 3h3v n PRO 400 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h3v n GLY 401 N 6.28 4.51 3.49 -1.23 0.00 -1.26 -4.76 105.19 112.23 3h3v n GLY 401 Ca 0.48 -0.86 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 3h3v n GLY 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3v s ALA 402 N -1.56 -1.78 0.00 4.61 0.00 -1.13 -1.54 121.76 120.37 3h3v s ALA 402 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 51.96 52.92 3h3v s ALA 402 Cb 0.00 0.41 0.00 0.00 0.00 0.00 0.00 23.12 23.53 3h3v s ALA 402 CO 0.00 -0.65 0.09 0.36 0.00 0.00 0.00 175.76 175.56 3h3v n LYS 403 N -0.12 4.70 -3.80 0.00 2.85 -1.10 -3.15 118.16 117.53 3h3v n LYS 403 Ca -0.12 -0.09 -0.13 0.00 -1.05 0.00 0.00 58.31 56.92 3h3v n LYS 403 Cb 0.62 -0.55 -0.13 0.00 -0.65 0.00 0.00 35.03 34.32 3h3v n LYS 403 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3h3v s TYR 404 N -0.70 -0.19 -0.14 5.58 4.12 -1.16 -2.09 117.35 122.77 3h3v s TYR 404 Ca 0.00 0.48 -0.00 0.00 0.02 0.00 0.00 57.07 57.57 3h3v s TYR 404 Cb 0.00 0.05 0.03 0.00 -1.52 0.00 0.00 41.96 40.52 3h3v s TYR 404 CO 0.00 -0.10 -0.10 0.08 0.02 0.00 0.00 175.55 175.44 3h3v s VAL 405 N 0.23 1.32 -0.16 0.71 1.01 -1.11 0.19 120.40 122.59 3h3v s VAL 405 Ca -0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 3h3v s VAL 405 Cb -0.02 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 3h3v s VAL 405 CO -0.01 0.35 -0.11 0.27 0.00 0.00 0.00 175.10 175.61 3h3v s ILE 406 N 1.58 3.11 0.69 2.22 -4.36 0.37 -0.73 121.20 124.07 3h3v s ILE 406 Ca 0.04 -0.62 -0.07 0.00 -0.26 0.00 0.00 60.65 59.74 3h3v s ILE 406 Cb -0.13 -2.34 0.05 0.00 1.25 0.00 0.00 42.46 41.28 3h3v s ILE 406 CO -0.09 0.49 1.01 -0.13 0.24 0.00 0.00 174.94 176.46 3h3v s ARG 407 N 0.76 2.36 0.17 0.37 0.52 -1.08 -0.59 118.95 121.46 3h3v s ARG 407 Ca -0.04 -0.14 -0.17 0.00 -0.52 0.00 0.00 55.73 54.86 3h3v s ARG 407 Cb -0.15 -2.16 0.11 0.00 0.52 0.00 0.00 34.95 33.26 3h3v s ARG 407 CO 0.01 -1.15 1.66 0.38 0.02 0.00 0.00 175.30 176.23 3h3v h ASP 408 N -0.55 -0.40 0.00 0.23 3.04 -1.89 -3.14 116.42 113.70 3h3v h ASP 408 Ca -0.45 0.13 0.00 0.00 -3.24 0.00 0.00 57.03 53.47 3h3v h ASP 408 Cb 1.30 0.27 0.00 0.00 -1.04 0.00 0.00 39.33 39.86 3h3v h ASP 408 CO 0.61 -0.14 0.60 -1.54 -2.04 0.00 0.00 179.24 176.73 3h3v n SER 409 N -5.32 0.00 -1.99 4.15 3.41 -1.26 -4.62 113.62 107.99 3h3v n SER 409 Ca 0.03 -1.58 0.00 0.00 -0.26 0.00 0.00 58.87 57.06 3h3v n SER 409 Cb 0.23 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 3h3v n SER 409 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h3v n GLY 410 N 3.20 0.00 2.90 5.00 0.00 -1.18 -4.83 105.19 110.28 3h3v n GLY 410 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 3h3v n GLY 410 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h3v s ASP 411 N -2.36 0.70 -0.21 1.61 2.15 -1.26 -5.05 116.67 112.25 3h3v s ASP 411 Ca 0.00 -0.09 -0.11 0.00 0.43 0.00 0.00 52.55 52.78 3h3v s ASP 411 Cb 0.00 -0.27 -0.05 0.00 -0.30 0.00 0.00 42.92 42.30 3h3v s ASP 411 CO 0.00 -0.03 0.18 0.00 -0.17 0.00 0.00 175.17 175.15 3h3v s ARG 412 N 0.60 4.16 -0.10 4.34 1.70 -1.26 -2.64 118.95 125.75 3h3v s ARG 412 Ca -0.07 -0.17 -0.21 0.00 -0.47 0.00 0.00 55.73 54.81 3h3v s ARG 412 Cb -0.10 -3.47 -0.04 0.00 -0.57 0.00 0.00 34.95 30.77 3h3v s ARG 412 CO -0.00 0.19 0.60 0.42 -1.08 0.00 0.00 175.30 175.43 3h3v s ILE 413 N 0.67 5.10 -0.85 4.99 1.01 0.09 -4.99 121.20 127.22 3h3v s ILE 413 Ca 0.10 1.22 -0.18 0.00 0.00 0.00 0.00 60.65 61.78 3h3v s ILE 413 Cb -0.12 -3.94 0.14 0.00 0.01 0.00 0.00 42.46 38.55 3h3v s ILE 413 CO 0.02 0.27 0.99 -0.62 0.00 0.00 0.00 174.94 175.59 3h3v s ASP 414 N 0.76 6.58 0.10 3.58 -1.08 -1.26 -2.73 116.67 122.62 3h3v s ASP 414 Ca 0.32 -2.05 0.01 0.00 -0.52 0.00 0.00 52.55 50.31 3h3v s ASP 414 Cb -0.16 -2.35 0.06 0.00 -1.46 0.00 0.00 42.92 39.01 3h3v s ASP 414 CO 0.14 -0.98 0.68 0.18 0.52 0.00 0.00 175.17 175.71 3h3v n LEU 415 N 6.02 0.03 -0.30 -1.34 4.77 -0.89 -1.25 117.00 124.04 3h3v n LEU 415 Ca 0.16 0.16 0.09 0.00 -0.03 0.00 0.00 56.01 56.39 3h3v n LEU 415 Cb 0.48 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 3h3v n LEU 415 CO 0.48 -0.17 0.19 -2.11 -1.33 0.00 0.00 177.39 174.45 3h3v n ARG 416 N -1.31 1.45 0.00 3.23 1.85 -1.26 -4.70 116.66 115.92 3h3v n ARG 416 Ca -0.00 -0.64 0.00 0.00 -1.00 0.00 0.00 57.85 56.21 3h3v n ARG 416 Cb 0.48 -1.34 0.00 0.00 -1.05 0.00 0.00 32.46 30.55 3h3v n ARG 416 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3h3v n TYR 417 N -0.45 0.00 -1.31 2.89 0.53 -0.38 -5.06 117.16 113.38 3h3v n TYR 417 Ca 0.06 0.00 -0.56 0.00 -1.02 0.00 0.00 57.90 56.38 3h3v n TYR 417 Cb 0.35 0.03 -0.10 0.00 -1.03 0.00 0.00 39.34 38.59 3h3v n TYR 417 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 3h3v n SER 418 N -2.10 0.85 -0.37 7.72 2.88 -0.93 -4.65 113.62 117.03 3h3v n SER 418 Ca 0.00 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.35 3h3v n SER 418 Cb 0.26 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 3h3v n SER 418 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 3h3v n LYS 419 N 5.06 0.00 0.00 -1.46 2.85 -1.26 0.09 118.16 123.44 3h3v n LYS 419 Ca 0.38 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.64 3h3v n LYS 419 Cb -0.04 -0.88 0.00 0.00 -0.65 0.00 0.00 35.03 33.46 3h3v n LYS 419 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3h3v n ARG 420 N 0.16 0.99 -0.14 -1.58 1.74 -1.26 -4.90 116.66 111.66 3h3v n ARG 420 Ca 0.00 -0.84 -0.04 0.00 -0.77 0.00 0.00 57.85 56.20 3h3v n ARG 420 Cb 0.00 -0.82 -0.03 0.00 -1.02 0.00 0.00 32.46 30.59 3h3v n ARG 420 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h3v n ALA 421 N -0.20 -0.22 1.25 7.54 0.00 0.11 0.22 120.51 129.21 3h3v n ALA 421 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.73 3h3v n ALA 421 Cb 0.25 0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.73 3h3v n ALA 421 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3v n GLY 422 N -1.09 -0.48 0.00 0.00 0.00 -1.26 -4.53 105.19 97.82 3h3v n GLY 422 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3h3v n GLY 422 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3h3v n ASP 423 N -0.43 0.00 -1.37 1.61 -0.08 0.59 -4.98 116.55 111.90 3h3v n ASP 423 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3h3v n ASP 423 Cb 0.02 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.48 3h3v n ASP 423 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 3h3v n ILE 424 N 0.00 -7.60 -3.82 5.18 5.41 -1.25 -4.77 119.36 112.51 3h3v n ILE 424 Ca 0.00 1.63 -0.36 0.00 1.00 0.00 0.00 62.75 65.02 3h3v n ILE 424 Cb 0.00 -3.94 -0.11 0.00 -0.71 0.00 0.00 39.64 34.88 3h3v n ILE 424 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 3h3v s GLN 425 N -1.72 3.85 0.50 0.38 -1.52 -1.26 -5.01 119.66 114.88 3h3v s GLN 425 Ca 0.00 -0.39 -0.19 0.00 -1.95 0.00 0.00 55.36 52.83 3h3v s GLN 425 Cb 0.00 -3.35 -0.08 0.00 -0.22 0.00 0.00 33.01 29.36 3h3v s GLN 425 CO 0.00 0.00 1.03 -0.51 -0.25 0.00 0.00 175.29 175.56 3h3v s LEU 426 N 1.14 3.78 -0.21 2.90 1.43 -1.26 -5.04 118.68 121.42 3h3v s LEU 426 Ca 0.05 1.87 -0.03 0.00 -1.03 0.00 0.00 54.13 54.99 3h3v s LEU 426 Cb -0.14 -4.55 -0.00 0.00 0.03 0.00 0.00 46.19 41.52 3h3v s LEU 426 CO 0.04 -0.81 -0.07 -1.10 0.23 0.00 0.00 176.35 174.64 3h3v s GLN 427 N -3.43 3.32 -0.74 1.70 -1.52 -1.26 -5.04 119.66 112.69 3h3v s GLN 427 Ca 0.66 -0.65 -0.32 0.00 -1.95 0.00 0.00 55.36 53.10 3h3v s GLN 427 Cb -0.15 -2.94 -0.17 0.00 -0.22 0.00 0.00 33.01 29.53 3h3v s GLN 427 CO 0.23 -0.19 2.51 0.66 -0.25 0.00 0.00 175.29 178.25 3h3v n TYR 428 N 4.74 0.96 0.00 0.91 4.02 -1.26 0.18 117.16 126.70 3h3v n TYR 428 Ca -0.19 0.35 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 3h3v n TYR 428 Cb 0.51 -2.45 0.00 0.00 -0.02 0.00 0.00 39.34 37.38 3h3v n TYR 428 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h3v n GLY 429 N 6.49 0.99 3.84 2.72 0.00 -0.98 -5.02 105.19 113.24 3h3v n GLY 429 Ca 0.55 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.25 3h3v n GLY 429 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h3v s TRP 430 N -1.36 3.44 -0.14 1.61 0.52 0.47 -4.67 118.94 118.81 3h3v s TRP 430 Ca 0.00 1.46 -0.02 0.00 0.02 0.00 0.00 56.10 57.56 3h3v s TRP 430 Cb 0.00 -2.80 -0.02 0.00 -1.15 0.00 0.00 33.47 29.50 3h3v s TRP 430 CO 0.00 -0.41 -0.09 0.21 0.02 0.00 0.00 176.95 176.68 3h3v s LYS 431 N -4.12 3.52 -0.43 4.98 2.20 0.24 0.92 119.74 127.06 3h3v s LYS 431 Ca 0.59 -0.61 0.03 0.00 -0.36 0.00 0.00 55.97 55.63 3h3v s LYS 431 Cb -0.10 -2.77 0.12 0.00 -1.51 0.00 0.00 37.83 33.57 3h3v s LYS 431 CO 0.33 0.23 0.17 0.08 -0.36 0.00 0.00 175.35 175.79 3h3v s VAL 432 N 0.36 2.19 0.07 4.02 1.01 0.14 0.14 120.40 128.33 3h3v s VAL 432 Ca -0.08 -2.73 -0.30 0.00 0.00 0.00 0.00 61.98 58.87 3h3v s VAL 432 Cb -0.15 -2.57 -0.09 0.00 0.00 0.00 0.00 36.38 33.57 3h3v s VAL 432 CO 0.04 -0.73 1.91 -1.61 0.00 0.00 0.00 175.10 174.71 3h3v s GLU 433 N 0.37 4.14 0.44 2.72 2.02 0.13 -3.27 118.70 125.25 3h3v s GLU 433 Ca 0.14 2.60 0.05 0.00 0.02 0.00 0.00 54.97 57.78 3h3v s GLU 433 Cb -0.23 -3.93 -0.05 0.00 0.10 0.00 0.00 34.13 30.02 3h3v s GLU 433 CO -0.05 -0.91 0.01 -0.98 0.02 0.00 0.00 175.26 173.36 3h3v s ARG 434 N 3.76 2.03 0.60 1.61 1.04 -0.29 -2.71 118.95 125.00 3h3v s ARG 434 Ca 0.85 -2.21 -0.17 0.00 -1.04 0.00 0.00 55.73 53.16 3h3v s ARG 434 Cb -0.44 -1.54 -0.03 0.00 -2.04 0.00 0.00 34.95 30.91 3h3v s ARG 434 CO 0.39 -0.18 1.11 -1.01 -0.04 0.00 0.00 175.30 175.57 3h3v s HIS 435 N -2.81 2.66 0.28 5.89 3.76 -0.59 -0.17 115.29 124.31 3h3v s HIS 435 Ca 0.24 1.55 -0.30 0.00 -0.15 0.00 0.00 55.06 56.40 3h3v s HIS 435 Cb 0.07 -3.21 -0.10 0.00 1.11 0.00 0.00 32.58 30.44 3h3v s HIS 435 CO 0.12 -1.60 1.44 0.42 -0.85 0.00 0.00 174.74 174.28 3h3v s ILE 436 N -2.10 2.54 0.42 0.60 -1.09 -1.15 -4.68 121.20 115.74 3h3v s ILE 436 Ca 0.69 0.48 0.07 0.00 -2.23 0.00 0.00 60.65 59.66 3h3v s ILE 436 Cb -0.22 -3.30 -0.06 0.00 -1.58 0.00 0.00 42.46 37.30 3h3v s ILE 436 CO 0.35 0.08 0.09 -0.04 -1.23 0.00 0.00 174.94 174.19 3h3v s MET 437 N -0.74 2.09 0.29 2.79 -1.94 -1.26 -4.88 119.30 115.66 3h3v s MET 437 Ca 0.58 -2.01 -0.30 0.00 -1.71 0.00 0.00 55.69 52.25 3h3v s MET 437 Cb -0.43 -1.79 -0.13 0.00 2.01 0.00 0.00 34.83 34.50 3h3v s MET 437 CO 0.47 -0.11 1.39 -0.25 -0.01 0.00 0.00 175.02 176.52 3h3v n ASP 438 N -1.12 2.97 -1.77 3.03 8.00 -1.26 -3.29 116.55 123.11 3h3v n ASP 438 Ca -0.04 1.17 -0.06 0.00 0.71 0.00 0.00 54.79 56.57 3h3v n ASP 438 Cb 0.66 -1.48 0.03 0.00 -0.02 0.00 0.00 41.12 40.31 3h3v n ASP 438 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3h3v n ASN 439 N 1.55 -2.36 -4.31 -2.24 4.13 0.31 -4.92 115.26 107.43 3h3v n ASN 439 Ca 0.08 -0.21 -0.33 0.00 1.68 0.00 0.00 54.58 55.80 3h3v n ASN 439 Cb 0.34 -2.08 -0.15 0.00 -1.54 0.00 0.00 39.78 36.36 3h3v n ASN 439 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3h3v s ASP 440 N -3.38 3.90 0.47 6.41 1.01 -1.21 -4.81 116.67 119.06 3h3v s ASP 440 Ca 0.05 -0.41 -0.24 0.00 0.71 0.00 0.00 52.55 52.66 3h3v s ASP 440 Cb -0.02 -1.61 -0.07 0.00 1.01 0.00 0.00 42.92 42.22 3h3v s ASP 440 CO 0.25 0.09 1.39 -2.16 0.21 0.00 0.00 175.17 174.95 3h3v s PRO 441 N 0.79 3.57 0.00 8.23 0.04 -1.26 -3.03 135.00 143.34 3h3v s PRO 441 Ca -0.05 2.33 -0.03 0.00 0.04 0.00 0.00 61.00 63.29 3h3v s PRO 441 Cb -0.15 -2.55 -0.01 0.00 0.04 0.00 0.00 34.50 31.83 3h3v s PRO 441 CO 0.01 -0.88 0.06 0.08 0.04 0.00 0.00 177.00 176.31 3h3v s VAL 442 N -1.24 0.07 -0.36 -0.36 1.01 -1.00 -4.37 120.40 114.15 3h3v s VAL 442 Ca 0.64 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.81 3h3v s VAL 442 Cb -0.42 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 35.67 3h3v s VAL 442 CO 0.53 -0.34 0.52 -0.22 0.00 0.00 0.00 175.10 175.59 3h3v s LEU 443 N -1.09 4.40 -0.15 3.92 0.20 -0.64 -1.44 118.68 123.89 3h3v s LEU 443 Ca -0.12 -0.11 0.02 0.00 0.69 0.00 0.00 54.13 54.61 3h3v s LEU 443 Cb -0.07 -2.59 0.01 0.00 -0.43 0.00 0.00 46.19 43.11 3h3v s LEU 443 CO 0.00 -0.52 -0.20 0.12 -0.29 0.00 0.00 176.35 175.46 3h3v s PHE 444 N 2.42 2.70 0.18 5.38 5.36 0.22 0.45 117.98 134.69 3h3v s PHE 444 Ca 0.19 -1.29 -0.10 0.00 -0.96 0.00 0.00 56.93 54.77 3h3v s PHE 444 Cb -0.15 -1.84 -0.00 0.00 -0.34 0.00 0.00 43.02 40.68 3h3v s PHE 444 CO 0.14 -0.59 0.33 0.54 -1.46 0.00 0.00 175.22 174.18 3h3v s ASN 445 N 0.84 -0.01 -0.17 6.13 4.22 -0.00 -2.44 114.94 123.51 3h3v s ASN 445 Ca -0.06 -0.84 -0.01 0.00 -2.14 0.00 0.00 52.86 49.81 3h3v s ASN 445 Cb -0.15 0.47 0.05 0.00 1.28 0.00 0.00 41.25 42.89 3h3v s ASN 445 CO -0.02 -0.94 -0.02 -0.60 -2.04 0.00 0.00 177.10 173.48 3h3v s ARG 446 N -3.97 1.17 0.77 3.55 3.52 -1.14 -0.36 118.95 122.49 3h3v s ARG 446 Ca 0.17 -0.49 -0.11 0.00 -0.13 0.00 0.00 55.73 55.17 3h3v s ARG 446 Cb 0.02 -2.02 0.06 0.00 -1.56 0.00 0.00 34.95 31.46 3h3v s ARG 446 CO 0.01 -0.50 1.10 -0.65 -0.81 0.00 0.00 175.30 174.45 3h3v s GLN 447 N 1.70 2.22 0.04 5.12 -0.21 -1.26 -4.29 119.66 122.97 3h3v s GLN 447 Ca -0.00 1.23 -0.30 0.00 0.02 0.00 0.00 55.36 56.30 3h3v s GLN 447 Cb -0.16 -1.89 -0.06 0.00 1.00 0.00 0.00 33.01 31.90 3h3v s GLN 447 CO -0.07 -1.68 1.31 -1.25 -2.12 0.00 0.00 175.29 171.47 3h3v s PRO 448 N -4.79 4.35 -1.03 2.91 0.04 -1.26 -5.07 135.00 130.14 3h3v s PRO 448 Ca 0.62 1.89 -0.23 0.00 0.04 0.00 0.00 61.00 63.32 3h3v s PRO 448 Cb -0.18 -3.43 0.05 0.00 0.04 0.00 0.00 34.50 30.98 3h3v s PRO 448 CO 0.55 -0.43 1.46 -1.12 0.04 0.00 0.00 177.00 177.50 3h3v s SER 449 N 1.40 6.52 -0.10 6.66 0.01 -1.26 -4.74 113.70 122.19 3h3v s SER 449 Ca 0.61 -1.51 0.13 0.00 1.31 0.00 0.00 55.95 56.50 3h3v s SER 449 Cb -0.31 -2.57 0.24 0.00 0.21 0.00 0.00 66.02 63.59 3h3v s SER 449 CO 0.27 -1.49 1.15 0.00 0.41 0.00 0.00 173.24 173.59 3h3v n LEU 450 N 8.84 2.46 -4.33 2.44 -0.00 -1.26 -5.01 117.00 120.14 3h3v n LEU 450 Ca 0.34 -2.75 -0.17 0.00 -0.00 0.00 0.00 56.01 53.43 3h3v n LEU 450 Cb 0.51 -0.32 -0.10 0.00 -0.00 0.00 0.00 43.42 43.50 3h3v n LEU 450 CO 0.66 0.65 -0.34 -2.28 -0.00 0.00 0.00 177.39 176.08 3h3v s HIS 451 N -2.30 1.55 0.17 1.47 2.46 -1.26 -4.66 115.29 112.72 3h3v s HIS 451 Ca 0.24 -0.88 0.09 0.00 0.47 0.00 0.00 55.06 54.99 3h3v s HIS 451 Cb 0.21 -0.88 0.04 0.00 -0.13 0.00 0.00 32.58 31.82 3h3v s HIS 451 CO 0.03 0.01 1.43 -0.22 -2.47 0.00 0.00 174.74 173.52 3h3v h LYS 452 N 2.50 0.00 0.00 2.88 3.64 -1.95 -3.04 116.57 120.61 3h3v h LYS 452 Ca -0.38 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 3h3v h LYS 452 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 3h3v h LYS 452 CO 0.64 0.82 0.00 -1.33 -2.27 0.00 0.00 179.45 177.32 3h3v n MET 453 N -3.53 0.90 0.22 1.90 2.81 -1.26 -3.66 117.12 114.51 3h3v n MET 453 Ca -0.00 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.95 3h3v n MET 453 Cb 0.80 -1.50 0.52 0.00 -0.71 0.00 0.00 33.22 32.33 3h3v n MET 453 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 3h3v h SER 454 N 0.00 0.00 -4.41 7.83 0.02 -1.72 -3.42 113.55 111.85 3h3v h SER 454 Ca 0.00 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.34 3h3v h SER 454 Cb 0.01 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 62.26 3h3v h SER 454 CO 0.00 0.21 -0.86 -0.04 -1.14 0.00 0.00 176.83 175.00 3h3v s MET 455 N -4.45 1.72 0.23 3.45 -1.94 -1.24 -2.89 119.30 114.17 3h3v s MET 455 Ca -0.03 -0.75 -0.10 0.00 -1.71 0.00 0.00 55.69 53.10 3h3v s MET 455 Cb 0.15 -1.65 -0.01 0.00 2.01 0.00 0.00 34.83 35.33 3h3v s MET 455 CO 0.68 0.44 0.38 -1.64 -0.01 0.00 0.00 175.02 174.87 3h3v s MET 456 N -0.46 1.44 -0.20 2.03 1.00 -1.02 -4.98 119.30 117.10 3h3v s MET 456 Ca 0.07 -1.34 -0.07 0.00 0.00 0.00 0.00 55.69 54.35 3h3v s MET 456 Cb -0.08 0.42 -0.04 0.00 0.00 0.00 0.00 34.83 35.12 3h3v s MET 456 CO -0.01 -0.57 0.07 0.00 0.00 0.00 0.00 175.02 174.51 3h3v s ALA 457 N -4.05 3.35 0.21 3.03 0.00 0.12 -0.61 121.76 123.82 3h3v s ALA 457 Ca 0.26 -0.84 0.11 0.00 0.00 0.00 0.00 51.96 51.50 3h3v s ALA 457 Cb 0.01 -1.96 -0.05 0.00 0.00 0.00 0.00 23.12 21.13 3h3v s ALA 457 CO 0.09 0.02 -0.21 -1.01 0.00 0.00 0.00 175.76 174.65 3h3v s HIS 458 N 0.66 2.17 0.03 0.00 3.76 -0.52 -1.37 115.29 120.02 3h3v s HIS 458 Ca 0.03 -0.38 -0.29 0.00 -0.15 0.00 0.00 55.06 54.27 3h3v s HIS 458 Cb -0.13 -1.03 -0.04 0.00 1.11 0.00 0.00 32.58 32.49 3h3v s HIS 458 CO 0.02 0.52 0.95 1.03 -0.85 0.00 0.00 174.74 176.41 3h3v s ARG 459 N -2.99 4.59 0.12 1.40 0.52 0.16 -2.38 118.95 120.38 3h3v s ARG 459 Ca 0.22 1.38 -0.28 0.00 -0.52 0.00 0.00 55.73 56.53 3h3v s ARG 459 Cb -0.06 -3.43 -0.06 0.00 0.52 0.00 0.00 34.95 31.91 3h3v s ARG 459 CO 0.10 0.05 0.89 0.54 0.02 0.00 0.00 175.30 176.90 3h3v s VAL 460 N 0.66 4.48 -0.19 3.52 0.11 -1.17 -1.65 120.40 126.16 3h3v s VAL 460 Ca 0.49 1.92 -0.02 0.00 -2.93 0.00 0.00 61.98 61.44 3h3v s VAL 460 Cb -0.21 -4.25 0.06 0.00 -1.53 0.00 0.00 36.38 30.44 3h3v s VAL 460 CO 0.28 0.38 0.01 -0.75 -3.33 0.00 0.00 175.10 171.68 3h3v s LYS 461 N -0.31 0.91 0.16 1.54 2.36 -0.78 0.11 119.74 123.73 3h3v s LYS 461 Ca 0.43 -0.51 -0.31 0.00 -2.55 0.00 0.00 55.97 53.02 3h3v s LYS 461 Cb -0.23 -2.14 -0.09 0.00 -1.05 0.00 0.00 37.83 34.32 3h3v s LYS 461 CO 0.28 -0.60 1.43 0.14 1.55 0.00 0.00 175.35 178.15 3h3v s VAL 462 N 1.75 3.01 0.00 4.02 -7.23 -1.26 -0.03 120.40 120.67 3h3v s VAL 462 Ca -0.01 0.76 -0.07 0.00 -1.81 0.00 0.00 61.98 60.84 3h3v s VAL 462 Cb -0.17 -3.48 0.00 0.00 0.56 0.00 0.00 36.38 33.29 3h3v s VAL 462 CO -0.07 0.08 0.14 0.27 -0.31 0.00 0.00 175.10 175.20 3h3v s ILE 463 N 0.79 0.08 1.10 -0.62 -4.36 0.33 -4.84 121.20 113.69 3h3v s ILE 463 Ca 0.64 -0.68 -0.13 0.00 -0.26 0.00 0.00 60.65 60.21 3h3v s ILE 463 Cb -0.39 -0.43 0.24 0.00 1.25 0.00 0.00 42.46 43.12 3h3v s ILE 463 CO 0.34 -0.37 1.06 -2.16 0.24 0.00 0.00 174.94 174.05 3h3v s PRO 464 N -1.37 -0.37 0.36 0.37 0.04 -1.26 -1.63 135.00 131.14 3h3v s PRO 464 Ca -0.15 0.55 0.00 0.00 0.04 0.00 0.00 61.00 61.44 3h3v s PRO 464 Cb -0.08 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.82 3h3v s PRO 464 CO 0.02 -3.28 0.00 0.66 0.04 0.00 0.00 177.00 174.44 3h3v n TYR 465 N -4.56 -3.17 -2.45 0.56 4.02 -1.26 -4.76 117.16 105.54 3h3v n TYR 465 Ca 0.05 1.68 -0.43 0.00 -0.01 0.00 0.00 57.90 59.19 3h3v n TYR 465 Cb 0.57 -2.84 0.00 0.00 -0.02 0.00 0.00 39.34 37.05 3h3v n TYR 465 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3h3v n SER 466 N -0.73 4.78 -3.56 7.72 3.41 -1.26 -4.35 113.62 119.64 3h3v n SER 466 Ca 0.00 -2.92 -0.15 0.00 -0.26 0.00 0.00 58.87 55.54 3h3v n SER 466 Cb 0.00 -1.70 -0.06 0.00 -0.26 0.00 0.00 64.21 62.19 3h3v n SER 466 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3h3v s THR 467 N 3.48 0.00 -0.21 6.66 -4.23 -1.26 -4.55 115.64 115.53 3h3v s THR 467 Ca 0.50 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.73 3h3v s THR 467 Cb 0.05 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.90 3h3v s THR 467 CO 0.03 0.00 0.99 -0.36 -0.54 0.00 0.00 174.62 174.74 3h3v s PHE 468 N -0.85 3.37 -0.40 3.99 2.99 -0.79 -4.07 117.98 122.21 3h3v s PHE 468 Ca -0.06 1.42 -0.05 0.00 0.00 0.00 0.00 56.93 58.24 3h3v s PHE 468 Cb -0.01 -3.21 0.09 0.00 0.00 0.00 0.00 43.02 39.89 3h3v s PHE 468 CO 0.06 -0.41 0.20 1.03 -0.00 0.00 0.00 175.22 176.09 3h3v s ARG 469 N 2.90 2.29 0.29 0.44 0.52 -0.72 -1.89 118.95 122.78 3h3v s ARG 469 Ca 0.43 -1.62 0.06 0.00 -0.52 0.00 0.00 55.73 54.08 3h3v s ARG 469 Cb -0.16 -3.61 -0.02 0.00 0.52 0.00 0.00 34.95 31.69 3h3v s ARG 469 CO 0.08 -0.98 0.38 -0.48 0.02 0.00 0.00 175.30 174.32 3h3v s LEU 470 N 1.26 4.02 0.61 2.53 2.34 -1.20 0.73 118.68 128.96 3h3v s LEU 470 Ca 0.04 -0.15 -0.14 0.00 0.06 0.00 0.00 54.13 53.94 3h3v s LEU 470 Cb -0.23 -2.67 -0.03 0.00 -0.56 0.00 0.00 46.19 42.71 3h3v s LEU 470 CO -0.02 -0.26 1.05 0.21 -1.06 0.00 0.00 176.35 176.27 3h3v s ASN 471 N -4.05 5.84 0.00 1.48 3.84 -1.26 -2.50 114.94 118.29 3h3v s ASN 471 Ca 0.39 1.71 -0.25 0.00 0.21 0.00 0.00 52.86 54.92 3h3v s ASN 471 Cb -0.09 -2.52 -0.17 0.00 -0.55 0.00 0.00 41.25 37.93 3h3v s ASN 471 CO 0.29 -1.13 1.21 -0.07 -2.79 0.00 0.00 177.10 174.61 3h3v h LEU 472 N 0.18 -0.30 -1.89 3.21 3.38 -1.89 -3.22 115.31 114.78 3h3v h LEU 472 Ca -0.46 -0.21 0.12 0.00 0.09 0.00 0.00 57.88 57.42 3h3v h LEU 472 Cb 1.21 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 3h3v h LEU 472 CO 0.58 0.08 0.49 0.28 0.09 0.00 0.00 178.44 179.97 3h3v h SER 473 N -0.74 0.00 -0.37 -0.43 0.02 -1.95 0.60 113.55 110.69 3h3v h SER 473 Ca -0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 3h3v h SER 473 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 3h3v h SER 473 CO 0.06 0.00 0.00 0.55 -1.14 0.00 0.00 176.83 176.30 3h3v n VAL 474 N -3.57 0.96 0.05 2.27 3.14 -1.22 -4.01 118.33 115.96 3h3v n VAL 474 Ca 0.07 -0.64 -0.22 0.00 -2.96 0.00 0.00 64.34 60.59 3h3v n VAL 474 Cb 0.66 -0.01 -0.14 0.00 -1.06 0.00 0.00 33.84 33.28 3h3v n VAL 474 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3h3v h THR 475 N 2.29 0.86 0.00 1.55 1.03 0.11 -3.37 112.91 115.38 3h3v h THR 475 Ca 0.00 -2.45 0.00 0.00 -0.01 0.00 0.00 66.41 63.95 3h3v h THR 475 Cb 0.88 2.68 0.00 0.00 -1.07 0.00 0.00 68.15 70.64 3h3v h THR 475 CO 0.12 0.85 0.00 0.77 -0.01 0.00 0.00 175.52 177.25 3h3v h SER 476 N 0.04 0.00 1.48 0.00 4.64 -1.74 -2.31 113.55 115.66 3h3v h SER 476 Ca -0.36 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.91 3h3v h SER 476 Cb 2.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.12 3h3v h SER 476 CO 0.14 0.00 -0.53 -0.65 -0.87 0.00 0.00 176.83 174.91 3h3v h PRO 477 N 0.00 0.00 0.00 4.77 0.11 -1.76 -3.14 132.00 131.98 3h3v h PRO 477 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3h3v h PRO 477 Cb 0.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.41 3h3v h PRO 477 CO 0.00 0.15 -0.70 0.66 -0.21 0.00 0.00 178.00 177.90 3h3v n TYR 478 N -3.00 0.49 -1.51 0.65 4.02 -0.95 -4.34 117.16 112.52 3h3v n TYR 478 Ca 0.01 0.14 -0.10 0.00 -0.01 0.00 0.00 57.90 57.94 3h3v n TYR 478 Cb 0.62 -0.61 -0.03 0.00 -0.02 0.00 0.00 39.34 39.30 3h3v n TYR 478 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3h3v n ASN 479 N -2.07 -4.05 -4.96 7.72 2.85 -0.91 -4.79 115.26 109.05 3h3v n ASN 479 Ca 0.03 0.19 -0.20 0.00 -0.11 0.00 0.00 54.58 54.49 3h3v n ASN 479 Cb 0.44 -2.66 0.04 0.00 1.24 0.00 0.00 39.78 38.83 3h3v n ASN 479 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3h3v s ALA 480 N -2.42 4.09 0.12 5.20 0.00 -1.00 -5.02 121.76 122.73 3h3v s ALA 480 Ca 0.00 -1.51 -0.08 0.00 0.00 0.00 0.00 51.96 50.38 3h3v s ALA 480 Cb 0.00 -1.92 0.03 0.00 0.00 0.00 0.00 23.12 21.23 3h3v s ALA 480 CO 0.00 -0.71 0.38 -0.40 0.00 0.00 0.00 175.76 175.03 3h3v n ASP 481 N -2.26 -0.83 -0.92 0.00 5.68 -1.26 -4.63 116.55 112.32 3h3v n ASP 481 Ca 0.09 -1.51 0.03 0.00 -0.50 0.00 0.00 54.79 52.90 3h3v n ASP 481 Cb 0.60 1.37 0.22 0.00 -1.14 0.00 0.00 41.12 42.17 3h3v n ASP 481 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3h3v n PHE 482 N -0.26 0.90 0.25 2.11 0.99 -1.26 -4.29 117.46 115.89 3h3v n PHE 482 Ca -0.02 -1.21 0.00 0.00 -0.00 0.00 0.00 57.45 56.21 3h3v n PHE 482 Cb 0.24 -0.37 0.00 0.00 -1.00 0.00 0.00 39.48 38.35 3h3v n PHE 482 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.76 176.36 3h3v n ASP 483 N -0.89 2.96 0.00 4.37 3.85 -1.26 -4.45 116.55 121.14 3h3v n ASP 483 Ca 0.26 -1.72 0.00 0.00 -0.71 0.00 0.00 54.79 52.62 3h3v n ASP 483 Cb 0.93 -0.57 0.00 0.00 -1.35 0.00 0.00 41.12 40.13 3h3v n ASP 483 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3h3v n GLY 484 N 1.08 1.61 3.84 6.12 0.00 -1.26 -5.09 105.19 111.49 3h3v n GLY 484 Ca 0.00 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 3h3v n GLY 484 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h3v s ASP 485 N -2.17 6.84 0.45 1.61 1.01 -1.26 -5.00 116.67 118.14 3h3v s ASP 485 Ca 0.00 1.19 0.06 0.00 0.71 0.00 0.00 52.55 54.52 3h3v s ASP 485 Cb 0.00 -2.33 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 3h3v s ASP 485 CO 0.00 -0.03 0.22 -1.61 0.21 0.00 0.00 175.17 173.97 3h3v s GLU 486 N -2.38 2.26 0.14 8.23 2.02 -1.26 -1.86 118.70 125.84 3h3v s GLU 486 Ca 0.45 -1.90 -0.13 0.00 0.02 0.00 0.00 54.97 53.41 3h3v s GLU 486 Cb -0.14 -2.00 0.01 0.00 0.10 0.00 0.00 34.13 32.11 3h3v s GLU 486 CO 0.20 -0.24 0.34 -1.64 0.02 0.00 0.00 175.26 173.94 3h3v s MET 487 N -3.99 1.10 0.00 1.61 -1.94 -1.18 -4.83 119.30 110.07 3h3v s MET 487 Ca 0.37 -0.92 0.00 0.00 -1.71 0.00 0.00 55.69 53.44 3h3v s MET 487 Cb 0.02 0.43 -0.04 0.00 2.01 0.00 0.00 34.83 37.25 3h3v s MET 487 CO 0.21 -0.41 0.07 -0.80 -0.01 0.00 0.00 175.02 174.08 3h3v s ASN 488 N -2.87 5.60 -0.08 3.03 -0.87 0.51 -3.38 114.94 116.88 3h3v s ASN 488 Ca 0.08 0.12 0.01 0.00 -1.57 0.00 0.00 52.86 51.50 3h3v s ASN 488 Cb 0.02 -1.58 0.02 0.00 -0.02 0.00 0.00 41.25 39.69 3h3v s ASN 488 CO -0.07 0.26 -0.10 -0.22 -2.57 0.00 0.00 177.10 174.40 3h3v s LEU 489 N -1.77 1.48 -0.15 0.60 2.96 0.10 -0.82 118.68 121.08 3h3v s LEU 489 Ca 0.23 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 3h3v s LEU 489 Cb -0.12 -0.80 -0.00 0.00 0.50 0.00 0.00 46.19 45.76 3h3v s LEU 489 CO 0.14 -0.02 -0.16 -1.00 -1.32 0.00 0.00 176.35 173.99 3h3v s HIS 490 N 1.01 2.76 -0.32 5.38 3.76 0.17 -0.65 115.29 127.42 3h3v s HIS 490 Ca -0.08 -1.02 -0.16 0.00 -0.15 0.00 0.00 55.06 53.64 3h3v s HIS 490 Cb -0.15 -1.87 -0.02 0.00 1.11 0.00 0.00 32.58 31.66 3h3v s HIS 490 CO -0.00 -0.45 0.43 0.08 -0.85 0.00 0.00 174.74 173.94 3h3v s VAL 491 N 0.74 5.11 1.08 -0.90 1.01 -0.72 -1.62 120.40 125.10 3h3v s VAL 491 Ca -0.07 0.37 -0.17 0.00 0.00 0.00 0.00 61.98 62.11 3h3v s VAL 491 Cb -0.16 -3.84 0.13 0.00 0.00 0.00 0.00 36.38 32.52 3h3v s VAL 491 CO 0.01 -0.05 0.09 -0.81 0.00 0.00 0.00 175.10 174.34 3h3v n PRO 492 N 5.51 -1.97 0.00 2.72 -0.04 -1.26 -4.92 135.00 135.03 3h3v n PRO 492 Ca -0.07 -0.57 0.00 0.00 -0.04 0.00 0.00 63.50 62.82 3h3v n PRO 492 Cb 0.50 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 3h3v n PRO 492 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 3h3v n GLN 493 N -1.87 0.27 -4.26 0.54 -0.06 -1.26 -4.92 117.38 105.82 3h3v n GLN 493 Ca 0.03 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.72 3h3v n GLN 493 Cb 0.51 -0.56 -0.09 0.00 -4.06 0.00 0.00 30.24 26.04 3h3v n GLN 493 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 3h3v s SER 494 N -2.15 4.94 0.19 1.69 0.15 -1.26 -4.59 113.70 112.68 3h3v s SER 494 Ca 0.00 -0.12 -0.25 0.00 0.70 0.00 0.00 55.95 56.28 3h3v s SER 494 Cb 0.00 -1.20 0.07 0.00 -1.71 0.00 0.00 66.02 63.17 3h3v s SER 494 CO 0.00 0.24 1.55 -0.08 1.20 0.00 0.00 173.24 176.14 3h3v h GLU 495 N 4.01 -0.03 -0.06 5.44 4.57 -1.98 1.00 114.58 127.52 3h3v h GLU 495 Ca -0.48 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 57.72 3h3v h GLU 495 Cb 1.17 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.76 3h3v h GLU 495 CO 0.57 -0.02 0.06 1.05 -1.18 0.00 0.00 179.01 179.49 3h3v h GLU 496 N -0.03 0.00 0.00 1.92 4.11 -2.00 -3.06 114.58 115.53 3h3v h GLU 496 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.67 3h3v h GLU 496 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 3h3v h GLU 496 CO -0.93 0.00 0.00 2.41 0.07 0.00 0.00 179.01 180.56 3h3v n THR 497 N -4.06 0.00 -0.29 -1.06 -1.04 0.34 -2.70 114.28 105.48 3h3v n THR 497 Ca -0.02 1.15 0.05 0.00 -2.04 0.00 0.00 64.05 63.20 3h3v n THR 497 Cb 0.15 -2.15 0.12 0.00 -1.82 0.00 0.00 70.33 66.63 3h3v n THR 497 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 3h3v n ARG 498 N -0.96 -0.07 -0.33 -2.82 1.85 -1.10 0.26 116.66 113.49 3h3v n ARG 498 Ca 0.00 1.27 0.28 0.00 -1.00 0.00 0.00 57.85 58.41 3h3v n ARG 498 Cb 0.00 -1.91 0.54 0.00 -1.05 0.00 0.00 32.46 30.04 3h3v n ARG 498 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3h3v h ALA 499 N 1.64 2.08 -0.35 2.89 0.00 -1.49 1.29 119.26 125.31 3h3v h ALA 499 Ca 0.39 0.23 -0.13 0.00 0.00 0.00 0.00 54.91 55.40 3h3v h ALA 499 Cb 0.60 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3h3v h ALA 499 CO -0.84 -0.78 -0.32 0.93 0.00 0.00 0.00 179.25 178.23 3h3v h GLU 500 N 0.15 0.76 0.33 0.00 5.08 0.38 -0.81 114.58 120.47 3h3v h GLU 500 Ca 0.80 -0.36 -0.02 0.00 -1.00 0.00 0.00 59.36 58.78 3h3v h GLU 500 Cb 1.99 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.23 3h3v h GLU 500 CO -0.69 0.98 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.07 3h3v h LEU 501 N 0.64 -0.37 -2.31 1.33 3.38 0.16 -2.52 115.31 115.63 3h3v h LEU 501 Ca 0.07 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 3h3v h LEU 501 Cb 0.86 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 3h3v h LEU 501 CO 0.07 0.08 -0.02 0.77 0.09 0.00 0.00 178.44 179.43 3h3v h SER 502 N -0.96 0.00 0.00 -0.43 4.64 -0.38 1.32 113.55 117.74 3h3v h SER 502 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3h3v h SER 502 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3h3v h SER 502 CO 0.07 0.02 -1.18 0.00 -0.87 0.00 0.00 176.83 174.87 3h3v n GLN 503 N -3.94 0.20 0.00 4.77 3.00 -0.31 -4.22 117.38 116.89 3h3v n GLN 503 Ca -0.03 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 3h3v n GLN 503 Cb 0.11 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.86 3h3v n GLN 503 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3h3v n LEU 504 N -1.64 0.00 -0.00 1.08 4.32 -0.95 -4.87 117.00 114.94 3h3v n LEU 504 Ca 0.02 0.00 0.07 0.00 -0.02 0.00 0.00 56.01 56.09 3h3v n LEU 504 Cb 0.37 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 42.08 3h3v n LEU 504 CO 0.43 0.00 -0.14 0.00 -1.22 0.00 0.00 177.39 176.46 3h3v n ALA 506 N -1.47 0.76 -0.32 0.00 0.00 0.26 0.15 120.51 119.89 3h3v n ALA 506 Ca 0.02 0.40 0.14 0.00 0.00 0.00 0.00 53.44 54.00 3h3v n ALA 506 Cb 0.27 -2.35 0.29 0.00 0.00 0.00 0.00 19.45 17.66 3h3v n ALA 506 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h3v h VAL 507 N 4.24 0.13 0.00 0.00 2.07 -1.57 0.49 116.25 121.61 3h3v h VAL 507 Ca -0.46 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.03 3h3v h VAL 507 Cb 1.28 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 3h3v h VAL 507 CO 0.90 0.01 0.32 -0.65 0.02 0.00 0.00 177.57 178.17 3h3v h PRO 508 N 0.07 0.00 0.00 1.57 0.11 -1.89 -1.80 132.00 130.06 3h3v h PRO 508 Ca 0.57 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.61 3h3v h PRO 508 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3h3v h PRO 508 CO -0.82 0.00 -0.63 -0.07 -0.21 0.00 0.00 178.00 176.27 3h3v h LEU 509 N 0.00 0.00 0.00 2.35 3.38 -0.34 -3.36 115.31 117.34 3h3v h LEU 509 Ca 0.00 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3h3v h LEU 509 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3h3v h LEU 509 CO 0.00 0.99 0.01 0.00 0.09 0.00 0.00 178.44 179.53 3h3v n GLN 510 N -4.58 0.00 -0.23 1.13 1.13 -0.68 -3.58 117.38 110.56 3h3v n GLN 510 Ca -0.15 0.02 0.22 0.00 -1.94 0.00 0.00 57.00 55.16 3h3v n GLN 510 Cb 0.39 -1.51 0.57 0.00 0.11 0.00 0.00 30.24 29.80 3h3v n GLN 510 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 3h3v h ILE 511 N 0.00 0.62 -3.35 5.09 2.04 -1.69 -3.38 117.51 116.84 3h3v h ILE 511 Ca 0.00 -0.10 -0.65 0.00 1.00 0.00 0.00 64.86 65.11 3h3v h ILE 511 Cb 0.02 0.31 -0.26 0.00 -0.74 0.00 0.00 36.82 36.14 3h3v h ILE 511 CO 0.00 0.05 -0.73 -0.69 0.00 0.00 0.00 178.15 176.79 3h3v s VAL 512 N -5.31 3.35 -0.34 1.67 1.01 -1.23 -1.78 120.40 117.76 3h3v s VAL 512 Ca -0.07 -0.53 -0.26 0.00 0.00 0.00 0.00 61.98 61.12 3h3v s VAL 512 Cb 0.23 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 34.14 3h3v s VAL 512 CO 0.78 0.47 0.93 -0.55 0.00 0.00 0.00 175.10 176.73 3h3v s SER 513 N 0.93 6.74 0.00 3.32 0.15 0.23 -4.85 113.70 120.21 3h3v s SER 513 Ca -0.01 0.72 0.00 0.00 0.70 0.00 0.00 55.95 57.36 3h3v s SER 513 Cb -0.15 -2.47 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 3h3v s SER 513 CO 0.00 -0.81 1.07 -0.81 1.20 0.00 0.00 173.24 173.90 3h3v n PRO 514 N 6.67 0.73 0.00 5.44 -0.04 -1.26 -0.36 135.00 146.18 3h3v n PRO 514 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 3h3v n PRO 514 Cb 0.48 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 3h3v n PRO 514 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3v n GLN 515 N 1.10 0.01 -0.09 0.54 10.64 -1.26 -4.75 117.38 123.57 3h3v n GLN 515 Ca 0.00 -0.06 0.00 0.00 -1.83 0.00 0.00 57.00 55.11 3h3v n GLN 515 Cb 0.37 -0.51 0.00 0.00 -0.86 0.00 0.00 30.24 29.24 3h3v n GLN 515 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 3h3v n SER 516 N -0.02 0.00 -3.74 2.61 3.41 -0.53 -3.53 113.62 111.83 3h3v n SER 516 Ca 0.00 -1.05 -0.23 0.00 -0.26 0.00 0.00 58.87 57.34 3h3v n SER 516 Cb 0.18 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.09 3h3v n SER 516 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3h3v n ASN 517 N 0.00 -0.41 -3.53 4.04 0.23 0.51 -4.87 115.26 111.23 3h3v n ASN 517 Ca 0.00 -0.80 -0.15 0.00 -0.53 0.00 0.00 54.58 53.10 3h3v n ASN 517 Cb 0.51 -0.98 -0.05 0.00 -2.08 0.00 0.00 39.78 37.17 3h3v n ASN 517 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 3h3v s LYS 518 N -6.00 0.92 0.57 -3.83 -2.85 -1.21 -4.73 119.74 102.62 3h3v s LYS 518 Ca 0.10 0.16 -0.19 0.00 -1.00 0.00 0.00 55.97 55.04 3h3v s LYS 518 Cb -0.06 0.43 -0.06 0.00 -2.06 0.00 0.00 37.83 36.09 3h3v s LYS 518 CO 0.62 -0.30 0.95 -0.35 0.10 0.00 0.00 175.35 176.37 3h3v n PRO 519 N 0.74 0.96 -0.06 1.78 -0.04 -1.26 -0.60 135.00 136.52 3h3v n PRO 519 Ca -0.16 0.37 0.04 0.00 -0.04 0.00 0.00 63.50 63.71 3h3v n PRO 519 Cb 0.58 -2.13 0.07 0.00 -0.04 0.00 0.00 33.50 31.98 3h3v n PRO 519 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3v s MET 521 N -0.82 1.16 -0.01 0.00 -1.94 -1.26 -4.36 119.30 112.07 3h3v s MET 521 Ca 0.12 -1.51 -0.10 0.00 -1.71 0.00 0.00 55.69 52.50 3h3v s MET 521 Cb 0.07 -0.77 0.03 0.00 2.01 0.00 0.00 34.83 36.17 3h3v s MET 521 CO 0.10 0.10 0.43 0.41 -0.01 0.00 0.00 175.02 176.05 3h3v n GLY 522 N -0.27 0.47 3.80 -0.03 0.00 -1.26 -4.05 105.19 103.85 3h3v n GLY 522 Ca -0.09 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.64 3h3v n GLY 522 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3v s ILE 523 N -2.10 4.59 0.33 -0.61 1.01 -1.17 -4.49 121.20 118.75 3h3v s ILE 523 Ca 0.10 1.39 0.05 0.00 0.00 0.00 0.00 60.65 62.19 3h3v s ILE 523 Cb -0.00 -3.98 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 3h3v s ILE 523 CO -0.00 0.49 0.34 0.52 0.00 0.00 0.00 174.94 176.29 3h3v n VAL 524 N 1.53 0.00 -0.41 2.92 0.31 -1.26 -4.75 118.33 116.67 3h3v n VAL 524 Ca -0.08 -2.15 0.00 0.00 -0.01 0.00 0.00 64.34 62.11 3h3v n VAL 524 Cb 0.50 1.14 0.00 0.00 -0.91 0.00 0.00 33.84 34.57 3h3v n VAL 524 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h3v n GLN 525 N -0.59 0.00 0.00 5.55 1.13 -1.26 -2.45 117.38 119.76 3h3v n GLN 525 Ca 0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.11 3h3v n GLN 525 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.93 3h3v n GLN 525 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3h3v n ASP 526 N -0.85 0.00 -0.69 1.08 9.92 -1.26 -0.32 116.55 124.43 3h3v n ASP 526 Ca 0.00 0.53 0.52 0.00 -0.53 0.00 0.00 54.79 55.31 3h3v n ASP 526 Cb 0.00 -0.09 0.79 0.00 -0.64 0.00 0.00 41.12 41.19 3h3v n ASP 526 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 3h3v n THR 527 N -1.32 -0.01 0.03 -3.53 -1.04 -1.20 -0.32 114.28 106.90 3h3v n THR 527 Ca 0.00 1.44 -0.02 0.00 -2.04 0.00 0.00 64.05 63.43 3h3v n THR 527 Cb 0.00 -2.41 -0.01 0.00 -1.82 0.00 0.00 70.33 66.09 3h3v n THR 527 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3h3v h LEU 528 N 0.00 -0.13 -1.62 -4.42 5.85 -0.33 -1.52 115.31 113.13 3h3v h LEU 528 Ca 0.91 0.00 0.32 0.00 0.84 0.00 0.00 57.88 59.96 3h3v h LEU 528 Cb 3.64 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 44.63 3h3v h LEU 528 CO -0.02 0.19 0.78 0.00 -0.34 0.00 0.00 178.44 179.05 3h3v h GLY 530 N 0.20 0.62 1.17 0.00 0.00 -0.74 -3.20 103.07 101.12 3h3v h GLY 530 Ca 0.62 -1.34 0.00 0.00 0.00 0.00 0.00 47.33 46.60 3h3v h GLY 530 CO -0.20 1.18 0.00 4.51 0.00 0.00 0.00 176.54 182.04 3h3v n ILE 531 N -3.88 0.25 -0.12 2.60 3.06 -0.06 -0.05 119.36 121.17 3h3v n ILE 531 Ca -0.14 0.06 -0.23 0.00 -2.50 0.00 0.00 62.75 59.95 3h3v n ILE 531 Cb 0.95 -0.94 -0.09 0.00 0.54 0.00 0.00 39.64 40.10 3h3v n ILE 531 CO 0.00 0.00 0.00 -1.14 -2.50 0.00 0.00 176.55 172.91 3h3v n ARG 532 N -1.08 0.56 -0.08 9.51 0.63 -1.11 -3.48 116.66 121.61 3h3v n ARG 532 Ca 0.05 0.39 -0.01 0.00 -0.92 0.00 0.00 57.85 57.37 3h3v n ARG 532 Cb 0.04 -1.60 0.26 0.00 0.45 0.00 0.00 32.46 31.61 3h3v n ARG 532 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 3h3v h LYS 533 N -1.00 0.70 0.00 -0.14 1.57 -1.41 -0.45 116.57 115.84 3h3v h LYS 533 Ca -0.45 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.16 3h3v h LYS 533 Cb 1.35 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 3h3v h LYS 533 CO -0.27 0.63 -0.24 1.25 -0.57 0.00 0.00 179.45 180.25 3h3v h LEU 534 N 0.68 0.00 0.00 2.94 5.85 -0.65 -3.35 115.31 120.78 3h3v h LEU 534 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.88 3h3v h LEU 534 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3h3v h LEU 534 CO -0.00 0.24 0.00 0.41 -0.34 0.00 0.00 178.44 178.75 3h3v n THR 535 N -3.79 0.00 0.00 1.05 -1.04 -0.19 -2.84 114.28 107.47 3h3v n THR 535 Ca -0.01 0.56 0.00 0.00 -2.04 0.00 0.00 64.05 62.55 3h3v n THR 535 Cb 0.34 -1.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.73 3h3v n THR 535 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h3v n LEU 536 N -0.60 0.00 -0.31 -4.42 4.77 -1.13 -3.49 117.00 111.82 3h3v n LEU 536 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 3h3v n LEU 536 Cb 0.00 0.00 0.36 0.00 -2.33 0.00 0.00 43.42 41.45 3h3v n LEU 536 CO 0.00 0.00 1.21 0.03 -1.33 0.00 0.00 177.39 177.30 3h3v h ARG 537 N 0.00 0.69 0.00 3.23 3.08 -1.94 0.15 114.38 119.59 3h3v h ARG 537 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3h3v h ARG 537 Cb 0.00 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 29.89 3h3v h ARG 537 CO 0.00 0.46 0.00 0.22 -1.07 0.00 0.00 179.97 179.58 3h3v h ASP 538 N 0.71 0.00 -3.59 7.04 -0.00 -1.97 -3.43 116.42 115.18 3h3v h ASP 538 Ca 0.52 0.00 -0.62 0.00 -0.00 0.00 0.00 57.03 56.93 3h3v h ASP 538 Cb 0.86 0.00 -0.13 0.00 -0.00 0.00 0.00 39.33 40.06 3h3v h ASP 538 CO -0.28 0.00 -0.08 -0.89 -0.00 0.00 0.00 179.24 177.99 3h3v s THR 539 N -3.51 5.11 0.09 2.25 2.01 0.54 -5.07 115.64 117.06 3h3v s THR 539 Ca -0.00 0.81 0.06 0.00 0.31 0.00 0.00 61.69 62.86 3h3v s THR 539 Cb 0.08 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 3h3v s THR 539 CO 0.28 0.13 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.82 3h3v s PHE 540 N 2.09 1.36 -0.01 4.92 0.40 -1.26 -3.29 117.98 122.19 3h3v s PHE 540 Ca 0.20 -0.48 0.02 0.00 -0.60 0.00 0.00 56.93 56.07 3h3v s PHE 540 Cb -0.16 -0.75 -0.00 0.00 0.51 0.00 0.00 43.02 42.63 3h3v s PHE 540 CO 0.09 0.11 -0.08 0.42 0.70 0.00 0.00 175.22 176.46 3h3v s ILE 541 N -1.51 0.67 0.04 0.64 1.01 0.48 -4.93 121.20 117.60 3h3v s ILE 541 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.33 3h3v s ILE 541 Cb -0.09 -0.57 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 3h3v s ILE 541 CO 0.03 0.20 0.15 -1.83 0.00 0.00 0.00 174.94 173.49 3h3v s GLU 542 N -0.09 3.25 0.00 2.79 -1.05 -1.26 -0.73 118.70 121.61 3h3v s GLU 542 Ca 0.02 -0.48 0.00 0.00 -0.15 0.00 0.00 54.97 54.36 3h3v s GLU 542 Cb -0.04 -2.95 0.00 0.00 -0.44 0.00 0.00 34.13 30.69 3h3v s GLU 542 CO -0.00 0.62 0.00 -0.11 0.95 0.00 0.00 175.26 176.72 3h3v n LEU 543 N 0.59 0.00 -0.16 1.83 7.94 -1.26 -1.28 117.00 124.67 3h3v n LEU 543 Ca -0.08 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 54.82 3h3v n LEU 543 Cb 0.52 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.49 3h3v n LEU 543 CO 0.46 0.00 0.24 -0.90 -1.11 0.00 0.00 177.39 176.08 3h3v n ASP 544 N -0.16 -0.26 0.15 1.96 5.75 -1.26 -0.55 116.55 122.19 3h3v n ASP 544 Ca 0.00 0.71 -0.07 0.00 -0.01 0.00 0.00 54.79 55.42 3h3v n ASP 544 Cb 0.00 -0.17 -0.03 0.00 -1.03 0.00 0.00 41.12 39.89 3h3v n ASP 544 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 3h3v h GLN 545 N 0.00 -0.45 0.00 0.11 4.20 -1.59 -2.39 115.11 115.00 3h3v h GLN 545 Ca 0.15 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.89 3h3v h GLN 545 Cb 0.25 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.13 3h3v h GLN 545 CO -0.40 -0.30 0.43 0.28 -0.67 0.00 0.00 178.83 178.16 3h3v n VAL 546 N -4.91 0.48 -0.09 -0.54 0.31 -0.31 0.76 118.33 114.02 3h3v n VAL 546 Ca -0.06 0.65 -0.14 0.00 -0.01 0.00 0.00 64.34 64.79 3h3v n VAL 546 Cb 0.18 -1.65 -0.07 0.00 -0.91 0.00 0.00 33.84 31.39 3h3v n VAL 546 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3h3v n LEU 547 N -1.64 1.84 -0.33 7.52 4.77 0.28 -3.31 117.00 126.13 3h3v n LEU 547 Ca -0.00 0.52 -0.01 0.00 -0.03 0.00 0.00 56.01 56.49 3h3v n LEU 547 Cb 0.44 -0.92 0.15 0.00 -2.33 0.00 0.00 43.42 40.76 3h3v n LEU 547 CO 0.02 -0.07 1.28 0.78 -1.33 0.00 0.00 177.39 178.08 3h3v h ASN 548 N -1.00 1.07 -0.62 -1.43 2.35 0.88 -1.15 115.58 115.68 3h3v h ASN 548 Ca -0.20 -0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.54 3h3v h ASN 548 Cb 0.95 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 39.02 3h3v h ASN 548 CO -0.12 0.77 0.40 0.24 -1.65 0.00 0.00 177.43 177.07 3h3v h MET 549 N 1.26 0.78 -0.61 0.81 2.86 -0.14 -1.24 114.93 118.65 3h3v h MET 549 Ca 0.35 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.97 3h3v h MET 549 Cb -0.12 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.33 3h3v h MET 549 CO -0.08 0.52 0.38 -0.07 1.06 0.00 0.00 176.91 178.72 3h3v h LEU 550 N 0.81 0.63 -1.58 1.22 3.38 -1.28 -1.74 115.31 116.75 3h3v h LEU 550 Ca 0.23 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.27 3h3v h LEU 550 Cb -0.06 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3h3v h LEU 550 CO -0.07 0.44 0.38 0.22 0.09 0.00 0.00 178.44 179.50 3h3v h TYR 551 N 0.75 0.52 0.00 1.13 3.20 -0.14 -1.78 116.97 120.65 3h3v h TYR 551 Ca 0.24 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.08 3h3v h TYR 551 Cb 0.01 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 3h3v h TYR 551 CO -0.05 0.28 -0.23 -1.49 -1.64 0.00 0.00 178.16 175.02 3h3v h TRP 552 N 0.51 0.00 -3.58 -3.82 4.06 -0.36 -3.38 115.95 109.38 3h3v h TRP 552 Ca 0.25 0.00 -0.56 0.00 2.06 0.00 0.00 58.89 60.64 3h3v h TRP 552 Cb 0.31 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 28.41 3h3v h TRP 552 CO -0.00 0.23 0.96 0.08 -3.56 0.00 0.00 178.44 176.15 3h3v s VAL 553 N -4.17 4.12 0.39 1.49 1.01 -0.67 -4.87 120.40 117.70 3h3v s VAL 553 Ca -0.02 1.13 0.14 0.00 0.00 0.00 0.00 61.98 63.22 3h3v s VAL 553 Cb 0.13 -4.55 0.35 0.00 0.00 0.00 0.00 36.38 32.32 3h3v s VAL 553 CO 0.65 -1.01 1.84 1.55 0.00 0.00 0.00 175.10 178.14 3h3v h PRO 554 N 9.55 0.52 -1.08 2.72 0.13 -1.84 -2.08 132.00 139.93 3h3v h PRO 554 Ca -0.24 -0.03 -0.46 0.00 -0.87 0.00 0.00 66.00 64.40 3h3v h PRO 554 Cb 1.07 -0.12 -0.24 0.00 0.13 0.00 0.00 31.00 31.84 3h3v h PRO 554 CO 1.13 0.34 0.59 -0.25 -0.23 0.00 0.00 178.00 179.58 3h3v n ASP 555 N -4.56 4.94 -4.67 1.44 8.00 -1.26 -4.94 116.55 115.49 3h3v n ASP 555 Ca 0.20 -3.36 -0.43 0.00 0.71 0.00 0.00 54.79 51.91 3h3v n ASP 555 Cb 0.63 -0.86 -0.02 0.00 -0.02 0.00 0.00 41.12 40.84 3h3v n ASP 555 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 3h3v s TRP 556 N -2.78 2.84 -1.84 1.24 -0.00 -0.78 -4.85 118.94 112.76 3h3v s TRP 556 Ca 0.48 0.94 0.06 0.00 -0.00 0.00 0.00 56.10 57.57 3h3v s TRP 556 Cb 0.39 -3.56 0.32 0.00 -0.00 0.00 0.00 33.47 30.63 3h3v s TRP 556 CO 0.05 -1.98 0.87 -0.40 -0.00 0.00 0.00 176.95 175.49 3h3v n ASP 557 N 6.05 0.00 -1.59 5.86 5.75 -1.26 -4.79 116.55 126.56 3h3v n ASP 557 Ca 0.13 -0.07 -0.10 0.00 -0.01 0.00 0.00 54.79 54.74 3h3v n ASP 557 Cb 0.45 -0.08 0.02 0.00 -1.03 0.00 0.00 41.12 40.48 3h3v n ASP 557 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h3v n GLY 558 N -0.69 0.18 2.76 6.12 0.00 -1.26 -5.01 105.19 107.29 3h3v n GLY 558 Ca 0.04 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 3h3v n GLY 558 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h3v s VAL 559 N -2.91 1.59 -0.30 1.61 1.01 -1.26 -5.07 120.40 115.07 3h3v s VAL 559 Ca 0.17 -2.61 -0.32 0.00 0.00 0.00 0.00 61.98 59.23 3h3v s VAL 559 Cb -0.08 -2.12 -0.09 0.00 0.00 0.00 0.00 36.38 34.10 3h3v s VAL 559 CO 0.21 -0.86 2.22 2.30 0.00 0.00 0.00 175.10 178.97 3h3v n ILE 560 N 3.57 0.25 -2.22 2.22 -5.35 -1.26 -4.89 119.36 111.68 3h3v n ILE 560 Ca 0.07 -0.36 -0.41 0.00 -0.27 0.00 0.00 62.75 61.78 3h3v n ILE 560 Cb 0.35 -2.07 -0.03 0.00 -1.74 0.00 0.00 39.64 36.15 3h3v n ILE 560 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 3h3v s PRO 561 N 6.36 4.40 -0.02 6.28 0.04 -1.26 -4.95 135.00 145.84 3h3v s PRO 561 Ca 1.06 2.06 -0.37 0.00 0.04 0.00 0.00 61.00 63.79 3h3v s PRO 561 Cb -0.62 -3.18 -0.15 0.00 0.04 0.00 0.00 34.50 30.60 3h3v s PRO 561 CO 0.42 -0.22 1.56 0.25 0.04 0.00 0.00 177.00 179.05 3h3v n THR 562 N 2.30 0.16 -1.63 1.26 -2.24 -1.26 -4.90 114.28 107.96 3h3v n THR 562 Ca 0.05 -0.03 -0.41 0.00 -2.27 0.00 0.00 64.05 61.39 3h3v n THR 562 Cb 0.43 -1.19 0.01 0.00 -2.10 0.00 0.00 70.33 67.48 3h3v n THR 562 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3h3v n PRO 563 N 3.96 1.48 0.05 -0.78 -0.02 -1.26 -4.92 135.00 133.51 3h3v n PRO 563 Ca 0.21 0.53 -0.09 0.00 -2.02 0.00 0.00 63.50 62.13 3h3v n PRO 563 Cb 0.20 -2.12 0.04 0.00 -0.02 0.00 0.00 33.50 31.60 3h3v n PRO 563 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h3v h ALA 564 N 1.66 0.64 -3.54 3.55 0.00 -1.63 -3.42 119.26 116.52 3h3v h ALA 564 Ca -0.45 -0.59 -0.68 0.00 0.00 0.00 0.00 54.91 53.19 3h3v h ALA 564 Cb 1.33 -0.07 -0.30 0.00 0.00 0.00 0.00 17.79 18.75 3h3v h ALA 564 CO 0.58 0.75 -0.84 0.42 0.00 0.00 0.00 179.25 180.16 3h3v s ILE 565 N -3.67 2.42 0.00 0.00 1.01 -1.05 -4.99 121.20 114.92 3h3v s ILE 565 Ca -0.06 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.69 3h3v s ILE 565 Cb 0.11 -1.94 0.00 0.00 0.01 0.00 0.00 42.46 40.63 3h3v s ILE 565 CO 0.83 0.55 0.00 -0.38 0.00 0.00 0.00 174.94 175.95 3h3v n ILE 566 N 3.30 0.00 0.00 2.92 5.41 -1.26 -0.73 119.36 129.00 3h3v n ILE 566 Ca -0.18 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.57 3h3v n ILE 566 Cb 0.53 -0.88 0.00 0.00 -0.71 0.00 0.00 39.64 38.57 3h3v n ILE 566 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 3h3v n LYS 567 N -2.65 0.00 -0.03 0.38 2.85 -1.26 -3.62 118.16 113.83 3h3v n LYS 567 Ca 0.00 0.00 -0.14 0.00 -1.05 0.00 0.00 58.31 57.12 3h3v n LYS 567 Cb 0.45 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.73 3h3v n LYS 567 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 3h3v h PRO 568 N 0.00 0.29 -4.64 -1.58 0.13 -2.05 -3.45 132.00 120.70 3h3v h PRO 568 Ca 0.00 -0.22 -0.53 0.00 -0.87 0.00 0.00 66.00 64.38 3h3v h PRO 568 Cb 0.00 0.04 -0.33 0.00 0.13 0.00 0.00 31.00 30.84 3h3v h PRO 568 CO 0.00 0.84 -0.82 0.21 -0.23 0.00 0.00 178.00 178.00 3h3v s LYS 569 N -3.74 1.82 -0.21 0.86 2.20 -1.24 -5.11 119.74 114.32 3h3v s LYS 569 Ca -0.15 -0.46 -0.29 0.00 -0.36 0.00 0.00 55.97 54.71 3h3v s LYS 569 Cb 0.03 -1.48 -0.02 0.00 -1.51 0.00 0.00 37.83 34.85 3h3v s LYS 569 CO 0.76 0.05 1.53 -1.25 -0.36 0.00 0.00 175.35 176.07 3h3v s PRO 570 N 0.61 3.91 0.25 4.03 0.04 -1.25 -4.23 135.00 138.35 3h3v s PRO 570 Ca -0.15 1.65 0.06 0.00 0.04 0.00 0.00 61.00 62.60 3h3v s PRO 570 Cb -0.16 -3.97 -0.05 0.00 0.04 0.00 0.00 34.50 30.35 3h3v s PRO 570 CO 0.04 -1.15 -0.05 -0.51 0.04 0.00 0.00 177.00 175.37 3h3v s LEU 571 N 4.74 2.39 0.11 -3.56 1.02 0.09 -4.28 118.68 119.20 3h3v s LEU 571 Ca 0.67 -1.18 0.03 0.00 0.02 0.00 0.00 54.13 53.67 3h3v s LEU 571 Cb -0.24 -0.50 -0.04 0.00 0.02 0.00 0.00 46.19 45.42 3h3v s LEU 571 CO 0.27 -0.39 -0.08 0.26 0.02 0.00 0.00 176.35 176.43 3h3v s TRP 572 N -3.16 1.02 0.23 0.29 0.51 0.10 -1.55 118.94 116.37 3h3v s TRP 572 Ca 0.28 -0.86 0.10 0.00 -2.12 0.00 0.00 56.10 53.50 3h3v s TRP 572 Cb 0.04 -0.56 -0.04 0.00 -0.81 0.00 0.00 33.47 32.10 3h3v s TRP 572 CO 0.10 -0.07 -0.08 -1.54 -0.51 0.00 0.00 176.95 174.85 3h3v s SER 573 N -3.07 4.26 0.11 2.95 1.04 -1.26 0.18 113.70 117.92 3h3v s SER 573 Ca 0.13 -0.67 -0.33 0.00 0.48 0.00 0.00 55.95 55.56 3h3v s SER 573 Cb 0.04 -0.70 -0.12 0.00 0.10 0.00 0.00 66.02 65.34 3h3v s SER 573 CO -0.03 0.05 1.57 1.23 0.98 0.00 0.00 173.24 177.04 3h3v h GLY 574 N 2.42 -1.01 -0.95 7.32 0.00 -1.51 0.23 103.07 109.57 3h3v h GLY 574 Ca -0.45 0.61 0.29 0.00 0.00 0.00 0.00 47.33 47.78 3h3v h GLY 574 CO 0.57 -0.25 0.11 0.50 0.00 0.00 0.00 176.54 177.48 3h3v h LYS 575 N -0.66 0.02 0.12 4.80 1.57 -1.58 0.59 116.57 121.42 3h3v h LYS 575 Ca 0.02 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 3h3v h LYS 575 Cb 0.71 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.99 3h3v h LYS 575 CO -0.34 0.01 -0.23 0.37 -0.57 0.00 0.00 179.45 178.69 3h3v h GLN 576 N 0.02 -0.42 0.18 3.15 4.15 -0.92 -2.89 115.11 118.38 3h3v h GLN 576 Ca 0.63 0.03 -0.30 0.00 0.77 0.00 0.00 58.65 59.78 3h3v h GLN 576 Cb 1.38 0.09 0.02 0.00 0.21 0.00 0.00 27.48 29.18 3h3v h GLN 576 CO -0.89 -0.28 -1.44 -0.84 -1.93 0.00 0.00 178.83 173.45 3h3v h ILE 577 N -0.43 1.14 -0.62 2.39 3.07 -0.43 -3.27 117.51 119.36 3h3v h ILE 577 Ca 0.03 -2.53 0.18 0.00 1.55 0.00 0.00 64.86 64.08 3h3v h ILE 577 Cb 0.45 2.90 -0.02 0.00 -0.27 0.00 0.00 36.82 39.88 3h3v h ILE 577 CO -0.13 0.78 0.86 0.25 -1.05 0.00 0.00 178.15 178.86 3h3v h LEU 578 N -0.07 0.00 -0.93 0.16 5.85 0.07 1.21 115.31 121.61 3h3v h LEU 578 Ca -0.28 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.33 3h3v h LEU 578 Cb 1.96 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.97 3h3v h LEU 578 CO 0.17 0.00 -0.45 0.28 -0.34 0.00 0.00 178.44 178.10 3h3v h SER 579 N 0.00 0.19 -0.56 1.25 0.02 -1.55 -3.03 113.55 109.86 3h3v h SER 579 Ca 0.30 -0.08 0.16 0.00 -0.84 0.00 0.00 61.79 61.33 3h3v h SER 579 Cb 2.00 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 64.47 3h3v h SER 579 CO -0.00 0.62 0.44 0.58 -1.14 0.00 0.00 176.83 177.33 3h3v h VAL 580 N 0.15 0.61 0.00 2.27 2.07 0.13 0.39 116.25 121.87 3h3v h VAL 580 Ca 0.01 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.36 3h3v h VAL 580 Cb 0.86 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 3h3v h VAL 580 CO 0.07 0.00 -0.81 0.00 0.02 0.00 0.00 177.57 176.85 3h3v h ALA 581 N 1.65 0.65 -1.87 1.67 0.00 -1.65 -3.43 119.26 116.29 3h3v h ALA 581 Ca 0.27 -0.74 -0.58 0.00 0.00 0.00 0.00 54.91 53.86 3h3v h ALA 581 Cb 1.14 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.72 3h3v h ALA 581 CO -0.00 1.01 0.75 0.42 0.00 0.00 0.00 179.25 181.43 3h3v s ILE 582 N -3.14 4.39 0.67 0.00 1.01 0.14 -4.87 121.20 119.40 3h3v s ILE 582 Ca -0.00 1.10 -0.16 0.00 0.00 0.00 0.00 60.65 61.59 3h3v s ILE 582 Cb 0.11 -4.48 0.01 0.00 0.01 0.00 0.00 42.46 38.11 3h3v s ILE 582 CO 0.79 -0.82 1.18 -2.16 0.00 0.00 0.00 174.94 173.93 3h3v s PRO 583 N 3.98 2.56 0.30 2.79 0.04 -1.26 -4.65 135.00 138.75 3h3v s PRO 583 Ca 0.42 1.68 -0.29 0.00 0.04 0.00 0.00 61.00 62.85 3h3v s PRO 583 Cb -0.09 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 3h3v s PRO 583 CO 0.26 -1.50 1.30 -0.80 0.04 0.00 0.00 177.00 176.31 3h3v s ASN 584 N -2.04 6.82 0.00 6.66 0.01 -1.25 -3.39 114.94 121.75 3h3v s ASN 584 Ca 0.73 2.61 0.00 0.00 -0.71 0.00 0.00 52.86 55.49 3h3v s ASN 584 Cb -0.27 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 38.75 3h3v s ASN 584 CO 0.40 -0.52 0.00 0.61 -1.51 0.00 0.00 177.10 176.09 3h3v n GLY 585 N 1.21 2.18 3.51 0.66 0.00 -0.99 -4.94 105.19 106.82 3h3v n GLY 585 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3h3v n GLY 585 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3v s ILE 586 N -2.14 1.65 0.00 -0.61 -1.09 -1.22 -4.86 121.20 112.94 3h3v s ILE 586 Ca 0.00 0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.42 3h3v s ILE 586 Cb 0.00 -2.29 0.00 0.00 -1.58 0.00 0.00 42.46 38.59 3h3v s ILE 586 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 174.94 175.28 3h3v n HIS 587 N -4.94 0.00 -4.64 3.97 -0.00 -1.26 -3.07 115.22 105.28 3h3v n HIS 587 Ca 0.09 0.00 -0.23 0.00 0.46 0.00 0.00 57.72 58.05 3h3v n HIS 587 Cb 0.58 0.00 -0.15 0.00 -0.12 0.00 0.00 29.99 30.30 3h3v n HIS 587 CO 0.00 0.00 0.00 -1.17 0.46 0.00 0.00 176.34 175.63 3h3v s LEU 588 N 0.00 1.96 -0.05 0.27 2.96 0.16 -4.94 118.68 119.05 3h3v s LEU 588 Ca 0.00 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.65 3h3v s LEU 588 Cb 0.00 -0.74 0.02 0.00 0.50 0.00 0.00 46.19 45.97 3h3v s LEU 588 CO 0.00 0.15 -0.03 -1.10 -1.32 0.00 0.00 176.35 174.05 3h3v s GLN 589 N -0.17 0.69 0.00 1.98 -0.21 -1.26 -0.87 119.66 119.82 3h3v s GLN 589 Ca 0.02 -0.03 0.00 0.00 0.02 0.00 0.00 55.36 55.37 3h3v s GLN 589 Cb -0.07 -0.80 0.00 0.00 1.00 0.00 0.00 33.01 33.13 3h3v s GLN 589 CO 0.00 -0.14 0.00 -2.13 -2.12 0.00 0.00 175.29 170.91 3h3v n ARG 590 N 4.29 0.00 -0.94 2.91 0.63 0.04 -4.96 116.66 118.62 3h3v n ARG 590 Ca -0.22 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.71 3h3v n ARG 590 Cb 0.51 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.42 3h3v n ARG 590 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3h3v n PHE 591 N -0.40 0.00 0.05 -0.14 3.01 -1.26 -4.90 117.46 113.81 3h3v n PHE 591 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.43 3h3v n PHE 591 Cb 0.00 -0.94 -0.01 0.00 -0.01 0.00 0.00 39.48 38.52 3h3v n PHE 591 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3h3v h ASP 592 N 0.00 -0.16 0.00 4.37 3.32 -1.89 -3.46 116.42 118.61 3h3v h ASP 592 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3h3v h ASP 592 Cb 0.00 0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3h3v h ASP 592 CO 0.00 0.16 0.00 -0.62 -1.72 0.00 0.00 179.24 177.06 3h3v n GLU 593 N -4.02 0.00 -0.05 3.56 1.02 -1.26 -4.88 120.64 115.01 3h3v n GLU 593 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 3h3v n GLU 593 Cb 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.49 3h3v n GLU 593 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h3v n GLY 594 N 0.06 1.23 3.72 0.62 0.00 -1.26 -4.81 105.19 104.75 3h3v n GLY 594 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3h3v n GLY 594 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h3v s THR 595 N 0.50 3.26 -0.21 2.61 2.01 -1.26 -4.32 115.64 118.23 3h3v s THR 595 Ca 0.00 0.90 0.18 0.00 0.31 0.00 0.00 61.69 63.08 3h3v s THR 595 Cb 0.00 -3.58 0.40 0.00 0.01 0.00 0.00 72.50 69.34 3h3v s THR 595 CO 0.00 0.07 1.24 0.35 -0.69 0.00 0.00 174.62 175.59 3h3v n THR 596 N 3.96 0.52 -0.64 -0.82 -2.24 -1.26 -4.88 114.28 108.90 3h3v n THR 596 Ca 0.12 -1.65 0.00 0.00 -2.27 0.00 0.00 64.05 60.24 3h3v n THR 596 Cb 0.42 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 3h3v n THR 596 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3h3v n LEU 597 N -0.62 0.82 -1.23 3.22 4.32 -1.26 -4.23 117.00 118.02 3h3v n LEU 597 Ca -0.05 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 55.88 3h3v n LEU 597 Cb 0.87 -1.75 -0.04 0.00 -1.62 0.00 0.00 43.42 40.88 3h3v n LEU 597 CO -0.04 -0.64 0.38 -0.11 -1.22 0.00 0.00 177.39 175.75 3h3v n LEU 598 N 0.00 -1.01 -3.92 2.23 0.00 -1.26 -5.11 117.00 107.93 3h3v n LEU 598 Ca 0.00 -2.08 -0.55 0.00 0.00 0.00 0.00 56.01 53.38 3h3v n LEU 598 Cb 0.23 0.02 -0.11 0.00 0.00 0.00 0.00 43.42 43.57 3h3v n LEU 598 CO 0.00 1.48 1.54 -1.54 0.00 0.00 0.00 177.39 178.87 3h3v n SER 599 N -0.23 0.72 0.52 1.96 3.41 -1.26 -4.83 113.62 113.90 3h3v n SER 599 Ca -0.25 0.66 -0.21 0.00 -0.26 0.00 0.00 58.87 58.81 3h3v n SER 599 Cb 0.70 -0.82 -0.10 0.00 -0.26 0.00 0.00 64.21 63.73 3h3v n SER 599 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3h3v h PRO 600 N 7.97 -1.28 0.00 4.33 0.13 -1.96 -2.18 132.00 139.01 3h3v h PRO 600 Ca -0.11 0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3h3v h PRO 600 Cb 1.30 0.29 0.00 0.00 0.13 0.00 0.00 31.00 32.71 3h3v h PRO 600 CO 0.99 -0.85 0.00 1.63 -0.23 0.00 0.00 178.00 179.54 3h3v n LYS 601 N -5.66 0.06 -3.23 0.86 5.02 -1.26 -4.73 118.16 109.21 3h3v n LYS 601 Ca -0.17 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 55.97 3h3v n LYS 601 Cb 0.52 -1.44 0.07 0.00 -0.02 0.00 0.00 35.03 34.17 3h3v n LYS 601 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3h3v n ASP 602 N -0.94 -2.90 -2.30 4.39 2.03 -0.82 -4.94 116.55 111.08 3h3v n ASP 602 Ca 0.01 -0.49 0.00 0.00 0.52 0.00 0.00 54.79 54.83 3h3v n ASP 602 Cb 0.01 -4.29 0.00 0.00 -0.72 0.00 0.00 41.12 36.11 3h3v n ASP 602 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3h3v n ASN 603 N -2.62 -0.19 0.00 1.67 3.02 -1.26 -2.95 115.26 112.92 3h3v n ASN 603 Ca -0.18 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.65 3h3v n ASN 603 Cb 0.62 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.79 3h3v n ASN 603 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3v n GLY 604 N 4.42 0.95 3.65 7.41 0.00 -1.26 -4.16 105.19 116.20 3h3v n GLY 604 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 3h3v n GLY 604 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3h3v s MET 605 N 0.00 0.01 -0.25 1.61 1.75 -1.26 -4.24 119.30 116.92 3h3v s MET 605 Ca 0.00 0.00 -0.09 0.00 -1.25 0.00 0.00 55.69 54.35 3h3v s MET 605 Cb 0.00 0.00 0.11 0.00 2.84 0.00 0.00 34.83 37.78 3h3v s MET 605 CO 0.00 -0.00 0.54 -1.17 -0.65 0.00 0.00 175.02 173.74 3h3v s LEU 606 N -0.81 -0.87 -0.07 4.11 2.96 -0.84 -0.78 118.68 122.38 3h3v s LEU 606 Ca 0.10 1.29 0.03 0.00 -0.22 0.00 0.00 54.13 55.32 3h3v s LEU 606 Cb -0.02 1.84 0.01 0.00 0.50 0.00 0.00 46.19 48.52 3h3v s LEU 606 CO -0.10 -0.23 -0.18 -0.63 -1.32 0.00 0.00 176.35 173.89 3h3v s ILE 607 N 2.66 1.54 -0.01 6.68 1.01 -0.05 -0.03 121.20 133.00 3h3v s ILE 607 Ca -0.04 -0.73 0.06 0.00 0.00 0.00 0.00 60.65 59.94 3h3v s ILE 607 Cb -0.12 -1.36 -0.02 0.00 0.01 0.00 0.00 42.46 40.98 3h3v s ILE 607 CO -0.16 0.44 -0.20 -0.63 0.00 0.00 0.00 174.94 174.40 3h3v s ILE 608 N 0.44 1.56 0.00 2.92 1.01 -0.16 -0.66 121.20 126.30 3h3v s ILE 608 Ca -0.14 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.63 3h3v s ILE 608 Cb -0.16 -1.30 0.00 0.00 0.01 0.00 0.00 42.46 41.01 3h3v s ILE 608 CO 0.05 0.42 0.00 -0.67 0.00 0.00 0.00 174.94 174.74 3h3v n ASP 609 N 2.53 -1.86 0.00 3.58 2.03 -1.18 0.48 116.55 122.13 3h3v n ASP 609 Ca -0.15 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.16 3h3v n ASP 609 Cb 0.53 -2.20 0.00 0.00 -0.72 0.00 0.00 41.12 38.73 3h3v n ASP 609 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h3v n GLY 610 N -0.38 1.15 3.21 0.27 0.00 -1.24 -2.35 105.19 105.85 3h3v n GLY 610 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3h3v n GLY 610 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h3v s GLN 611 N -0.20 2.02 0.23 1.61 -1.52 0.18 -4.51 119.66 117.47 3h3v s GLN 611 Ca 0.00 -0.76 -0.31 0.00 -1.95 0.00 0.00 55.36 52.34 3h3v s GLN 611 Cb 0.00 -1.80 -0.10 0.00 -0.22 0.00 0.00 33.01 30.89 3h3v s GLN 611 CO 0.00 0.36 1.53 0.42 -0.25 0.00 0.00 175.29 177.35 3h3v s ILE 612 N -0.21 2.48 -0.12 1.08 1.01 -1.26 -0.99 121.20 123.18 3h3v s ILE 612 Ca 0.00 0.38 0.08 0.00 0.00 0.00 0.00 60.65 61.11 3h3v s ILE 612 Cb -0.11 -3.24 -0.13 0.00 0.01 0.00 0.00 42.46 38.98 3h3v s ILE 612 CO 0.02 0.05 -0.01 -0.38 0.00 0.00 0.00 174.94 174.62 3h3v n ILE 613 N 2.93 0.82 0.00 2.92 5.41 0.96 -4.89 119.36 127.50 3h3v n ILE 613 Ca 0.10 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.40 3h3v n ILE 613 Cb 0.39 -0.78 0.00 0.00 -0.71 0.00 0.00 39.64 38.54 3h3v n ILE 613 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 3h3v n PHE 614 N -2.57 0.00 0.00 1.39 1.16 -1.11 -4.98 117.46 111.35 3h3v n PHE 614 Ca -0.21 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.37 3h3v n PHE 614 Cb 0.85 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.72 3h3v n PHE 614 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3h3v n GLY 615 N -0.03 2.08 3.68 4.97 0.00 -1.26 -1.98 105.19 112.65 3h3v n GLY 615 Ca 0.00 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 3h3v n GLY 615 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h3v s VAL 616 N -1.10 2.53 -0.15 1.61 1.01 -1.15 -4.89 120.40 118.26 3h3v s VAL 616 Ca 0.00 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.16 3h3v s VAL 616 Cb 0.00 -2.49 -0.00 0.00 0.00 0.00 0.00 36.38 33.89 3h3v s VAL 616 CO 0.00 -0.23 -0.17 -0.69 0.00 0.00 0.00 175.10 174.02 3h3v s VAL 617 N -2.79 2.55 0.04 2.92 1.01 -1.26 -4.83 120.40 118.04 3h3v s VAL 617 Ca 0.65 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 3h3v s VAL 617 Cb -0.20 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.12 3h3v s VAL 617 CO 0.58 0.52 0.07 -1.84 0.00 0.00 0.00 175.10 174.44 3h3v n GLU 618 N 4.01 0.11 -0.29 2.72 -0.00 -1.26 -3.68 120.64 122.25 3h3v n GLU 618 Ca -0.19 -0.28 0.22 0.00 -0.00 0.00 0.00 57.16 56.91 3h3v n GLU 618 Cb 0.52 0.31 0.41 0.00 -0.00 0.00 0.00 31.44 32.68 3h3v n GLU 618 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 3h3v n LYS 619 N -0.06 -0.06 0.29 3.44 4.81 -1.08 0.14 118.16 125.64 3h3v n LYS 619 Ca -0.01 1.24 -0.16 0.00 -0.87 0.00 0.00 58.31 58.51 3h3v n LYS 619 Cb 0.07 -2.12 -0.08 0.00 0.02 0.00 0.00 35.03 32.91 3h3v n LYS 619 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 3h3v h LYS 620 N 0.00 -0.67 0.00 1.64 1.57 -1.94 -0.76 116.57 116.41 3h3v h LYS 620 Ca 0.66 0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 59.29 3h3v h LYS 620 Cb 1.62 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 34.07 3h3v h LYS 620 CO -0.73 -0.43 -0.87 1.15 -0.57 0.00 0.00 179.45 178.01 3h3v h THR 621 N -0.75 1.50 -0.17 -0.16 2.02 -0.66 -3.39 112.91 111.30 3h3v h THR 621 Ca -0.07 -2.62 -0.20 0.00 0.77 0.00 0.00 66.41 64.29 3h3v h THR 621 Cb 0.56 2.46 -0.33 0.00 -1.74 0.00 0.00 68.15 69.10 3h3v h THR 621 CO 0.12 0.76 -0.95 0.55 0.37 0.00 0.00 175.52 176.37 3h3v n VAL 622 N -3.66 0.89 -3.60 3.16 3.14 0.68 -1.26 118.33 117.68 3h3v n VAL 622 Ca -0.03 -2.11 -0.00 0.00 -2.96 0.00 0.00 64.34 59.23 3h3v n VAL 622 Cb 0.80 0.70 -0.00 0.00 -1.06 0.00 0.00 33.84 34.28 3h3v n VAL 622 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3h3v n GLY 623 N -0.14 3.27 1.84 7.55 0.00 -0.29 -3.04 105.19 114.38 3h3v n GLY 623 Ca 0.11 -2.18 -0.05 0.00 0.00 0.00 0.00 46.02 43.91 3h3v n GLY 623 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h3v n SER 624 N -1.81 4.23 -4.80 1.61 3.41 -1.26 -4.63 113.62 110.36 3h3v n SER 624 Ca -0.00 -2.20 -0.29 0.00 -0.26 0.00 0.00 58.87 56.12 3h3v n SER 624 Cb 0.01 -1.01 0.11 0.00 -0.26 0.00 0.00 64.21 63.06 3h3v n SER 624 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3h3v s SER 625 N 2.10 4.08 0.00 4.04 1.04 -1.26 -4.57 113.70 119.13 3h3v s SER 625 Ca 0.25 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.48 3h3v s SER 625 Cb 0.12 -1.28 0.00 0.00 0.10 0.00 0.00 66.02 64.96 3h3v s SER 625 CO 0.00 -2.18 0.63 0.59 0.98 0.00 0.00 173.24 173.26 3h3v n ASN 626 N -3.50 0.00 -1.84 7.02 3.02 -1.26 -3.65 115.26 115.06 3h3v n ASN 626 Ca 0.08 0.79 -0.17 0.00 -0.03 0.00 0.00 54.58 55.25 3h3v n ASN 626 Cb 0.60 -0.46 0.09 0.00 -0.61 0.00 0.00 39.78 39.41 3h3v n ASN 626 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3v n GLY 627 N 0.07 3.85 3.81 7.41 0.00 -1.26 -4.73 105.19 114.33 3h3v n GLY 627 Ca 0.00 -0.89 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 3h3v n GLY 627 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h3v s GLY 628 N -0.42 1.79 0.20 -0.02 0.00 -1.24 -4.80 107.32 102.84 3h3v s GLY 628 Ca 0.37 0.20 -0.20 0.00 0.00 0.00 0.00 44.72 45.08 3h3v s GLY 628 CO 0.05 0.51 1.57 -2.00 0.00 0.00 0.00 173.10 173.23 3h3v h LEU 629 N -0.49 -1.33 0.24 0.66 6.46 -1.47 -0.16 115.31 119.21 3h3v h LEU 629 Ca -0.45 0.27 0.01 0.00 -0.12 0.00 0.00 57.88 57.59 3h3v h LEU 629 Cb 1.22 0.67 -0.02 0.00 -0.73 0.00 0.00 40.66 41.79 3h3v h LEU 629 CO 0.56 -0.30 -0.28 0.40 -0.62 0.00 0.00 178.44 178.20 3h3v h ILE 630 N -0.09 0.40 -0.75 4.05 2.04 -1.82 0.28 117.51 121.62 3h3v h ILE 630 Ca 0.28 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.31 3h3v h ILE 630 Cb 0.57 0.40 -0.13 0.00 -0.74 0.00 0.00 36.82 36.92 3h3v h ILE 630 CO -0.82 0.00 0.02 -0.74 0.00 0.00 0.00 178.15 176.61 3h3v h HIS 631 N -0.57 -0.02 0.13 1.37 2.76 -1.42 -0.01 115.15 117.39 3h3v h HIS 631 Ca 0.00 0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 3h3v h HIS 631 Cb 0.54 0.13 0.00 0.00 1.55 0.00 0.00 27.41 29.63 3h3v h HIS 631 CO -0.20 -0.23 -0.06 0.28 -1.30 0.00 0.00 177.93 176.42 3h3v h VAL 632 N 0.11 1.05 -0.76 5.26 2.07 -0.52 -2.40 116.25 121.07 3h3v h VAL 632 Ca 0.41 -0.98 0.16 0.00 0.82 0.00 0.00 66.70 67.11 3h3v h VAL 632 Cb 0.73 1.64 -0.11 0.00 -1.52 0.00 0.00 31.29 32.03 3h3v h VAL 632 CO -0.65 0.22 0.24 0.58 0.02 0.00 0.00 177.57 177.99 3h3v h VAL 633 N -0.66 0.56 0.18 2.57 2.07 0.09 -0.82 116.25 120.25 3h3v h VAL 633 Ca -0.02 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 3h3v h VAL 633 Cb 0.50 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3h3v h VAL 633 CO 0.03 0.06 -0.09 0.74 0.02 0.00 0.00 177.57 178.33 3h3v h THR 634 N 0.34 0.83 0.11 2.57 2.02 -0.99 -1.28 112.91 116.50 3h3v h THR 634 Ca 0.43 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 67.54 3h3v h THR 634 Cb 0.71 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.99 3h3v h THR 634 CO -0.47 0.02 -0.10 0.03 0.37 0.00 0.00 175.52 175.36 3h3v h ARG 635 N -0.28 -0.20 0.00 6.66 2.47 -0.82 -1.91 114.38 120.30 3h3v h ARG 635 Ca -0.03 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 3h3v h ARG 635 Cb 0.22 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.58 3h3v h ARG 635 CO 0.04 -0.13 0.00 -1.91 0.56 0.00 0.00 179.97 178.53 3h3v n GLU 636 N -2.92 0.00 0.15 0.04 4.07 -0.39 -3.91 120.64 117.67 3h3v n GLU 636 Ca -0.02 0.32 0.02 0.00 -0.06 0.00 0.00 57.16 57.42 3h3v n GLU 636 Cb 0.10 -1.18 0.37 0.00 -0.06 0.00 0.00 31.44 30.66 3h3v n GLU 636 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 3h3v h LYS 637 N 0.00 0.13 0.00 5.31 1.79 -1.39 -3.50 116.57 118.92 3h3v h LYS 637 Ca 0.00 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 3h3v h LYS 637 Cb 0.00 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 3h3v h LYS 637 CO 0.00 0.39 0.00 0.41 -1.08 0.00 0.00 179.45 179.17 3h3v n GLY 638 N -0.65 0.87 0.08 3.86 0.00 -0.72 -4.72 105.19 103.91 3h3v n GLY 638 Ca -0.01 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 43.91 3h3v n GLY 638 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h3v h PRO 639 N 7.85 0.00 -0.31 1.61 0.13 -1.83 -3.18 132.00 136.26 3h3v h PRO 639 Ca 0.00 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.21 3h3v h PRO 639 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 3h3v h PRO 639 CO 0.00 0.29 0.22 1.96 -0.23 0.00 0.00 178.00 180.24 3h3v h GLN 640 N -1.00 0.07 0.49 0.86 1.08 -1.93 0.21 115.11 114.89 3h3v h GLN 640 Ca -0.09 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.08 3h3v h GLN 640 Cb 0.67 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 3h3v h GLN 640 CO -0.05 0.05 -0.24 0.28 -0.95 0.00 0.00 178.83 177.92 3h3v h VAL 641 N 0.07 0.00 -0.75 -0.54 2.07 -1.85 -2.51 116.25 112.74 3h3v h VAL 641 Ca 0.15 -0.27 0.06 0.00 0.82 0.00 0.00 66.70 67.45 3h3v h VAL 641 Cb 0.49 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.20 3h3v h VAL 641 CO -0.01 0.00 0.45 0.00 0.02 0.00 0.00 177.57 178.03 3h3v h ALA 643 N 1.37 -0.10 -0.10 0.00 0.00 -0.59 -0.19 119.26 119.64 3h3v h ALA 643 Ca 0.33 0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.44 3h3v h ALA 643 Cb 0.16 0.95 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3h3v h ALA 643 CO -0.17 -0.73 -0.03 -0.22 0.00 0.00 0.00 179.25 178.10 3h3v h LYS 644 N -0.12 -0.01 -0.89 0.00 3.64 -0.87 -2.81 116.57 115.50 3h3v h LYS 644 Ca 0.25 0.00 0.25 0.00 -1.27 0.00 0.00 60.65 59.87 3h3v h LYS 644 Cb 0.56 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.22 3h3v h LYS 644 CO -0.79 -0.01 0.02 -0.11 -2.27 0.00 0.00 179.45 176.29 3h3v n LEU 645 N -5.15 -0.10 -0.22 5.20 7.94 -0.11 0.15 117.00 124.71 3h3v n LEU 645 Ca -0.05 1.52 0.01 0.00 -1.11 0.00 0.00 56.01 56.38 3h3v n LEU 645 Cb 0.09 -0.55 0.10 0.00 0.53 0.00 0.00 43.42 43.58 3h3v n LEU 645 CO 0.28 -1.54 0.79 -0.26 -1.11 0.00 0.00 177.39 175.56 3h3v h PHE 646 N 0.00 -0.16 0.42 1.96 -1.00 -1.21 0.73 116.94 117.69 3h3v h PHE 646 Ca 0.54 0.05 -0.02 0.00 2.81 0.00 0.00 57.97 61.35 3h3v h PHE 646 Cb 1.12 0.17 0.00 0.00 3.61 0.00 0.00 35.95 40.85 3h3v h PHE 646 CO -0.45 -0.22 -0.20 0.78 -1.61 0.00 0.00 178.31 176.60 3h3v h GLY 647 N 0.07 -0.60 0.06 -1.45 0.00 0.13 -1.96 103.07 99.33 3h3v h GLY 647 Ca 0.33 0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.89 3h3v h GLY 647 CO -0.60 -0.22 -0.18 3.43 0.00 0.00 0.00 176.54 178.97 3h3v h ASN 648 N -0.70 -0.54 -0.89 0.19 2.35 -0.87 0.36 115.58 115.47 3h3v h ASN 648 Ca -0.06 0.06 0.15 0.00 -0.55 0.00 0.00 56.30 55.90 3h3v h ASN 648 Cb 0.51 0.20 -0.15 0.00 0.05 0.00 0.00 38.32 38.92 3h3v h ASN 648 CO 0.10 -0.20 -0.31 -0.38 -1.65 0.00 0.00 177.43 174.99 3h3v n ILE 649 N -3.48 -0.44 0.14 2.81 5.41 0.19 -1.28 119.36 122.72 3h3v n ILE 649 Ca -0.03 2.08 -0.07 0.00 1.00 0.00 0.00 62.75 65.72 3h3v n ILE 649 Cb 0.15 -2.78 -0.04 0.00 -0.71 0.00 0.00 39.64 36.25 3h3v n ILE 649 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 3h3v h GLN 650 N 0.00 -0.41 -0.98 0.38 4.20 -0.53 -1.05 115.11 116.73 3h3v h GLN 650 Ca 0.35 0.03 0.32 0.00 0.06 0.00 0.00 58.65 59.40 3h3v h GLN 650 Cb 0.57 0.09 -0.18 0.00 0.30 0.00 0.00 27.48 28.26 3h3v h GLN 650 CO -0.90 -0.27 0.18 1.63 -0.67 0.00 0.00 178.83 178.80 3h3v n LYS 651 N -3.47 -0.07 0.00 1.46 5.02 0.12 0.85 118.16 122.06 3h3v n LYS 651 Ca -0.05 1.43 0.00 0.00 -2.02 0.00 0.00 58.31 57.67 3h3v n LYS 651 Cb 0.18 -2.37 0.00 0.00 -0.02 0.00 0.00 35.03 32.83 3h3v n LYS 651 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3h3v n VAL 652 N -5.39 0.00 -0.26 -0.18 0.31 -0.58 -1.83 118.33 110.40 3h3v n VAL 652 Ca 0.28 0.87 0.03 0.00 -0.01 0.00 0.00 64.34 65.50 3h3v n VAL 652 Cb 0.92 -1.76 0.11 0.00 -0.91 0.00 0.00 33.84 32.20 3h3v n VAL 652 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3h3v h VAL 653 N 0.00 0.26 -0.05 2.52 2.07 -0.84 0.15 116.25 120.37 3h3v h VAL 653 Ca 0.00 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.55 3h3v h VAL 653 Cb 0.00 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 29.95 3h3v h VAL 653 CO 0.00 0.00 -0.29 0.78 0.02 0.00 0.00 177.57 178.09 3h3v h ASN 654 N 0.02 -0.86 -0.71 0.57 2.35 0.33 0.34 115.58 117.63 3h3v h ASN 654 Ca 0.38 0.12 0.12 0.00 -0.55 0.00 0.00 56.30 56.37 3h3v h ASN 654 Cb 0.61 0.36 -0.05 0.00 0.05 0.00 0.00 38.32 39.30 3h3v h ASN 654 CO -0.75 -0.34 0.47 0.15 -1.65 0.00 0.00 177.43 175.30 3h3v h PHE 655 N -0.41 0.52 0.24 1.19 3.57 -0.26 0.15 116.94 121.95 3h3v h PHE 655 Ca 0.08 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 3h3v h PHE 655 Cb 0.51 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.09 3h3v h PHE 655 CO -0.34 0.22 -0.12 2.35 -2.23 0.00 0.00 178.31 178.20 3h3v h TRP 656 N 0.47 -0.30 -0.30 0.41 7.01 0.19 -3.15 115.95 120.27 3h3v h TRP 656 Ca 0.34 -0.01 0.09 0.00 2.11 0.00 0.00 58.89 61.42 3h3v h TRP 656 Cb 0.67 0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.82 3h3v h TRP 656 CO -0.00 -0.17 0.49 1.25 -2.79 0.00 0.00 178.44 177.21 3h3v h LEU 657 N -1.08 0.00 -0.10 0.65 5.85 -0.13 0.20 115.31 120.70 3h3v h LEU 657 Ca -0.03 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 3h3v h LEU 657 Cb 0.27 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 3h3v h LEU 657 CO 0.05 0.00 0.05 0.25 -0.34 0.00 0.00 178.44 178.45 3h3v h LEU 658 N 0.00 0.12 0.06 2.25 5.85 -0.67 -0.43 115.31 122.50 3h3v h LEU 658 Ca 0.14 -0.11 -0.17 0.00 0.84 0.00 0.00 57.88 58.58 3h3v h LEU 658 Cb 1.11 -0.03 0.02 0.00 0.37 0.00 0.00 40.66 42.13 3h3v h LEU 658 CO -0.00 0.20 -0.71 0.45 -0.34 0.00 0.00 178.44 178.04 3h3v h HIS 659 N 0.04 0.59 0.00 1.25 3.86 -0.72 -3.25 115.15 116.92 3h3v h HIS 659 Ca 0.03 -0.37 -0.00 0.00 -1.16 0.00 0.00 60.37 58.88 3h3v h HIS 659 Cb 0.11 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 28.53 3h3v h HIS 659 CO -0.03 1.22 -0.00 -0.97 0.86 0.00 0.00 177.93 179.01 3h3v h ASN 660 N -0.20 0.00 -3.14 2.45 -1.24 -1.07 -3.49 115.58 108.90 3h3v h ASN 660 Ca -0.11 0.00 0.31 0.00 0.71 0.00 0.00 56.30 57.21 3h3v h ASN 660 Cb 1.47 0.00 -0.15 0.00 0.73 0.00 0.00 38.32 40.36 3h3v h ASN 660 CO 0.14 0.00 -0.99 0.61 -1.29 0.00 0.00 177.43 175.90 3h3v n GLY 661 N -0.40 -2.63 3.60 1.57 0.00 -0.17 -5.04 105.19 102.10 3h3v n GLY 661 Ca -0.01 -0.88 -0.08 0.00 0.00 0.00 0.00 46.02 45.06 3h3v n GLY 661 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3h3v s PHE 662 N -4.02 -0.32 0.00 1.61 5.36 -1.26 -4.99 117.98 114.35 3h3v s PHE 662 Ca 0.00 0.07 0.00 0.00 -0.96 0.00 0.00 56.93 56.04 3h3v s PHE 662 Cb 0.00 0.59 0.00 0.00 -0.34 0.00 0.00 43.02 43.27 3h3v s PHE 662 CO 0.00 -0.78 0.00 0.45 -1.46 0.00 0.00 175.22 173.43 3h3v n SER 663 N -0.36 0.00 -3.55 6.13 2.88 -1.26 -5.18 113.62 112.28 3h3v n SER 663 Ca -0.09 -0.82 -0.16 0.00 -1.33 0.00 0.00 58.87 56.47 3h3v n SER 663 Cb 0.62 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.02 3h3v n SER 663 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3h3v s THR 664 N -2.13 0.00 0.11 2.46 2.01 -1.26 -4.71 115.64 112.12 3h3v s THR 664 Ca 0.00 0.00 -0.25 0.00 0.31 0.00 0.00 61.69 61.75 3h3v s THR 664 Cb 0.00 -1.00 0.07 0.00 0.01 0.00 0.00 72.50 71.58 3h3v s THR 664 CO 0.00 0.00 0.77 -0.83 -0.69 0.00 0.00 174.62 173.87 3h3v s GLY 665 N -0.98 -0.44 0.43 4.40 0.00 -1.26 -5.03 107.32 104.45 3h3v s GLY 665 Ca -0.08 0.53 0.20 0.00 0.00 0.00 0.00 44.72 45.37 3h3v s GLY 665 CO 0.07 0.17 0.95 0.29 0.00 0.00 0.00 173.10 174.57 3h3v n ILE 666 N -0.35 0.00 0.19 0.90 -6.64 -1.26 0.63 119.36 112.83 3h3v n ILE 666 Ca -0.11 0.92 0.05 0.00 -1.77 0.00 0.00 62.75 61.84 3h3v n ILE 666 Cb 0.62 -1.64 0.47 0.00 -1.44 0.00 0.00 39.64 37.66 3h3v n ILE 666 CO 0.00 0.00 0.00 1.23 -1.77 0.00 0.00 176.55 176.01 3h3v h GLY 667 N 0.00 0.07 1.61 3.28 0.00 -1.97 -0.48 103.07 105.58 3h3v h GLY 667 Ca 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.67 3h3v h GLY 667 CO -0.00 0.04 0.00 1.22 0.00 0.00 0.00 176.54 177.79 3h3v n ASP 668 N -4.31 0.00 -0.95 0.19 8.00 0.20 -3.07 116.55 116.60 3h3v n ASP 668 Ca -0.02 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.56 3h3v n ASP 668 Cb 0.25 -0.31 0.26 0.00 -0.02 0.00 0.00 41.12 41.30 3h3v n ASP 668 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3h3v n THR 669 N -1.31 2.10 -5.19 -3.53 -2.24 -0.19 -4.82 114.28 99.10 3h3v n THR 669 Ca 0.11 -1.67 -0.32 0.00 -2.27 0.00 0.00 64.05 59.89 3h3v n THR 669 Cb 0.20 -0.12 -0.17 0.00 -2.10 0.00 0.00 70.33 68.15 3h3v n THR 669 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3h3v s ILE 670 N -2.49 2.15 0.04 2.28 1.01 -1.18 -4.37 121.20 118.65 3h3v s ILE 670 Ca 0.40 -1.00 -0.14 0.00 0.00 0.00 0.00 60.65 59.92 3h3v s ILE 670 Cb 0.31 -1.82 -0.06 0.00 0.01 0.00 0.00 42.46 40.91 3h3v s ILE 670 CO 0.11 0.56 0.43 0.00 0.00 0.00 0.00 174.94 176.04 3h3v s ALA 671 N 0.22 3.68 0.07 9.38 0.00 -1.26 -5.02 121.76 128.83 3h3v s ALA 671 Ca -0.15 -0.23 -0.26 0.00 0.00 0.00 0.00 51.96 51.32 3h3v s ALA 671 Cb -0.17 -2.39 -0.14 0.00 0.00 0.00 0.00 23.12 20.42 3h3v s ALA 671 CO 0.07 0.49 0.62 -3.47 0.00 0.00 0.00 175.76 173.48 3h3v n ASP 672 N 1.47 -0.42 -0.03 0.00 2.03 -1.26 -4.53 116.55 113.81 3h3v n ASP 672 Ca -0.11 0.86 -0.01 0.00 0.52 0.00 0.00 54.79 56.05 3h3v n ASP 672 Cb 0.52 -0.70 -0.01 0.00 -0.72 0.00 0.00 41.12 40.21 3h3v n ASP 672 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h3v n GLY 673 N 1.30 -1.05 0.20 0.27 0.00 -1.26 -0.86 105.19 103.79 3h3v n GLY 673 Ca 0.14 0.25 -0.11 0.00 0.00 0.00 0.00 46.02 46.30 3h3v n GLY 673 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h3v h PRO 674 N 0.00 0.54 -0.48 1.61 0.13 -2.01 -3.15 132.00 128.65 3h3v h PRO 674 Ca 0.01 -0.39 0.14 0.00 -0.87 0.00 0.00 66.00 64.89 3h3v h PRO 674 Cb 0.03 0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.20 3h3v h PRO 674 CO -0.07 1.01 0.53 1.15 -0.23 0.00 0.00 178.00 180.40 3h3v h THR 675 N 0.40 0.32 0.50 1.56 2.02 -1.31 0.19 112.91 116.58 3h3v h THR 675 Ca -0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3h3v h THR 675 Cb 1.21 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 3h3v h THR 675 CO 0.12 0.00 -0.24 0.24 0.37 0.00 0.00 175.52 176.01 3h3v h MET 676 N 0.00 -0.64 -0.49 6.66 2.86 -1.33 -3.00 114.93 118.98 3h3v h MET 676 Ca 0.23 0.04 0.09 0.00 -2.06 0.00 0.00 59.70 58.00 3h3v h MET 676 Cb 1.29 0.15 -0.07 0.00 0.06 0.00 0.00 31.60 33.02 3h3v h MET 676 CO -0.00 -0.41 0.06 -0.09 1.06 0.00 0.00 176.91 177.53 3h3v h ARG 677 N -1.16 0.18 -1.20 1.72 2.43 -1.15 0.13 114.38 115.32 3h3v h ARG 677 Ca -0.07 -0.01 0.35 0.00 -0.81 0.00 0.00 59.98 59.44 3h3v h ARG 677 Cb 0.53 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.99 3h3v h ARG 677 CO 0.11 0.12 0.86 1.49 -1.51 0.00 0.00 179.97 181.03 3h3v h GLU 678 N 0.18 0.03 0.16 0.20 4.81 -0.76 0.20 114.58 119.40 3h3v h GLU 678 Ca 0.25 -0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 59.15 3h3v h GLU 678 Cb 0.35 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.73 3h3v h GLU 678 CO -0.36 0.02 -1.64 0.82 -0.73 0.00 0.00 179.01 177.11 3h3v h ILE 679 N 0.03 0.96 -0.39 2.32 2.04 -0.65 -2.95 117.51 118.87 3h3v h ILE 679 Ca 0.58 -2.47 0.11 0.00 1.00 0.00 0.00 64.86 64.08 3h3v h ILE 679 Cb 2.26 2.74 -0.02 0.00 -0.74 0.00 0.00 36.82 41.07 3h3v h ILE 679 CO -0.03 0.81 0.33 0.74 0.00 0.00 0.00 178.15 180.00 3h3v h THR 680 N -0.03 0.61 0.00 -0.27 2.02 0.53 0.68 112.91 116.46 3h3v h THR 680 Ca -0.33 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 3h3v h THR 680 Cb 1.98 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 69.15 3h3v h THR 680 CO 0.14 0.00 -1.11 -1.84 0.37 0.00 0.00 175.52 173.07 3h3v n GLU 681 N -4.11 0.61 0.07 6.66 0.28 -0.69 -1.44 120.64 122.02 3h3v n GLU 681 Ca 0.07 0.12 -0.04 0.00 -0.16 0.00 0.00 57.16 57.14 3h3v n GLU 681 Cb 0.51 -1.81 0.18 0.00 1.43 0.00 0.00 31.44 31.76 3h3v n GLU 681 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 177.13 178.12 3h3v h THR 682 N 0.00 1.31 0.09 3.84 2.02 0.45 -1.77 112.91 118.86 3h3v h THR 682 Ca -0.02 -1.57 -0.00 0.00 0.77 0.00 0.00 66.41 65.58 3h3v h THR 682 Cb 1.07 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 3h3v h THR 682 CO 0.01 0.48 -0.04 0.40 0.37 0.00 0.00 175.52 176.73 3h3v h ILE 683 N 0.27 0.00 -0.74 3.11 2.04 -0.98 -3.17 117.51 118.04 3h3v h ILE 683 Ca 0.02 -0.87 0.11 0.00 1.00 0.00 0.00 64.86 65.13 3h3v h ILE 683 Cb 0.86 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.82 3h3v h ILE 683 CO 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 178.15 177.93 3h3v n ALA 684 N -2.74 -0.10 -0.21 1.87 0.00 -0.52 0.70 120.51 119.51 3h3v n ALA 684 Ca -0.02 0.74 -0.08 0.00 0.00 0.00 0.00 53.44 54.08 3h3v n ALA 684 Cb 0.05 -0.33 0.04 0.00 0.00 0.00 0.00 19.45 19.21 3h3v n ALA 684 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3h3v h GLU 685 N 0.00 1.07 -0.06 0.00 4.11 -1.47 -1.27 114.58 116.96 3h3v h GLU 685 Ca 0.26 -0.32 -0.02 0.00 0.07 0.00 0.00 59.36 59.34 3h3v h GLU 685 Cb 0.44 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3h3v h GLU 685 CO -0.73 1.03 -0.06 0.00 0.07 0.00 0.00 179.01 179.32 3h3v h ALA 686 N 1.03 1.80 -0.34 1.06 0.00 0.30 0.15 119.26 123.26 3h3v h ALA 686 Ca 0.18 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3h3v h ALA 686 Cb 0.52 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3h3v h ALA 686 CO 0.03 0.16 0.03 0.87 0.00 0.00 0.00 179.25 180.33 3h3v h LYS 687 N 0.09 0.57 0.00 0.00 1.57 0.68 -2.59 116.57 116.89 3h3v h LYS 687 Ca 0.02 -0.17 -0.08 0.00 -1.87 0.00 0.00 60.65 58.56 3h3v h LYS 687 Cb 0.16 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 3h3v h LYS 687 CO 0.01 0.67 -0.37 -0.22 -0.57 0.00 0.00 179.45 178.97 3h3v h LYS 688 N 0.39 0.00 0.00 3.15 3.64 -0.28 0.95 116.57 124.42 3h3v h LYS 688 Ca 0.10 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3h3v h LYS 688 Cb 0.39 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3h3v h LYS 688 CO 0.01 0.37 -0.10 -0.22 -2.27 0.00 0.00 179.45 177.23 3h3v h LYS 689 N 0.00 0.00 0.01 1.90 3.64 -0.46 -0.45 116.57 121.21 3h3v h LYS 689 Ca -0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 3h3v h LYS 689 Cb 0.70 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.51 3h3v h LYS 689 CO 0.05 0.10 -0.52 0.28 -2.27 0.00 0.00 179.45 177.09 3h3v h VAL 690 N 0.00 1.45 -0.78 2.00 2.07 -0.75 -3.04 116.25 117.20 3h3v h VAL 690 Ca -0.00 -2.29 0.18 0.00 0.82 0.00 0.00 66.70 65.41 3h3v h VAL 690 Cb 0.46 2.94 -0.13 0.00 -1.52 0.00 0.00 31.29 33.05 3h3v h VAL 690 CO 0.01 0.51 0.14 0.25 0.02 0.00 0.00 177.57 178.50 3h3v h LEU 691 N -0.96 -0.11 0.00 2.57 5.85 -0.51 0.03 115.31 122.18 3h3v h LEU 691 Ca -0.14 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3h3v h LEU 691 Cb 1.15 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.44 3h3v h LEU 691 CO -0.07 -0.12 0.00 0.47 -0.34 0.00 0.00 178.44 178.38 3h3v n ASP 692 N -5.24 0.00 0.26 1.25 9.92 -0.21 -1.52 116.55 121.01 3h3v n ASP 692 Ca 0.16 0.83 0.11 0.00 -0.53 0.00 0.00 54.79 55.36 3h3v n ASP 692 Cb 0.52 -0.33 0.57 0.00 -0.64 0.00 0.00 41.12 41.24 3h3v n ASP 692 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 3h3v h VAL 693 N 0.00 0.00 0.03 2.53 2.07 -1.39 0.42 116.25 119.92 3h3v h VAL 693 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3h3v h VAL 693 Cb 0.00 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 3h3v h VAL 693 CO 0.00 0.00 -0.02 0.74 0.02 0.00 0.00 177.57 178.31 3h3v h THR 694 N 0.00 1.35 -0.05 2.57 2.02 -0.71 -2.85 112.91 115.25 3h3v h THR 694 Ca 0.00 -1.76 -0.15 0.00 0.77 0.00 0.00 66.41 65.27 3h3v h THR 694 Cb 0.73 2.44 -0.01 0.00 -1.74 0.00 0.00 68.15 69.57 3h3v h THR 694 CO 0.00 0.41 -0.66 0.11 0.37 0.00 0.00 175.52 175.75 3h3v h LYS 695 N -0.88 0.19 0.00 6.66 1.57 0.17 -1.68 116.57 122.61 3h3v h LYS 695 Ca -0.00 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3h3v h LYS 695 Cb 0.71 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.05 3h3v h LYS 695 CO 0.01 0.78 0.00 -1.91 -0.57 0.00 0.00 179.45 177.76 3h3v n GLU 696 N -3.82 0.14 -0.02 3.15 2.13 0.13 -1.26 120.64 121.09 3h3v n GLU 696 Ca -0.02 0.44 0.07 0.00 0.66 0.00 0.00 57.16 58.31 3h3v n GLU 696 Cb 0.65 -1.81 -0.15 0.00 0.27 0.00 0.00 31.44 30.40 3h3v n GLU 696 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h3v n ALA 697 N -1.72 2.55 0.64 4.31 0.00 -0.97 -3.37 120.51 121.96 3h3v n ALA 697 Ca 0.02 -0.59 0.03 0.00 0.00 0.00 0.00 53.44 52.90 3h3v n ALA 697 Cb 0.17 -0.59 0.13 0.00 0.00 0.00 0.00 19.45 19.15 3h3v n ALA 697 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3h3v n GLN 698 N -2.27 2.06 0.00 0.00 6.02 -0.39 -2.91 117.38 119.89 3h3v n GLN 698 Ca -0.08 -0.99 0.00 0.00 -0.01 0.00 0.00 57.00 55.93 3h3v n GLN 698 Cb 0.61 -1.58 0.00 0.00 1.02 0.00 0.00 30.24 30.29 3h3v n GLN 698 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3h3v n ALA 699 N 0.21 1.95 -1.54 -1.58 0.00 -1.12 -4.98 120.51 113.45 3h3v n ALA 699 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.52 3h3v n ALA 699 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.90 3h3v n ALA 699 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h3v n ASN 700 N -1.06 -2.13 -1.75 0.00 5.15 -1.15 -4.96 115.26 109.37 3h3v n ASN 700 Ca 0.00 0.01 -0.05 0.00 -0.60 0.00 0.00 54.58 53.94 3h3v n ASN 700 Cb 0.00 -0.69 0.27 0.00 -0.53 0.00 0.00 39.78 38.83 3h3v n ASN 700 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3h3v n LEU 701 N -0.12 5.57 -4.16 1.20 4.77 -1.22 -4.94 117.00 118.10 3h3v n LEU 701 Ca -0.01 -3.31 -0.32 0.00 -0.03 0.00 0.00 56.01 52.34 3h3v n LEU 701 Cb 0.28 -0.71 -0.17 0.00 -2.33 0.00 0.00 43.42 40.49 3h3v n LEU 701 CO 0.01 0.88 -0.54 -0.76 -1.33 0.00 0.00 177.39 175.65 3h3v s LEU 702 N -3.04 2.06 -0.01 2.23 1.43 -1.25 -4.94 118.68 115.16 3h3v s LEU 702 Ca 0.52 -0.58 -0.30 0.00 -1.03 0.00 0.00 54.13 52.74 3h3v s LEU 702 Cb 0.43 -1.40 -0.06 0.00 0.03 0.00 0.00 46.19 45.19 3h3v s LEU 702 CO 0.11 0.08 1.48 -0.89 0.23 0.00 0.00 176.35 177.36 3h3v s THR 703 N 0.76 3.61 -0.08 5.49 2.01 -1.26 -4.97 115.64 121.20 3h3v s THR 703 Ca -0.09 0.95 -0.30 0.00 0.31 0.00 0.00 61.69 62.56 3h3v s THR 703 Cb -0.16 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 3h3v s THR 703 CO -0.00 -0.02 1.48 0.00 -0.69 0.00 0.00 174.62 175.38 3h3v s ALA 704 N 2.84 3.63 -0.26 7.40 0.00 -1.26 -4.95 121.76 129.16 3h3v s ALA 704 Ca 0.67 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 53.11 3h3v s ALA 704 Cb -0.32 -3.68 -0.02 0.00 0.00 0.00 0.00 23.12 19.10 3h3v s ALA 704 CO 0.27 -1.24 1.51 0.15 0.00 0.00 0.00 175.76 176.45 3h3v s LYS 705 N 3.56 3.81 0.00 0.00 1.02 -1.26 -4.83 119.74 122.03 3h3v s LYS 705 Ca 0.65 1.48 0.00 0.00 0.02 0.00 0.00 55.97 58.13 3h3v s LYS 705 Cb -0.29 -3.99 0.00 0.00 -0.52 0.00 0.00 37.83 33.03 3h3v s LYS 705 CO 0.24 -1.27 0.00 1.58 -0.92 0.00 0.00 175.35 174.98 3h3v n HIS 706 N 8.25 0.00 -0.41 3.18 -0.00 -1.26 -1.38 115.22 123.60 3h3v n HIS 706 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.89 3h3v n HIS 706 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.45 3h3v n HIS 706 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3h3v n GLY 707 N 0.00 1.19 3.46 1.57 0.00 -1.26 -5.03 105.19 105.12 3h3v n GLY 707 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3h3v n GLY 707 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h3v s MET 708 N -0.37 2.04 0.94 1.61 1.00 -0.48 -5.09 119.30 118.94 3h3v s MET 708 Ca 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 55.69 54.58 3h3v s MET 708 Cb 0.00 -2.17 0.15 0.00 0.00 0.00 0.00 34.83 32.81 3h3v s MET 708 CO 0.00 0.53 1.09 2.41 0.00 0.00 0.00 175.02 179.05 3h3v n THR 709 N 1.49 0.00 -0.19 2.05 -1.04 -1.26 -4.51 114.28 110.82 3h3v n THR 709 Ca -0.16 -0.04 -0.08 0.00 -2.04 0.00 0.00 64.05 61.73 3h3v n THR 709 Cb 0.52 -0.97 0.02 0.00 -1.82 0.00 0.00 70.33 68.08 3h3v n THR 709 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3h3v h LEU 710 N -1.94 0.73 0.12 -4.42 4.07 -1.97 -0.95 115.31 110.96 3h3v h LEU 710 Ca -0.44 -0.16 -0.00 0.00 0.08 0.00 0.00 57.88 57.35 3h3v h LEU 710 Cb 1.27 -0.19 -0.00 0.00 1.08 0.00 0.00 40.66 42.82 3h3v h LEU 710 CO 0.41 0.69 -0.11 -0.09 -1.08 0.00 0.00 178.44 178.26 3h3v h ARG 711 N 0.72 -0.22 -0.90 1.13 9.65 -2.00 -1.84 114.38 120.93 3h3v h ARG 711 Ca 0.18 0.02 0.15 0.00 -1.10 0.00 0.00 59.98 59.22 3h3v h ARG 711 Cb 0.18 0.05 -0.15 0.00 -1.39 0.00 0.00 29.97 28.66 3h3v h ARG 711 CO -0.02 -0.15 -0.35 0.93 2.80 0.00 0.00 179.97 183.18 3h3v h GLU 712 N -0.23 -0.03 -0.10 0.20 5.08 -1.88 1.42 114.58 119.03 3h3v h GLU 712 Ca -0.02 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3h3v h GLU 712 Cb 0.20 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 3h3v h GLU 712 CO -0.01 -0.02 0.11 0.77 -1.00 0.00 0.00 179.01 178.86 3h3v h SER 713 N -0.04 0.00 0.33 1.42 0.02 -1.09 -0.35 113.55 113.85 3h3v h SER 713 Ca 0.34 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.27 3h3v h SER 713 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 3h3v h SER 713 CO -0.92 0.00 -0.16 0.15 -1.14 0.00 0.00 176.83 174.77 3h3v h PHE 714 N 0.00 -0.41 -0.70 3.45 3.57 0.28 -3.10 116.94 120.02 3h3v h PHE 714 Ca 0.05 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.69 3h3v h PHE 714 Cb 0.27 0.14 -0.13 0.00 2.79 0.00 0.00 35.95 39.02 3h3v h PHE 714 CO 0.00 -0.26 -0.10 0.93 -2.23 0.00 0.00 178.31 176.66 3h3v h GLU 715 N -1.05 0.04 -0.34 1.11 4.39 -0.84 -2.04 114.58 115.86 3h3v h GLU 715 Ca -0.05 -0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.69 3h3v h GLU 715 Cb 0.34 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.93 3h3v h GLU 715 CO 0.07 0.03 -0.32 0.22 -1.16 0.00 0.00 179.01 177.85 3h3v h ASP 716 N 0.04 -1.11 -0.22 1.42 1.82 -1.14 -1.05 116.42 116.18 3h3v h ASP 716 Ca 0.36 0.15 0.06 0.00 -0.39 0.00 0.00 57.03 57.21 3h3v h ASP 716 Cb 0.58 0.47 -0.06 0.00 0.68 0.00 0.00 39.33 41.00 3h3v h ASP 716 CO -0.68 -0.20 -0.18 0.78 -1.61 0.00 0.00 179.24 177.36 3h3v h ASN 717 N -0.15 -0.57 0.00 2.28 2.35 -1.34 -2.76 115.58 115.39 3h3v h ASN 717 Ca 0.06 0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3h3v h ASN 717 Cb 0.30 0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.96 3h3v h ASN 717 CO -0.40 -0.22 0.00 0.52 -1.65 0.00 0.00 177.43 175.68 3h3v n VAL 718 N -5.33 0.00 0.00 2.81 0.31 -0.53 -1.99 118.33 113.59 3h3v n VAL 718 Ca -0.01 1.07 0.00 0.00 -0.01 0.00 0.00 64.34 65.39 3h3v n VAL 718 Cb 0.24 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 3h3v n VAL 718 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3h3v n VAL 719 N -1.44 0.00 -0.20 2.52 0.31 -0.51 0.13 118.33 119.14 3h3v n VAL 719 Ca 0.00 0.91 0.18 0.00 -0.01 0.00 0.00 64.34 65.42 3h3v n VAL 719 Cb 0.00 -1.27 0.32 0.00 -0.91 0.00 0.00 33.84 31.98 3h3v n VAL 719 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3h3v n ARG 720 N -1.78 -0.03 0.02 5.55 1.74 -1.05 0.65 116.66 121.78 3h3v n ARG 720 Ca 0.00 0.68 -0.13 0.00 -0.77 0.00 0.00 57.85 57.63 3h3v n ARG 720 Cb 0.00 -1.27 -0.09 0.00 -1.02 0.00 0.00 32.46 30.08 3h3v n ARG 720 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 3h3v h PHE 721 N 0.00 -0.07 0.73 -1.55 0.05 0.33 -2.18 116.94 114.25 3h3v h PHE 721 Ca 0.44 -0.00 -0.03 0.00 3.82 0.00 0.00 57.97 62.20 3h3v h PHE 721 Cb 1.28 0.02 -0.00 0.00 2.00 0.00 0.00 35.95 39.25 3h3v h PHE 721 CO -0.00 0.33 -0.44 -0.07 -0.18 0.00 0.00 178.31 177.94 3h3v h LEU 722 N -0.50 -1.10 -0.11 1.54 4.07 0.38 0.07 115.31 119.67 3h3v h LEU 722 Ca -0.01 0.06 0.04 0.00 0.08 0.00 0.00 57.88 58.05 3h3v h LEU 722 Cb 0.44 0.32 -0.06 0.00 1.08 0.00 0.00 40.66 42.43 3h3v h LEU 722 CO 0.01 -0.69 -0.39 0.78 -1.08 0.00 0.00 178.44 177.07 3h3v h ASN 723 N -1.10 -1.22 -0.97 -0.43 2.35 -1.61 1.86 115.58 114.45 3h3v h ASN 723 Ca -0.10 0.16 0.25 0.00 -0.55 0.00 0.00 56.30 56.06 3h3v h ASN 723 Cb 0.88 0.50 -0.07 0.00 0.05 0.00 0.00 38.32 39.68 3h3v h ASN 723 CO 0.10 -0.42 0.65 -0.08 -1.65 0.00 0.00 177.43 176.04 3h3v h GLU 724 N -0.48 0.28 0.03 0.81 4.81 -1.30 0.92 114.58 119.66 3h3v h GLU 724 Ca 0.08 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 3h3v h GLU 724 Cb 0.61 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.94 3h3v h GLU 724 CO -0.37 0.19 -0.33 0.00 -0.73 0.00 0.00 179.01 177.76 3h3v h ALA 725 N 1.58 -0.00 -0.37 2.92 0.00 0.16 -2.84 119.26 120.71 3h3v h ALA 725 Ca 0.51 -0.53 0.08 0.00 0.00 0.00 0.00 54.91 54.96 3h3v h ALA 725 Cb 1.47 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.21 3h3v h ALA 725 CO -0.17 0.14 -0.14 -0.09 0.00 0.00 0.00 179.25 179.00 3h3v h ARG 726 N -0.58 -0.06 0.78 0.00 2.43 0.54 0.17 114.38 117.66 3h3v h ARG 726 Ca -0.05 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 3h3v h ARG 726 Cb 1.17 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.73 3h3v h ARG 726 CO 0.06 -0.04 -0.48 -0.44 -1.51 0.00 0.00 179.97 177.56 3h3v h ASP 727 N -0.06 -1.21 0.00 -3.80 5.19 0.63 -1.23 116.42 115.94 3h3v h ASP 727 Ca 0.18 0.07 -0.00 0.00 -0.62 0.00 0.00 57.03 56.66 3h3v h ASP 727 Cb 0.34 0.35 -0.00 0.00 0.18 0.00 0.00 39.33 40.20 3h3v h ASP 727 CO -0.41 -0.74 -0.00 0.07 -3.12 0.00 0.00 179.24 175.04 3h3v h LYS 728 N -1.18 0.00 -0.56 3.56 2.10 -1.37 0.20 116.57 119.32 3h3v h LYS 728 Ca -0.11 0.00 0.07 0.00 -2.00 0.00 0.00 60.65 58.62 3h3v h LYS 728 Cb 0.95 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.22 3h3v h LYS 728 CO 0.11 0.00 0.22 0.00 -2.00 0.00 0.00 179.45 177.78 3h3v h ALA 729 N 2.00 0.71 0.46 0.07 0.00 -0.09 0.88 119.26 123.27 3h3v h ALA 729 Ca -0.00 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3h3v h ALA 729 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h3v h ALA 729 CO 0.00 -0.17 -0.22 0.78 0.00 0.00 0.00 179.25 179.64 3h3v h GLY 730 N 0.42 -0.64 -0.85 0.00 0.00 0.35 -3.14 103.07 99.21 3h3v h GLY 730 Ca 0.27 0.24 0.35 0.00 0.00 0.00 0.00 47.33 48.19 3h3v h GLY 730 CO -0.25 -0.23 0.44 -2.13 0.00 0.00 0.00 176.54 174.37 3h3v n ARG 731 N -5.20 -0.05 0.19 4.80 0.63 0.44 0.81 116.66 118.27 3h3v n ARG 731 Ca -0.09 1.18 -0.14 0.00 -0.92 0.00 0.00 57.85 57.87 3h3v n ARG 731 Cb 0.29 -2.11 -0.08 0.00 0.45 0.00 0.00 32.46 31.01 3h3v n ARG 731 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 3h3v h LEU 732 N 0.00 -1.18 -1.29 6.15 3.38 -0.78 -1.96 115.31 119.64 3h3v h LEU 732 Ca 0.72 0.10 0.09 0.00 0.09 0.00 0.00 57.88 58.88 3h3v h LEU 732 Cb 1.88 0.40 -0.06 0.00 0.09 0.00 0.00 40.66 42.98 3h3v h LEU 732 CO -0.66 -0.51 0.54 0.00 0.09 0.00 0.00 178.44 177.90 3h3v h ALA 733 N -0.96 1.69 0.17 1.53 0.00 0.37 -2.70 119.26 119.35 3h3v h ALA 733 Ca -0.04 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.87 3h3v h ALA 733 Cb 0.67 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3h3v h ALA 733 CO -0.11 0.16 -0.51 1.49 0.00 0.00 0.00 179.25 180.27 3h3v h GLU 734 N 0.81 -0.75 -0.56 0.00 4.81 -0.31 0.17 114.58 118.77 3h3v h GLU 734 Ca 0.37 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 3h3v h GLU 734 Cb 0.37 0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3h3v h GLU 734 CO -0.14 -0.50 0.00 0.28 -0.73 0.00 0.00 179.01 177.92 3h3v n VAL 735 N -5.50 0.00 0.21 0.32 0.31 -0.95 -2.31 118.33 110.42 3h3v n VAL 735 Ca -0.09 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.28 3h3v n VAL 735 Cb 0.42 -0.29 -0.05 0.00 -0.91 0.00 0.00 33.84 33.01 3h3v n VAL 735 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3h3v n ASN 736 N -0.19 1.51 -4.61 4.52 2.85 0.44 -4.93 115.26 114.85 3h3v n ASN 736 Ca 0.00 -0.41 -0.41 0.00 -0.11 0.00 0.00 54.58 53.65 3h3v n ASN 736 Cb 0.14 1.14 -0.06 0.00 1.24 0.00 0.00 39.78 42.24 3h3v n ASN 736 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3h3v s LEU 737 N -2.84 4.11 1.10 1.20 1.43 -0.32 -4.81 118.68 118.55 3h3v s LEU 737 Ca 0.01 0.59 -0.15 0.00 -1.03 0.00 0.00 54.13 53.54 3h3v s LEU 737 Cb 0.05 -2.91 0.17 0.00 0.03 0.00 0.00 46.19 43.53 3h3v s LEU 737 CO 0.32 -0.49 0.54 0.29 0.23 0.00 0.00 176.35 177.24 3h3v n LYS 738 N 5.93 -1.66 0.00 1.70 5.02 -1.26 -4.84 118.16 123.06 3h3v n LYS 738 Ca 0.01 -0.45 0.00 0.00 -2.02 0.00 0.00 58.31 55.84 3h3v n LYS 738 Cb 0.49 -1.96 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 3h3v n LYS 738 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3h3v n ASP 739 N -3.11 0.14 -0.00 4.39 9.92 -1.26 -2.20 116.55 124.43 3h3v n ASP 739 Ca 0.03 -1.63 0.04 0.00 -0.53 0.00 0.00 54.79 52.70 3h3v n ASP 739 Cb 0.57 -0.07 -0.05 0.00 -0.64 0.00 0.00 41.12 40.93 3h3v n ASP 739 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3h3v n LEU 740 N -0.40 0.31 -4.64 0.64 -0.00 -1.26 -4.89 117.00 106.76 3h3v n LEU 740 Ca 0.00 -0.38 -0.43 0.00 -0.00 0.00 0.00 56.01 55.20 3h3v n LEU 740 Cb 0.03 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.43 3h3v n LEU 740 CO 0.00 0.08 1.41 0.21 -0.00 0.00 0.00 177.39 179.09 3h3v s ASN 741 N -2.09 6.39 0.13 1.45 3.04 -0.93 -4.90 114.94 118.03 3h3v s ASN 741 Ca 0.02 1.82 -0.27 0.00 0.04 0.00 0.00 52.86 54.47 3h3v s ASN 741 Cb 0.06 -2.53 -0.05 0.00 -1.54 0.00 0.00 41.25 37.20 3h3v s ASN 741 CO 0.35 -1.22 1.60 0.78 -3.04 0.00 0.00 177.10 175.58 3h3v h ASN 742 N 10.71 -1.06 -1.03 -4.21 2.35 -1.90 0.22 115.58 120.66 3h3v h ASN 742 Ca -0.36 0.14 0.28 0.00 -0.55 0.00 0.00 56.30 55.81 3h3v h ASN 742 Cb 1.17 0.43 -0.12 0.00 0.05 0.00 0.00 38.32 39.85 3h3v h ASN 742 CO 0.98 -0.39 0.62 0.58 -1.65 0.00 0.00 177.43 177.57 3h3v h VAL 743 N -0.47 0.45 -0.17 2.81 2.07 -1.87 0.82 116.25 119.89 3h3v h VAL 743 Ca 0.07 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 3h3v h VAL 743 Cb 0.58 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 3h3v h VAL 743 CO -0.32 0.08 -0.19 0.50 0.02 0.00 0.00 177.57 177.66 3h3v h LYS 744 N 0.44 0.42 -0.98 1.57 3.64 -1.46 -2.62 116.57 117.58 3h3v h LYS 744 Ca 0.67 -0.23 0.15 0.00 -1.27 0.00 0.00 60.65 59.97 3h3v h LYS 744 Cb 1.49 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 33.23 3h3v h LYS 744 CO -0.47 0.81 0.62 1.96 -2.27 0.00 0.00 179.45 180.09 3h3v h GLN 745 N 0.06 0.82 0.00 1.90 4.20 0.36 0.82 115.11 123.27 3h3v h GLN 745 Ca 0.02 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3h3v h GLN 745 Cb 0.74 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.34 3h3v h GLN 745 CO 0.05 0.54 0.00 -1.33 -0.67 0.00 0.00 178.83 177.42 3h3v n MET 746 N -4.65 0.21 0.03 1.46 2.81 0.36 -1.11 117.12 116.23 3h3v n MET 746 Ca 0.20 0.27 -0.19 0.00 -1.81 0.00 0.00 57.70 56.17 3h3v n MET 746 Cb 0.46 -1.80 -0.14 0.00 -0.71 0.00 0.00 33.22 31.03 3h3v n MET 746 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3h3v h VAL 747 N 0.00 0.80 -0.23 2.03 2.07 0.54 -2.38 116.25 119.08 3h3v h VAL 747 Ca 0.00 -2.50 -0.10 0.00 0.82 0.00 0.00 66.70 64.92 3h3v h VAL 747 Cb 0.58 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 3h3v h VAL 747 CO 0.00 0.82 -0.29 0.24 0.02 0.00 0.00 177.57 178.36 3h3v h MET 748 N 0.07 0.46 -0.21 1.57 2.07 0.55 -2.66 114.93 116.78 3h3v h MET 748 Ca -0.36 -0.18 -0.20 0.00 -2.07 0.00 0.00 59.70 56.89 3h3v h MET 748 Cb 2.04 -0.02 0.00 0.00 -1.87 0.00 0.00 31.60 31.76 3h3v h MET 748 CO 0.12 0.70 -0.66 0.00 1.07 0.00 0.00 176.91 178.14 3h3v h ALA 749 N 1.30 0.42 -1.16 6.32 0.00 -1.24 -3.47 119.26 121.43 3h3v h ALA 749 Ca 0.05 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3h3v h ALA 749 Cb 0.71 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3h3v h ALA 749 CO 0.05 0.69 0.00 0.41 0.00 0.00 0.00 179.25 180.40 3h3v n GLY 750 N 0.52 0.68 2.59 0.00 0.00 -1.00 -2.63 105.19 105.34 3h3v n GLY 750 Ca -0.06 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 3h3v n GLY 750 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h3v n SER 751 N 0.05 2.57 0.00 1.61 3.41 -0.92 -4.70 113.62 115.65 3h3v n SER 751 Ca 0.00 -2.98 0.00 0.00 -0.26 0.00 0.00 58.87 55.63 3h3v n SER 751 Cb 0.37 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 3h3v n SER 751 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h3v n LYS 752 N -0.27 0.00 0.00 4.33 4.76 -1.25 -4.73 118.16 121.00 3h3v n LYS 752 Ca 0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 3h3v n LYS 752 Cb 0.78 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.97 3h3v n LYS 752 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h3v n GLY 753 N 0.27 -2.00 3.21 0.72 0.00 -1.26 -4.00 105.19 102.13 3h3v n GLY 753 Ca 0.00 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.73 3h3v n GLY 753 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h3v s SER 754 N -1.33 0.22 0.00 1.61 1.04 -1.26 -4.51 113.70 109.46 3h3v s SER 754 Ca 0.00 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.29 3h3v s SER 754 Cb 0.00 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.47 3h3v s SER 754 CO 0.00 -0.79 0.00 0.33 0.98 0.00 0.00 173.24 173.76 3h3v n PHE 755 N -0.15 0.00 -0.27 5.02 7.35 -1.26 -0.46 117.46 127.69 3h3v n PHE 755 Ca -0.05 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.73 3h3v n PHE 755 Cb 0.64 0.00 0.19 0.00 0.35 0.00 0.00 39.48 40.65 3h3v n PHE 755 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 3h3v n ILE 756 N -0.36 -0.32 -0.02 -2.13 2.08 -1.26 -1.87 119.36 115.47 3h3v n ILE 756 Ca 0.00 1.70 -0.05 0.00 0.56 0.00 0.00 62.75 64.96 3h3v n ILE 756 Cb 0.00 -2.44 -0.03 0.00 -0.75 0.00 0.00 39.64 36.42 3h3v n ILE 756 CO 0.00 0.00 0.00 0.78 0.56 0.00 0.00 176.55 177.89 3h3v h ASN 757 N 0.00 -0.57 -0.92 4.38 2.35 -1.18 0.54 115.58 120.18 3h3v h ASN 757 Ca 0.43 0.07 0.24 0.00 -0.55 0.00 0.00 56.30 56.49 3h3v h ASN 757 Cb 0.83 0.23 -0.13 0.00 0.05 0.00 0.00 38.32 39.30 3h3v h ASN 757 CO -0.74 -0.14 0.43 0.40 -1.65 0.00 0.00 177.43 175.73 3h3v h ILE 758 N -0.16 0.45 0.00 2.81 2.04 -1.47 -2.19 117.51 119.00 3h3v h ILE 758 Ca 0.02 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.74 3h3v h ILE 758 Cb 0.20 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 3h3v h ILE 758 CO -0.16 0.07 0.00 0.00 0.00 0.00 0.00 178.15 178.06 3h3v n ALA 759 N -2.46 -0.22 0.00 1.87 0.00 -0.32 -0.01 120.51 119.37 3h3v n ALA 759 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 3h3v n ALA 759 Cb 0.71 0.13 0.00 0.00 0.00 0.00 0.00 19.45 20.28 3h3v n ALA 759 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3h3v n GLN 760 N -1.73 0.00 -0.07 0.00 6.02 0.03 -0.10 117.38 121.53 3h3v n GLN 760 Ca 0.00 0.14 -0.13 0.00 -0.01 0.00 0.00 57.00 57.00 3h3v n GLN 760 Cb 0.00 -1.54 -0.06 0.00 1.02 0.00 0.00 30.24 29.66 3h3v n GLN 760 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3h3v n MET 761 N -1.07 0.34 -0.07 -1.09 2.81 -0.87 -2.23 117.12 114.94 3h3v n MET 761 Ca 0.00 0.11 -0.04 0.00 -1.81 0.00 0.00 57.70 55.96 3h3v n MET 761 Cb 0.04 -1.17 -0.15 0.00 -0.71 0.00 0.00 33.22 31.23 3h3v n MET 761 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3h3v n SER 762 N -3.27 0.26 0.00 7.83 7.64 0.98 -1.89 113.62 125.18 3h3v n SER 762 Ca -0.27 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.61 3h3v n SER 762 Cb 0.74 1.26 0.00 0.00 -1.01 0.00 0.00 64.21 65.20 3h3v n SER 762 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h3v n ALA 763 N -2.57 0.02 -3.09 -0.43 0.00 0.85 -4.65 120.51 110.65 3h3v n ALA 763 Ca -0.23 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.09 3h3v n ALA 763 Cb 0.95 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.29 3h3v n ALA 763 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3v n VAL 765 N 2.53 0.00 0.00 0.00 0.31 -0.24 -3.54 118.33 117.40 3h3v n VAL 765 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 3h3v n VAL 765 Cb 0.58 -0.55 0.00 0.00 -0.91 0.00 0.00 33.84 32.96 3h3v n VAL 765 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h3v n GLY 766 N 0.67 -0.87 3.55 2.92 0.00 -1.07 -4.68 105.19 105.71 3h3v n GLY 766 Ca 0.00 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.58 3h3v n GLY 766 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3h3v s GLN 767 N -2.00 3.20 0.38 1.61 2.00 -1.26 -1.55 119.66 122.04 3h3v s GLN 767 Ca 0.00 -0.41 -0.26 0.00 -2.00 0.00 0.00 55.36 52.68 3h3v s GLN 767 Cb 0.00 -4.64 -0.11 0.00 0.80 0.00 0.00 33.01 29.06 3h3v s GLN 767 CO 0.00 -2.33 1.19 0.94 -0.50 0.00 0.00 175.29 174.59 3h3v n GLN 768 N 9.16 1.81 -3.84 1.67 -0.06 -0.92 -4.96 117.38 120.24 3h3v n GLN 768 Ca 0.17 0.64 -0.09 0.00 -2.00 0.00 0.00 57.00 55.72 3h3v n GLN 768 Cb 0.50 -2.24 -0.07 0.00 -4.06 0.00 0.00 30.24 24.37 3h3v n GLN 768 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 3h3v s SER 769 N -0.51 0.09 -0.01 1.69 1.04 -1.26 -3.91 113.70 110.82 3h3v s SER 769 Ca 0.59 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 56.43 3h3v s SER 769 Cb -0.56 0.34 0.01 0.00 0.10 0.00 0.00 66.02 65.92 3h3v s SER 769 CO 0.59 -0.72 -0.00 -0.69 0.98 0.00 0.00 173.24 173.40 3h3v s VAL 770 N -3.73 0.11 -1.24 5.02 1.01 -1.07 -4.65 120.40 115.84 3h3v s VAL 770 Ca 0.04 0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.92 3h3v s VAL 770 Cb 0.04 -0.16 0.13 0.00 0.00 0.00 0.00 36.38 36.39 3h3v s VAL 770 CO -0.10 0.08 0.43 -0.62 0.00 0.00 0.00 175.10 174.89 3h3v n GLU 771 N 3.64 -2.10 0.00 2.72 1.02 -1.26 -2.63 120.64 122.04 3h3v n GLU 771 Ca -0.21 0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 3h3v n GLU 771 Cb 0.54 -4.79 0.00 0.00 -0.02 0.00 0.00 31.44 27.17 3h3v n GLU 771 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h3v n GLY 772 N -0.96 2.02 3.58 0.62 0.00 -1.26 -5.00 105.19 104.19 3h3v n GLY 772 Ca 0.05 -0.44 -0.48 0.00 0.00 0.00 0.00 46.02 45.16 3h3v n GLY 772 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h3v n LYS 773 N 0.00 1.18 -0.59 1.61 5.02 -1.08 -4.86 118.16 119.44 3h3v n LYS 773 Ca 0.00 0.42 -0.30 0.00 -2.02 0.00 0.00 58.31 56.41 3h3v n LYS 773 Cb 0.00 -1.86 0.21 0.00 -0.02 0.00 0.00 35.03 33.36 3h3v n LYS 773 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3h3v s ARG 774 N -0.73 0.03 0.16 1.97 1.70 -1.26 -2.61 118.95 118.21 3h3v s ARG 774 Ca 0.69 1.25 -0.16 0.00 -0.47 0.00 0.00 55.73 57.03 3h3v s ARG 774 Cb -0.81 -1.63 -0.10 0.00 -0.57 0.00 0.00 34.95 31.83 3h3v s ARG 774 CO 0.54 -3.21 0.25 -0.89 -1.08 0.00 0.00 175.30 170.91 3h3v n ILE 775 N -4.60 1.00 -2.86 4.99 2.08 0.80 -4.77 119.36 115.99 3h3v n ILE 775 Ca 0.08 -0.31 -0.15 0.00 0.56 0.00 0.00 62.75 62.93 3h3v n ILE 775 Cb 0.53 0.00 0.06 0.00 -0.75 0.00 0.00 39.64 39.48 3h3v n ILE 775 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3h3v n ALA 776 N -0.19 0.64 -1.44 -1.39 0.00 -1.26 -4.70 120.51 112.18 3h3v n ALA 776 Ca 0.10 -1.46 -0.33 0.00 0.00 0.00 0.00 53.44 51.76 3h3v n ALA 776 Cb 0.18 0.35 0.05 0.00 0.00 0.00 0.00 19.45 20.03 3h3v n ALA 776 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3h3v n PHE 777 N -2.07 2.73 -0.03 0.00 0.99 -1.26 -4.28 117.46 113.54 3h3v n PHE 777 Ca 0.12 -2.56 0.24 0.00 -0.00 0.00 0.00 57.45 55.24 3h3v n PHE 777 Cb 0.42 -1.30 0.71 0.00 -1.00 0.00 0.00 39.48 38.31 3h3v n PHE 777 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 3h3v h GLY 778 N 2.56 0.00 -7.65 1.37 0.00 -1.82 -3.20 103.07 94.33 3h3v h GLY 778 Ca 0.53 0.00 -0.76 0.00 0.00 0.00 0.00 47.33 47.09 3h3v h GLY 778 CO 1.35 0.00 0.64 -1.36 0.00 0.00 0.00 176.54 177.16 3h3v s PHE 779 N -4.70 3.78 0.00 5.60 2.99 -1.13 -4.90 117.98 119.62 3h3v s PHE 779 Ca -0.04 -2.17 0.00 0.00 0.00 0.00 0.00 56.93 54.71 3h3v s PHE 779 Cb 0.17 -4.02 0.00 0.00 0.00 0.00 0.00 43.02 39.17 3h3v s PHE 779 CO 0.61 -1.15 0.00 0.28 -0.00 0.00 0.00 175.22 174.95 3h3v n VAL 780 N 3.93 0.00 -3.07 -0.44 0.31 -1.21 -0.78 118.33 117.07 3h3v n VAL 780 Ca 0.24 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.39 3h3v n VAL 780 Cb 0.44 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.41 3h3v n VAL 780 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3h3v n ASP 781 N 0.77 -5.26 -3.62 4.52 8.00 -1.25 -4.86 116.55 114.85 3h3v n ASP 781 Ca 0.00 -0.31 0.02 0.00 0.71 0.00 0.00 54.79 55.21 3h3v n ASP 781 Cb 0.00 -4.00 -0.00 0.00 -0.02 0.00 0.00 41.12 37.09 3h3v n ASP 781 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h3v s ARG 782 N -5.70 0.38 0.00 -1.24 1.70 0.04 0.62 118.95 114.76 3h3v s ARG 782 Ca 0.33 -0.21 0.00 0.00 -0.47 0.00 0.00 55.73 55.38 3h3v s ARG 782 Cb -0.15 0.13 0.00 0.00 -0.57 0.00 0.00 34.95 34.36 3h3v s ARG 782 CO 0.41 -0.17 0.04 2.41 -1.08 0.00 0.00 175.30 176.91 3h3v n THR 783 N -0.50 0.00 -3.78 4.99 -1.04 -1.26 -2.82 114.28 109.87 3h3v n THR 783 Ca -0.08 0.08 -0.24 0.00 -2.04 0.00 0.00 64.05 61.76 3h3v n THR 783 Cb 0.63 -0.16 -0.02 0.00 -1.82 0.00 0.00 70.33 68.96 3h3v n THR 783 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3h3v s LEU 784 N -0.88 3.02 0.00 -4.42 1.43 -1.26 -4.10 118.68 112.47 3h3v s LEU 784 Ca 0.00 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.06 3h3v s LEU 784 Cb 0.00 -1.54 0.00 0.00 0.03 0.00 0.00 46.19 44.68 3h3v s LEU 784 CO 0.00 -0.87 0.57 -0.81 0.23 0.00 0.00 176.35 175.47 3h3v n PRO 785 N -1.63 0.78 -0.27 1.29 -0.04 -1.26 -2.65 135.00 131.23 3h3v n PRO 785 Ca 0.01 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.57 3h3v n PRO 785 Cb 0.63 -1.21 0.25 0.00 -0.04 0.00 0.00 33.50 33.13 3h3v n PRO 785 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3h3v n HIS 786 N -0.17 0.71 -4.31 0.54 8.25 -1.26 -4.97 115.22 114.02 3h3v n HIS 786 Ca 0.00 -0.42 -0.20 0.00 -0.26 0.00 0.00 57.72 56.84 3h3v n HIS 786 Cb 0.11 -0.01 -0.11 0.00 1.12 0.00 0.00 29.99 31.10 3h3v n HIS 786 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3h3v s PHE 787 N -1.12 1.68 -0.02 4.41 2.99 -1.08 -5.12 117.98 119.71 3h3v s PHE 787 Ca 0.40 -0.51 -0.25 0.00 0.00 0.00 0.00 56.93 56.57 3h3v s PHE 787 Cb 0.21 -0.84 -0.04 0.00 0.00 0.00 0.00 43.02 42.35 3h3v s PHE 787 CO 0.29 0.28 0.77 -1.12 -0.00 0.00 0.00 175.22 175.43 3h3v s SER 788 N -2.67 7.12 1.03 1.36 0.01 -1.26 -4.93 113.70 114.37 3h3v s SER 788 Ca 0.14 1.35 -0.24 0.00 1.31 0.00 0.00 55.95 58.51 3h3v s SER 788 Cb -0.05 -2.46 -0.10 0.00 0.21 0.00 0.00 66.02 63.63 3h3v s SER 788 CO 0.05 -0.10 -1.05 0.29 0.41 0.00 0.00 173.24 172.85 3h3v n LYS 789 N 3.49 -0.52 -3.06 12.44 5.02 -1.26 -3.14 118.16 131.13 3h3v n LYS 789 Ca -0.00 -0.15 -0.15 0.00 -2.02 0.00 0.00 58.31 55.99 3h3v n LYS 789 Cb 0.51 -1.21 -0.02 0.00 -0.02 0.00 0.00 35.03 34.29 3h3v n LYS 789 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3h3v n ASP 790 N 1.89 -2.20 -4.64 4.39 9.92 0.20 -4.91 116.55 121.20 3h3v n ASP 790 Ca -0.01 -0.07 -0.38 0.00 -0.53 0.00 0.00 54.79 53.80 3h3v n ASP 790 Cb 0.70 -1.93 -0.09 0.00 -0.64 0.00 0.00 41.12 39.16 3h3v n ASP 790 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3h3v s ASP 791 N -2.40 6.27 0.00 -2.24 -1.08 -1.19 -4.94 116.67 111.10 3h3v s ASP 791 Ca 0.24 0.31 0.11 0.00 -0.52 0.00 0.00 52.55 52.70 3h3v s ASP 791 Cb -0.14 -2.19 -0.12 0.00 -1.46 0.00 0.00 42.92 39.01 3h3v s ASP 791 CO 0.30 -0.08 0.50 -1.22 0.52 0.00 0.00 175.17 175.19 3h3v n TYR 792 N 4.76 0.00 -1.05 -5.34 4.02 -1.26 -4.72 117.16 113.58 3h3v n TYR 792 Ca -0.10 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.43 3h3v n TYR 792 Cb 0.51 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.89 3h3v n TYR 792 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3h3v n SER 793 N -1.24 -3.97 -0.23 7.72 3.41 -1.26 -4.43 113.62 113.62 3h3v n SER 793 Ca 0.02 0.36 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 3h3v n SER 793 Cb 0.18 -0.95 0.12 0.00 -0.26 0.00 0.00 64.21 63.30 3h3v n SER 793 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3h3v h PRO 794 N -0.84 0.56 0.00 4.33 0.13 -1.96 -1.53 132.00 132.69 3h3v h PRO 794 Ca -0.44 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3h3v h PRO 794 Cb 1.33 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3h3v h PRO 794 CO 0.32 0.37 0.00 0.39 -0.23 0.00 0.00 178.00 178.85 3h3v n GLU 795 N -4.87 0.04 0.01 0.86 4.71 -1.26 -2.71 120.64 117.42 3h3v n GLU 795 Ca 0.10 0.02 -0.02 0.00 -0.01 0.00 0.00 57.16 57.25 3h3v n GLU 795 Cb 0.25 -1.50 -0.01 0.00 -1.01 0.00 0.00 31.44 29.17 3h3v n GLU 795 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3h3v n SER 796 N -1.02 0.68 0.00 1.62 2.88 -0.61 -4.65 113.62 112.53 3h3v n SER 796 Ca 0.01 0.09 0.01 0.00 -1.33 0.00 0.00 58.87 57.66 3h3v n SER 796 Cb 0.01 -0.22 0.08 0.00 -0.75 0.00 0.00 64.21 63.32 3h3v n SER 796 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3h3v n LYS 797 N -3.35 0.19 -0.77 -1.46 4.76 -1.01 -4.79 118.16 111.73 3h3v n LYS 797 Ca -0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 3h3v n LYS 797 Cb 0.29 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 32.26 3h3v n LYS 797 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h3v n GLY 798 N -0.44 -0.94 2.62 0.72 0.00 -1.14 -0.14 105.19 105.86 3h3v n GLY 798 Ca 0.02 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 3h3v n GLY 798 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3h3v s PHE 799 N -0.21 0.16 -0.45 1.61 5.36 -1.10 -2.15 117.98 121.20 3h3v s PHE 799 Ca 0.00 -0.28 -0.27 0.00 -0.96 0.00 0.00 56.93 55.42 3h3v s PHE 799 Cb 0.00 -0.67 0.03 0.00 -0.34 0.00 0.00 43.02 42.04 3h3v s PHE 799 CO 0.00 -0.52 1.03 0.08 -1.46 0.00 0.00 175.22 174.35 3h3v s VAL 800 N 2.15 4.37 0.08 3.12 1.01 -0.60 -4.73 120.40 125.81 3h3v s VAL 800 Ca 0.02 1.07 0.04 0.00 0.00 0.00 0.00 61.98 63.10 3h3v s VAL 800 Cb -0.16 -4.49 -0.24 0.00 0.00 0.00 0.00 36.38 31.49 3h3v s VAL 800 CO -0.09 -0.85 1.15 -0.08 0.00 0.00 0.00 175.10 175.22 3h3v h GLU 801 N 9.01 0.09 -7.41 2.72 4.81 -1.96 -2.84 114.58 118.99 3h3v h GLU 801 Ca -0.23 -0.16 -0.48 0.00 -0.13 0.00 0.00 59.36 58.35 3h3v h GLU 801 Cb 1.07 0.06 0.12 0.00 0.63 0.00 0.00 28.75 30.63 3h3v h GLU 801 CO 1.06 1.02 0.31 -0.80 -0.73 0.00 0.00 179.01 179.88 3h3v s ASN 802 N -6.80 4.10 0.29 1.04 0.01 -1.26 -4.36 114.94 107.97 3h3v s ASN 802 Ca -0.02 1.27 0.06 0.00 -0.71 0.00 0.00 52.86 53.46 3h3v s ASN 802 Cb 0.09 -1.96 -0.02 0.00 0.41 0.00 0.00 41.25 39.76 3h3v s ASN 802 CO 0.84 -2.21 0.34 -0.94 -1.51 0.00 0.00 177.10 173.62 3h3v s SER 803 N -3.84 5.82 0.61 -1.22 1.04 -1.22 -1.07 113.70 113.81 3h3v s SER 803 Ca 0.62 -0.19 0.33 0.00 0.48 0.00 0.00 55.95 57.18 3h3v s SER 803 Cb -0.15 -1.40 1.94 0.00 0.10 0.00 0.00 66.02 66.52 3h3v s SER 803 CO 0.55 -0.22 2.28 1.88 0.98 0.00 0.00 173.24 178.70 3h3v h TYR 804 N 1.18 0.00 0.07 5.02 0.99 -1.24 -1.23 116.97 121.77 3h3v h TYR 804 Ca -0.48 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.25 3h3v h TYR 804 Cb 1.24 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.97 3h3v h TYR 804 CO 0.48 0.00 -0.04 1.25 -0.00 0.00 0.00 178.16 179.86 3h3v h LEU 805 N 0.00 -0.09 0.24 3.88 5.85 -1.67 -3.27 115.31 120.25 3h3v h LEU 805 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3h3v h LEU 805 Cb 0.00 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3h3v h LEU 805 CO -0.00 -0.06 -0.12 0.03 -0.34 0.00 0.00 178.44 177.95 3h3v h ARG 806 N -0.10 -0.31 0.00 1.25 3.08 -1.55 -3.50 114.38 113.24 3h3v h ARG 806 Ca -0.01 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3h3v h ARG 806 Cb 0.08 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.20 3h3v h ARG 806 CO 0.01 0.06 0.00 0.41 -1.07 0.00 0.00 179.97 179.38 3h3v n GLY 807 N 0.25 2.56 3.39 0.04 0.00 -0.66 -5.02 105.19 105.74 3h3v n GLY 807 Ca -0.08 -1.26 -0.29 0.00 0.00 0.00 0.00 46.02 44.39 3h3v n GLY 807 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h3v n LEU 808 N 0.00 -1.91 -4.75 0.99 4.32 -1.26 -4.93 117.00 109.46 3h3v n LEU 808 Ca 0.00 -0.26 -0.25 0.00 -0.02 0.00 0.00 56.01 55.47 3h3v n LEU 808 Cb 0.00 -1.15 -0.06 0.00 -1.62 0.00 0.00 43.42 40.58 3h3v n LEU 808 CO 0.00 -3.44 -0.25 0.42 -1.22 0.00 0.00 177.39 172.90 3h3v s THR 809 N -2.32 4.17 0.29 -5.08 -4.23 -1.26 -4.82 115.64 102.39 3h3v s THR 809 Ca 0.66 -1.31 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 3h3v s THR 809 Cb -0.22 -3.15 0.41 0.00 1.34 0.00 0.00 72.50 70.88 3h3v s THR 809 CO 0.65 -0.17 1.49 -2.65 -0.54 0.00 0.00 174.62 173.39 3h3v n PRO 810 N -0.47 -0.08 0.40 3.99 -0.02 -1.26 0.15 135.00 137.71 3h3v n PRO 810 Ca -0.08 1.44 -0.17 0.00 -2.02 0.00 0.00 63.50 62.67 3h3v n PRO 810 Cb 0.56 -2.26 -0.08 0.00 -0.02 0.00 0.00 33.50 31.70 3h3v n PRO 810 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3h3v h GLN 811 N 0.00 -0.99 -0.52 -0.52 7.50 -1.98 0.60 115.11 119.19 3h3v h GLN 811 Ca 0.55 0.07 0.08 0.00 0.50 0.00 0.00 58.65 59.86 3h3v h GLN 811 Cb 1.09 0.23 -0.10 0.00 0.05 0.00 0.00 27.48 28.75 3h3v h GLN 811 CO -0.91 -0.65 -0.41 0.93 -1.50 0.00 0.00 178.83 176.29 3h3v h GLU 812 N -1.22 -0.24 -0.68 1.46 5.08 -1.05 0.29 114.58 118.22 3h3v h GLU 812 Ca -0.11 0.02 0.13 0.00 -1.00 0.00 0.00 59.36 58.40 3h3v h GLU 812 Cb 0.80 0.05 -0.09 0.00 0.50 0.00 0.00 28.75 30.01 3h3v h GLU 812 CO 0.17 -0.16 0.21 0.35 -1.00 0.00 0.00 179.01 178.58 3h3v h PHE 813 N -0.25 0.35 -0.00 4.33 3.57 0.15 0.28 116.94 125.37 3h3v h PHE 813 Ca 0.18 0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.58 3h3v h PHE 813 Cb 0.57 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 3h3v h PHE 813 CO -0.67 0.01 -0.62 0.35 -2.23 0.00 0.00 178.31 175.16 3h3v h PHE 814 N 0.34 0.02 0.04 0.41 3.57 0.99 -1.66 116.94 120.66 3h3v h PHE 814 Ca 0.37 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.72 3h3v h PHE 814 Cb 0.56 -0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.31 3h3v h PHE 814 CO -0.21 0.63 -0.56 0.74 -2.23 0.00 0.00 178.31 176.68 3h3v h PHE 815 N 0.01 0.48 -0.54 0.41 0.05 0.54 -1.42 116.94 116.48 3h3v h PHE 815 Ca -0.01 -0.29 0.13 0.00 3.82 0.00 0.00 57.97 61.62 3h3v h PHE 815 Cb 1.09 -0.04 -0.03 0.00 2.00 0.00 0.00 35.95 38.97 3h3v h PHE 815 CO 0.00 1.15 0.37 1.25 -0.18 0.00 0.00 178.31 180.90 3h3v h HIS 816 N -0.31 0.18 0.19 -0.55 2.76 -0.49 0.36 115.15 117.29 3h3v h HIS 816 Ca -0.08 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.08 3h3v h HIS 816 Cb 1.33 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 30.24 3h3v h HIS 816 CO 0.18 0.08 -0.09 0.00 -1.30 0.00 0.00 177.93 176.79 3h3v h ALA 817 N 1.73 -0.91 -0.98 5.26 0.00 -1.07 0.78 119.26 124.07 3h3v h ALA 817 Ca 0.26 -0.06 0.25 0.00 0.00 0.00 0.00 54.91 55.36 3h3v h ALA 817 Cb 0.80 0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.56 3h3v h ALA 817 CO -0.04 -0.89 0.56 0.52 0.00 0.00 0.00 179.25 179.40 3h3v h MET 818 N -0.29 0.52 0.15 0.00 2.86 -0.69 0.71 114.93 118.19 3h3v h MET 818 Ca -0.03 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 3h3v h MET 818 Cb 0.19 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.74 3h3v h MET 818 CO 0.04 0.34 -0.07 0.78 1.06 0.00 0.00 176.91 179.06 3h3v h GLY 819 N 0.53 -0.21 1.01 8.32 0.00 -0.12 -3.01 103.07 109.60 3h3v h GLY 819 Ca 0.63 0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.99 3h3v h GLY 819 CO -0.49 -0.07 -0.46 -1.33 0.00 0.00 0.00 176.54 174.19 3h3v h GLY 820 N -0.23 -1.33 -0.32 4.60 0.00 0.33 -3.12 103.07 103.01 3h3v h GLY 820 Ca -0.02 0.49 0.06 0.00 0.00 0.00 0.00 47.33 47.86 3h3v h GLY 820 CO 0.03 -0.48 -0.09 -2.13 0.00 0.00 0.00 176.54 173.87 3h3v n ARG 821 N -5.64 -0.04 -0.01 4.80 3.00 0.22 0.85 116.66 119.84 3h3v n ARG 821 Ca -0.16 0.49 -0.10 0.00 -0.00 0.00 0.00 57.85 58.08 3h3v n ARG 821 Cb 0.50 -0.73 -0.04 0.00 0.00 0.00 0.00 32.46 32.19 3h3v n ARG 821 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 3h3v h GLU 822 N 0.00 0.01 -0.90 -0.14 4.81 -1.46 -2.53 114.58 114.37 3h3v h GLU 822 Ca 0.14 -0.00 0.17 0.00 -0.13 0.00 0.00 59.36 59.54 3h3v h GLU 822 Cb 0.22 -0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.43 3h3v h GLU 822 CO -0.32 0.01 -0.28 0.78 -0.73 0.00 0.00 179.01 178.47 3h3v h GLY 823 N 0.01 0.43 0.98 1.92 0.00 0.35 -0.56 103.07 106.20 3h3v h GLY 823 Ca 0.06 0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.73 3h3v h GLY 823 CO -0.12 -0.30 -0.38 1.41 0.00 0.00 0.00 176.54 177.15 3h3v h LEU 824 N -0.02 -0.90 -0.01 3.11 3.38 -1.53 -2.21 115.31 117.13 3h3v h LEU 824 Ca 0.40 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3h3v h LEU 824 Cb 0.64 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 3h3v h LEU 824 CO -0.93 -0.62 -0.01 -0.38 0.09 0.00 0.00 178.44 176.59 3h3v n ILE 825 N -5.54 -0.01 -0.06 1.22 5.41 -0.26 -0.15 119.36 119.97 3h3v n ILE 825 Ca -0.15 1.23 0.01 0.00 1.00 0.00 0.00 62.75 64.84 3h3v n ILE 825 Cb 0.43 -1.64 0.31 0.00 -0.71 0.00 0.00 39.64 38.03 3h3v n ILE 825 CO 0.00 0.00 0.00 -2.24 0.00 0.00 0.00 176.55 174.31 3h3v h ASP 826 N 0.00 0.60 -0.28 4.38 3.04 -1.53 -2.93 116.42 119.71 3h3v h ASP 826 Ca 0.00 -0.06 0.03 0.00 -3.24 0.00 0.00 57.03 53.76 3h3v h ASP 826 Cb 0.01 -0.15 -0.04 0.00 -1.04 0.00 0.00 39.33 38.10 3h3v h ASP 826 CO -0.01 0.54 -0.26 0.74 -2.04 0.00 0.00 179.24 178.21 3h3v h THR 827 N 0.66 0.00 0.00 1.15 2.02 0.12 3.78 112.91 120.64 3h3v h THR 827 Ca 0.16 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.17 3h3v h THR 827 Cb 0.13 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.47 3h3v h THR 827 CO -0.02 0.00 -0.34 0.00 0.37 0.00 0.00 175.52 175.53 3h3v n ALA 828 N -2.96 6.10 0.21 6.16 0.00 -0.64 -1.27 120.51 128.12 3h3v n ALA 828 Ca -0.01 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.77 3h3v n ALA 828 Cb 0.14 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.36 3h3v n ALA 828 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h3v n VAL 829 N 2.44 0.00 0.87 0.00 0.31 0.11 -4.79 118.33 117.26 3h3v n VAL 829 Ca 0.39 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.72 3h3v n VAL 829 Cb 0.87 -0.08 0.00 0.00 -0.91 0.00 0.00 33.84 33.72 3h3v n VAL 829 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3h3v n LYS 830 N -3.41 0.62 -0.03 5.55 5.02 1.21 -1.21 118.16 125.91 3h3v n LYS 830 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.25 3h3v n LYS 830 Cb 0.00 -1.19 -0.04 0.00 -0.02 0.00 0.00 35.03 33.78 3h3v n LYS 830 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 3h3v n THR 831 N -0.09 0.39 0.11 -0.18 5.66 -0.39 -4.09 114.28 115.69 3h3v n THR 831 Ca 0.00 -0.19 -0.22 0.00 -3.05 0.00 0.00 64.05 60.59 3h3v n THR 831 Cb 0.09 -0.80 -0.14 0.00 -1.55 0.00 0.00 70.33 67.94 3h3v n THR 831 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3h3v h ALA 832 N 0.13 -0.03 -0.72 1.79 0.00 -1.53 -2.65 119.26 116.25 3h3v h ALA 832 Ca -0.15 -0.81 -0.05 0.00 0.00 0.00 0.00 54.91 53.90 3h3v h ALA 832 Cb 1.29 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 3h3v h ALA 832 CO -0.01 0.73 0.26 1.49 0.00 0.00 0.00 179.25 181.72 3h3v h GLU 833 N 0.21 1.08 0.65 0.00 4.81 -1.41 -2.27 114.58 117.65 3h3v h GLU 833 Ca -0.20 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 58.80 3h3v h GLU 833 Cb 2.00 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 31.20 3h3v h GLU 833 CO 0.25 0.89 -0.40 1.15 -0.73 0.00 0.00 179.01 180.17 3h3v h THR 834 N 1.05 0.19 -1.07 0.32 2.02 -1.70 -0.98 112.91 112.75 3h3v h THR 834 Ca 0.24 0.00 0.31 0.00 0.77 0.00 0.00 66.41 67.73 3h3v h THR 834 Cb 0.23 0.19 -0.05 0.00 -1.74 0.00 0.00 68.15 66.79 3h3v h THR 834 CO -0.02 0.00 0.76 1.23 0.37 0.00 0.00 175.52 177.87 3h3v h GLY 835 N -0.99 0.06 0.19 2.16 0.00 -1.17 0.10 103.07 103.42 3h3v h GLY 835 Ca -0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 3h3v h GLY 835 CO 0.08 -0.01 -0.09 -1.82 0.00 0.00 0.00 176.54 174.71 3h3v h TYR 836 N 0.02 -0.23 -0.99 5.60 3.20 -0.93 -1.62 116.97 122.01 3h3v h TYR 836 Ca 0.51 -0.01 0.35 0.00 3.14 0.00 0.00 58.73 62.73 3h3v h TYR 836 Cb 2.01 0.08 -0.16 0.00 1.54 0.00 0.00 36.73 40.19 3h3v h TYR 836 CO -0.00 -0.10 0.49 0.82 -1.64 0.00 0.00 178.16 177.72 3h3v h ILE 837 N -1.06 0.15 0.37 1.81 2.04 0.05 0.41 117.51 121.29 3h3v h ILE 837 Ca -0.03 -0.05 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 3h3v h ILE 837 Cb 0.23 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 3h3v h ILE 837 CO 0.04 0.03 -0.18 -0.61 0.00 0.00 0.00 178.15 177.43 3h3v h GLN 838 N 0.15 -0.48 -0.09 2.37 -0.00 -0.90 -2.83 115.11 113.32 3h3v h GLN 838 Ca 0.76 0.03 0.03 0.00 -0.00 0.00 0.00 58.65 59.47 3h3v h GLN 838 Cb 1.85 0.11 -0.00 0.00 0.00 0.00 0.00 27.48 29.43 3h3v h GLN 838 CO -0.71 -0.32 0.67 -0.09 0.00 0.00 0.00 178.83 178.38 3h3v h ARG 839 N -0.70 0.00 0.00 1.69 1.12 0.04 0.61 114.38 117.15 3h3v h ARG 839 Ca -0.05 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.81 3h3v h ARG 839 Cb 0.38 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.34 3h3v h ARG 839 CO 0.08 0.00 -0.14 0.00 -3.11 0.00 0.00 179.97 176.80 3h3v h ARG 840 N 0.00 0.00 -1.28 0.20 3.08 -1.11 -3.16 114.38 112.12 3h3v h ARG 840 Ca 0.04 0.00 0.37 0.00 0.07 0.00 0.00 59.98 60.46 3h3v h ARG 840 Cb 1.38 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.38 3h3v h ARG 840 CO -0.00 0.09 1.21 -0.07 -1.07 0.00 0.00 179.97 180.13 3h3v h LEU 841 N -1.00 0.00 0.24 3.04 3.38 -0.65 0.26 115.31 120.58 3h3v h LEU 841 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3h3v h LEU 841 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3h3v h LEU 841 CO -0.00 0.00 -0.11 0.58 0.09 0.00 0.00 178.44 178.99 3h3v h VAL 842 N 0.00 0.00 0.00 1.22 2.07 -1.42 -2.87 116.25 115.25 3h3v h VAL 842 Ca 0.61 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.90 3h3v h VAL 842 Cb 3.02 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 3h3v h VAL 842 CO -0.01 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.87 3h3v n LYS 843 N -3.48 0.12 0.17 1.57 4.76 0.28 -0.79 118.16 120.79 3h3v n LYS 843 Ca -0.04 0.55 0.12 0.00 -2.87 0.00 0.00 58.31 56.08 3h3v n LYS 843 Cb 0.13 -1.84 0.17 0.00 -1.84 0.00 0.00 35.03 31.64 3h3v n LYS 843 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3h3v h ALA 844 N 2.08 0.86 0.00 7.82 0.00 -0.57 -3.37 119.26 126.08 3h3v h ALA 844 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h3v h ALA 844 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3h3v h ALA 844 CO 0.00 0.00 -0.38 1.28 0.00 0.00 0.00 179.25 180.15 3h3v n LEU 845 N -2.82 0.02 0.00 0.00 4.77 -0.47 -4.96 117.00 113.53 3h3v n LEU 845 Ca 0.03 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 3h3v n LEU 845 Cb 0.51 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3h3v n LEU 845 CO 0.35 0.19 0.23 -0.62 -1.33 0.00 0.00 177.39 176.22 3h3v n GLU 846 N -0.01 0.00 0.00 3.23 1.02 0.03 -2.36 120.64 122.56 3h3v n GLU 846 Ca 0.00 0.38 0.00 0.00 -0.02 0.00 0.00 57.16 57.52 3h3v n GLU 846 Cb 0.65 -0.97 0.00 0.00 -0.02 0.00 0.00 31.44 31.10 3h3v n GLU 846 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3h3v n ASP 847 N -0.84 0.00 -4.56 1.62 5.68 -1.26 -4.05 116.55 113.13 3h3v n ASP 847 Ca 0.00 0.04 -0.43 0.00 -0.50 0.00 0.00 54.79 53.90 3h3v n ASP 847 Cb 0.00 -0.04 -0.04 0.00 -1.14 0.00 0.00 41.12 39.90 3h3v n ASP 847 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 3h3v s ILE 848 N -1.60 4.44 0.15 2.12 1.01 -0.99 -4.08 121.20 122.25 3h3v s ILE 848 Ca 0.00 0.71 0.01 0.00 0.00 0.00 0.00 60.65 61.37 3h3v s ILE 848 Cb 0.00 -4.46 -0.04 0.00 0.01 0.00 0.00 42.46 37.97 3h3v s ILE 848 CO 0.00 -0.89 0.01 0.00 0.00 0.00 0.00 174.94 174.07 3h3v s MET 849 N 3.83 1.03 -0.10 2.79 0.23 -0.44 -0.45 119.30 126.18 3h3v s MET 849 Ca 0.37 -1.49 -0.27 0.00 -1.03 0.00 0.00 55.69 53.27 3h3v s MET 849 Cb -0.10 -0.10 -0.02 0.00 -1.53 0.00 0.00 34.83 33.08 3h3v s MET 849 CO 0.26 -0.16 0.89 0.08 -2.03 0.00 0.00 175.02 174.06 3h3v s VAL 850 N -3.78 4.88 0.43 5.16 1.01 -0.95 -2.20 120.40 124.96 3h3v s VAL 850 Ca 0.23 1.80 -0.02 0.00 0.00 0.00 0.00 61.98 63.99 3h3v s VAL 850 Cb 0.07 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 3h3v s VAL 850 CO 0.02 0.08 0.68 -1.00 0.00 0.00 0.00 175.10 174.89 3h3v s HIS 851 N 1.66 3.46 -0.52 5.22 3.76 -0.08 -1.98 115.29 126.81 3h3v s HIS 851 Ca 0.44 0.51 0.07 0.00 -0.15 0.00 0.00 55.06 55.93 3h3v s HIS 851 Cb -0.18 -2.17 0.36 0.00 1.11 0.00 0.00 32.58 31.70 3h3v s HIS 851 CO 0.18 -0.17 1.12 0.66 -0.85 0.00 0.00 174.74 175.68 3h3v n TYR 852 N -2.06 0.23 1.04 1.40 0.53 -1.26 0.64 117.16 117.67 3h3v n TYR 852 Ca -0.01 0.12 0.12 0.00 -1.02 0.00 0.00 57.90 57.11 3h3v n TYR 852 Cb 0.56 -0.59 0.25 0.00 -1.03 0.00 0.00 39.34 38.53 3h3v n TYR 852 CO 0.00 0.00 0.00 -0.40 -1.02 0.00 0.00 176.86 175.44 3h3v n ASP 853 N -1.69 0.61 0.00 7.72 5.68 -1.26 -4.93 116.55 122.68 3h3v n ASP 853 Ca -0.00 -0.39 0.00 0.00 -0.50 0.00 0.00 54.79 53.90 3h3v n ASP 853 Cb 0.13 0.27 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 3h3v n ASP 853 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3h3v n ASN 854 N -1.37 -1.80 -4.97 -1.12 3.02 0.21 -4.91 115.26 104.31 3h3v n ASN 854 Ca 0.06 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.41 3h3v n ASN 854 Cb 0.34 -0.30 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 3h3v n ASN 854 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3h3v s THR 855 N -2.00 5.16 -0.30 3.41 -1.32 -1.23 -3.75 115.64 115.60 3h3v s THR 855 Ca 0.00 -0.98 -0.06 0.00 -1.21 0.00 0.00 61.69 59.44 3h3v s THR 855 Cb 0.00 -3.82 0.02 0.00 -1.51 0.00 0.00 72.50 67.19 3h3v s THR 855 CO 0.00 -0.32 0.06 -0.89 -2.21 0.00 0.00 174.62 171.26 3h3v s THR 856 N -2.00 3.67 0.14 5.08 2.01 0.30 -0.91 115.64 123.93 3h3v s THR 856 Ca 0.35 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.45 3h3v s THR 856 Cb -0.09 -2.96 -0.01 0.00 0.01 0.00 0.00 72.50 69.45 3h3v s THR 856 CO 0.29 0.01 0.10 0.54 -0.69 0.00 0.00 174.62 174.87 3h3v n ARG 857 N 4.80 0.35 -1.22 4.92 1.74 -0.93 0.52 116.66 126.84 3h3v n ARG 857 Ca -0.14 -1.35 0.00 0.00 -0.77 0.00 0.00 57.85 55.59 3h3v n ARG 857 Cb 0.46 0.99 0.00 0.00 -1.02 0.00 0.00 32.46 32.90 3h3v n ARG 857 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3h3v n ASN 858 N -2.29 1.30 0.00 0.55 2.04 -1.24 -1.33 115.26 114.29 3h3v n ASN 858 Ca 0.01 -0.61 0.01 0.00 -0.44 0.00 0.00 54.58 53.55 3h3v n ASN 858 Cb 0.24 0.00 0.03 0.00 -2.53 0.00 0.00 39.78 37.53 3h3v n ASN 858 CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 3h3v n SER 859 N -1.04 0.00 0.00 0.53 3.41 -1.26 -0.92 113.62 114.35 3h3v n SER 859 Ca 0.00 -0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.23 3h3v n SER 859 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3h3v n SER 859 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h3v n LEU 860 N -0.58 0.75 0.00 1.04 4.77 -1.26 -4.83 117.00 116.88 3h3v n LEU 860 Ca 0.01 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 3h3v n LEU 860 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h3v n LEU 860 CO 0.01 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 3h3v n GLY 861 N -0.02 0.34 3.63 -0.72 0.00 -0.09 -4.93 105.19 103.41 3h3v n GLY 861 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3h3v n GLY 861 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h3v s ASN 862 N -2.11 6.29 0.30 1.61 -0.87 -1.26 -4.81 114.94 114.09 3h3v s ASN 862 Ca 0.00 1.86 -0.30 0.00 -1.57 0.00 0.00 52.86 52.86 3h3v s ASN 862 Cb 0.00 -2.53 -0.12 0.00 -0.02 0.00 0.00 41.25 38.58 3h3v s ASN 862 CO 0.00 -1.30 1.53 0.52 -2.57 0.00 0.00 177.10 175.28 3h3v n VAL 863 N 6.39 1.25 0.00 1.60 0.31 -1.26 -3.72 118.33 122.90 3h3v n VAL 863 Ca 0.20 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 3h3v n VAL 863 Cb 0.44 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 3h3v n VAL 863 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3h3v n ILE 864 N 1.68 0.00 -3.65 2.52 5.41 0.18 -4.98 119.36 120.52 3h3v n ILE 864 Ca 0.07 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.79 3h3v n ILE 864 Cb 0.36 -0.63 -0.06 0.00 -0.71 0.00 0.00 39.64 38.61 3h3v n ILE 864 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 3h3v s GLN 865 N -1.98 0.57 0.41 0.38 -0.21 -1.08 -4.87 119.66 112.88 3h3v s GLN 865 Ca 0.00 1.34 0.15 0.00 0.02 0.00 0.00 55.36 56.87 3h3v s GLN 865 Cb 0.00 0.63 0.87 0.00 1.00 0.00 0.00 33.01 35.51 3h3v s GLN 865 CO 0.00 -0.20 1.89 0.74 -2.12 0.00 0.00 175.29 175.61 3h3v h PHE 866 N 7.80 0.00 -3.11 0.91 -1.00 -1.89 0.86 116.94 120.51 3h3v h PHE 866 Ca -0.21 0.00 -0.53 0.00 2.81 0.00 0.00 57.97 60.04 3h3v h PHE 866 Cb 1.13 0.00 -0.40 0.00 3.61 0.00 0.00 35.95 40.29 3h3v h PHE 866 CO 0.16 0.29 -0.76 0.42 -1.61 0.00 0.00 178.31 176.81 3h3v s ILE 867 N -4.29 0.39 -0.45 -0.55 1.09 -1.26 -3.49 121.20 112.65 3h3v s ILE 867 Ca -0.03 -0.75 -0.41 0.00 -1.10 0.00 0.00 60.65 58.36 3h3v s ILE 867 Cb 0.14 -1.11 -0.18 0.00 -1.06 0.00 0.00 42.46 40.26 3h3v s ILE 867 CO 0.70 -0.45 1.66 0.00 -0.10 0.00 0.00 174.94 176.75 3h3v n TYR 868 N 5.08 1.34 -1.51 3.97 9.36 -1.25 0.11 117.16 134.27 3h3v n TYR 868 Ca -0.06 0.88 -0.09 0.00 3.32 0.00 0.00 57.90 61.95 3h3v n TYR 868 Cb 0.45 -2.03 -0.03 0.00 -0.63 0.00 0.00 39.34 37.10 3h3v n TYR 868 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3h3v n GLY 869 N 5.00 0.75 2.98 2.98 0.00 -1.26 -0.81 105.19 114.83 3h3v n GLY 869 Ca 0.38 -0.61 -0.21 0.00 0.00 0.00 0.00 46.02 45.57 3h3v n GLY 869 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3v n GLU 870 N -2.49 -3.56 0.00 1.61 1.02 0.31 -4.54 120.64 112.99 3h3v n GLU 870 Ca -0.09 0.70 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 3h3v n GLU 870 Cb 0.37 -5.44 0.00 0.00 -0.02 0.00 0.00 31.44 26.34 3h3v n GLU 870 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3h3v n ASP 871 N -2.26 0.00 -3.06 1.62 5.75 -1.20 -4.79 116.55 112.61 3h3v n ASP 871 Ca -0.10 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.46 3h3v n ASP 871 Cb 0.60 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.71 3h3v n ASP 871 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h3v n GLY 872 N 0.00 -0.51 3.71 6.12 0.00 0.01 -4.92 105.19 109.59 3h3v n GLY 872 Ca 0.00 0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 3h3v n GLY 872 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h3v s MET 873 N -5.73 2.64 -0.28 1.61 -1.94 -1.26 -0.76 119.30 113.59 3h3v s MET 873 Ca 0.30 -0.79 -0.26 0.00 -1.71 0.00 0.00 55.69 53.23 3h3v s MET 873 Cb -0.14 -2.59 0.00 0.00 2.01 0.00 0.00 34.83 34.11 3h3v s MET 873 CO 0.38 0.55 0.90 0.34 -0.01 0.00 0.00 175.02 177.17 3h3v s ASP 874 N -2.31 6.83 0.15 3.03 -1.08 -0.85 -4.62 116.67 117.83 3h3v s ASP 874 Ca 0.27 0.96 -0.09 0.00 -0.52 0.00 0.00 52.55 53.17 3h3v s ASP 874 Cb -0.12 -2.46 0.18 0.00 -1.46 0.00 0.00 42.92 39.06 3h3v s ASP 874 CO 0.19 -0.65 0.92 0.00 0.52 0.00 0.00 175.17 176.15 3h3v n ALA 875 N 6.29 -0.01 0.14 3.66 0.00 -1.26 0.35 120.51 129.68 3h3v n ALA 875 Ca 0.07 0.61 0.19 0.00 0.00 0.00 0.00 53.44 54.31 3h3v n ALA 875 Cb 0.47 -0.30 0.73 0.00 0.00 0.00 0.00 19.45 20.35 3h3v n ALA 875 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3v h ALA 876 N 0.93 1.98 -1.01 0.00 0.00 -1.85 -2.74 119.26 116.56 3h3v h ALA 876 Ca 0.23 -0.01 -0.77 0.00 0.00 0.00 0.00 54.91 54.36 3h3v h ALA 876 Cb 0.38 0.03 -0.27 0.00 0.00 0.00 0.00 17.79 17.92 3h3v h ALA 876 CO -0.59 -0.65 1.06 0.72 0.00 0.00 0.00 179.25 179.79 3h3v n HIS 877 N -3.46 2.96 -3.84 0.00 8.25 0.16 -4.85 115.22 114.44 3h3v n HIS 877 Ca 0.06 -2.33 -0.12 0.00 -0.26 0.00 0.00 57.72 55.07 3h3v n HIS 877 Cb 0.62 -1.19 -0.11 0.00 1.12 0.00 0.00 29.99 30.43 3h3v n HIS 877 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3h3v s ILE 878 N -5.02 0.03 0.01 1.59 1.01 -1.03 -3.98 121.20 113.80 3h3v s ILE 878 Ca 0.51 -0.27 -0.04 0.00 0.00 0.00 0.00 60.65 60.85 3h3v s ILE 878 Cb 0.43 -0.30 -0.01 0.00 0.01 0.00 0.00 42.46 42.59 3h3v s ILE 878 CO -0.40 -0.15 0.07 -1.61 0.00 0.00 0.00 174.94 172.85 3h3v s GLU 879 N -0.48 0.38 -0.02 2.79 2.02 -1.23 -4.72 118.70 117.45 3h3v s GLU 879 Ca -0.06 -0.43 -0.30 0.00 0.02 0.00 0.00 54.97 54.20 3h3v s GLU 879 Cb -0.04 0.15 -0.07 0.00 0.10 0.00 0.00 34.13 34.27 3h3v s GLU 879 CO 0.01 -0.08 1.88 0.15 0.02 0.00 0.00 175.26 177.24 3h3v s LYS 880 N -1.28 4.07 0.53 1.61 1.02 -1.26 -1.67 119.74 122.75 3h3v s LYS 880 Ca -0.14 2.41 0.04 0.00 0.02 0.00 0.00 55.97 58.30 3h3v s LYS 880 Cb -0.08 -4.12 0.02 0.00 -0.52 0.00 0.00 37.83 33.13 3h3v s LYS 880 CO 0.00 -1.02 0.26 -0.65 -0.92 0.00 0.00 175.35 173.03 3h3v s GLN 881 N 4.48 2.24 -0.07 1.68 -1.52 0.11 -4.85 119.66 121.74 3h3v s GLN 881 Ca 0.84 -2.13 0.00 0.00 -1.95 0.00 0.00 55.36 52.13 3h3v s GLN 881 Cb -0.38 -1.91 0.02 0.00 -0.22 0.00 0.00 33.01 30.51 3h3v s GLN 881 CO 0.37 -0.50 -0.04 -1.54 -0.25 0.00 0.00 175.29 173.32 3h3v s SER 882 N -4.13 1.42 -1.20 5.90 1.04 -1.25 -0.68 113.70 114.79 3h3v s SER 882 Ca 0.25 -0.16 -0.17 0.00 0.48 0.00 0.00 55.95 56.36 3h3v s SER 882 Cb -0.01 -0.54 0.11 0.00 0.10 0.00 0.00 66.02 65.68 3h3v s SER 882 CO 0.15 -0.10 1.55 -0.76 0.98 0.00 0.00 173.24 175.06 3h3v s LEU 883 N 1.36 4.30 0.45 2.42 1.43 0.50 -4.82 118.68 124.31 3h3v s LEU 883 Ca -0.04 -2.46 0.23 0.00 -1.03 0.00 0.00 54.13 50.84 3h3v s LEU 883 Cb -0.13 -2.50 1.23 0.00 0.03 0.00 0.00 46.19 44.81 3h3v s LEU 883 CO -0.03 -1.07 1.82 0.44 0.23 0.00 0.00 176.35 177.74 3h3v h ASP 884 N 7.85 0.30 0.00 2.29 3.32 -1.93 0.01 116.42 128.26 3h3v h ASP 884 Ca 0.35 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3h3v h ASP 884 Cb 0.90 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.45 3h3v h ASP 884 CO 1.35 0.08 0.00 0.41 -1.72 0.00 0.00 179.24 179.36 3h3v n THR 885 N -4.47 0.00 0.02 0.35 -1.04 -1.26 -3.59 114.28 104.29 3h3v n THR 885 Ca 0.23 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.22 3h3v n THR 885 Cb 0.90 -0.81 -0.00 0.00 -1.82 0.00 0.00 70.33 68.60 3h3v n THR 885 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h3v n ILE 886 N -0.81 1.13 -1.37 12.58 3.06 -0.01 -3.97 119.36 129.97 3h3v n ILE 886 Ca 0.00 0.33 -0.29 0.00 -2.50 0.00 0.00 62.75 60.29 3h3v n ILE 886 Cb 0.00 -1.64 0.17 0.00 0.54 0.00 0.00 39.64 38.72 3h3v n ILE 886 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 3h3v s GLY 887 N -4.01 1.59 0.00 4.50 0.00 -1.24 -4.97 107.32 103.20 3h3v s GLY 887 Ca -0.04 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.05 3h3v s GLY 887 CO 0.06 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.80 3h3v n GLY 888 N -1.77 2.08 3.78 0.20 0.00 -1.26 -4.96 105.19 103.26 3h3v n GLY 888 Ca 0.08 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.87 3h3v n GLY 888 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h3v s SER 889 N -0.05 5.28 0.22 1.61 1.04 -1.26 -4.17 113.70 116.37 3h3v s SER 889 Ca 0.00 1.89 -0.08 0.00 0.48 0.00 0.00 55.95 58.25 3h3v s SER 889 Cb 0.00 -2.54 0.18 0.00 0.10 0.00 0.00 66.02 63.76 3h3v s SER 889 CO 0.00 -1.51 1.82 0.44 0.98 0.00 0.00 173.24 174.97 3h3v h ASP 890 N -0.01 1.10 0.02 7.02 3.32 -1.71 -1.81 116.42 124.35 3h3v h ASP 890 Ca -0.46 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 56.46 3h3v h ASP 890 Cb 1.23 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.50 3h3v h ASP 890 CO 0.55 0.92 -0.02 0.00 -1.72 0.00 0.00 179.24 178.97 3h3v h ALA 891 N 1.23 -0.79 -0.97 3.45 0.00 -1.92 -2.80 119.26 117.45 3h3v h ALA 891 Ca 0.29 -0.01 0.28 0.00 0.00 0.00 0.00 54.91 55.48 3h3v h ALA 891 Cb 0.10 0.25 -0.14 0.00 0.00 0.00 0.00 17.79 18.00 3h3v h ALA 891 CO -0.04 -0.79 0.50 0.00 0.00 0.00 0.00 179.25 178.92 3h3v h ALA 892 N -1.74 1.76 0.54 0.00 0.00 -1.93 -1.92 119.26 115.97 3h3v h ALA 892 Ca -0.00 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3h3v h ALA 892 Cb 0.04 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3h3v h ALA 892 CO -0.00 -0.48 -0.50 0.35 0.00 0.00 0.00 179.25 178.62 3h3v h PHE 893 N 0.36 -1.38 -0.51 0.00 3.57 -1.18 -2.18 116.94 115.62 3h3v h PHE 893 Ca 0.67 0.01 0.09 0.00 3.53 0.00 0.00 57.97 62.27 3h3v h PHE 893 Cb 1.45 0.53 -0.10 0.00 2.79 0.00 0.00 35.95 40.61 3h3v h PHE 893 CO -0.06 -0.68 -0.39 1.49 -2.23 0.00 0.00 178.31 176.44 3h3v h GLU 894 N -1.03 -0.23 -0.07 1.11 4.81 -1.09 -2.14 114.58 115.94 3h3v h GLU 894 Ca -0.07 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 3h3v h GLU 894 Cb 0.89 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 3h3v h GLU 894 CO -0.04 -0.15 -0.04 -0.22 -0.73 0.00 0.00 179.01 177.83 3h3v h LYS 895 N -0.24 -0.00 -0.14 1.92 3.64 -1.19 0.25 116.57 120.81 3h3v h LYS 895 Ca 0.18 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 3h3v h LYS 895 Cb 0.56 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.32 3h3v h LYS 895 CO -0.63 -0.00 -0.50 -0.09 -2.27 0.00 0.00 179.45 175.96 3h3v h ARG 896 N -0.00 -0.50 -0.00 1.90 2.43 -0.86 -3.21 114.38 114.14 3h3v h ARG 896 Ca 0.01 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3h3v h ARG 896 Cb 0.03 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 3h3v h ARG 896 CO -0.06 -0.33 -0.42 0.66 -1.51 0.00 0.00 179.97 178.31 3h3v n TYR 897 N -5.17 0.00 -2.54 2.20 4.02 -0.85 -4.42 117.16 110.40 3h3v n TYR 897 Ca -0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.42 3h3v n TYR 897 Cb 0.34 -0.24 -0.03 0.00 -0.02 0.00 0.00 39.34 39.39 3h3v n TYR 897 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 3h3v s ARG 898 N -2.90 4.50 -0.08 -0.72 6.06 0.87 -4.67 118.95 122.00 3h3v s ARG 898 Ca 0.14 1.63 0.02 0.00 -2.50 0.00 0.00 55.73 55.02 3h3v s ARG 898 Cb 0.18 -3.38 0.01 0.00 0.06 0.00 0.00 34.95 31.82 3h3v s ARG 898 CO 0.65 -0.13 -0.13 0.08 -2.50 0.00 0.00 175.30 173.27 3h3v s VAL 899 N 0.86 1.28 -0.29 7.11 1.01 -1.26 -4.92 120.40 124.18 3h3v s VAL 899 Ca 0.55 -0.54 -0.00 0.00 0.00 0.00 0.00 61.98 61.99 3h3v s VAL 899 Cb -0.26 -1.17 0.09 0.00 0.00 0.00 0.00 36.38 35.03 3h3v s VAL 899 CO 0.29 0.39 0.06 -0.62 0.00 0.00 0.00 175.10 175.23 3h3v s ASP 900 N 0.84 3.96 -0.01 3.32 -1.08 0.66 -4.80 116.67 119.56 3h3v s ASP 900 Ca -0.11 -1.54 0.04 0.00 -0.52 0.00 0.00 52.55 50.42 3h3v s ASP 900 Cb -0.15 -0.96 0.13 0.00 -1.46 0.00 0.00 42.92 40.48 3h3v s ASP 900 CO 0.01 -0.37 1.04 0.18 0.52 0.00 0.00 175.17 176.55 3h3v n LEU 901 N 4.78 1.00 -0.66 -1.34 4.77 -1.26 -2.32 117.00 121.96 3h3v n LEU 901 Ca -0.03 -0.50 0.06 0.00 -0.03 0.00 0.00 56.01 55.51 3h3v n LEU 901 Cb 0.43 -0.18 0.19 0.00 -2.33 0.00 0.00 43.42 41.52 3h3v n LEU 901 CO 0.14 0.22 0.34 0.18 -1.33 0.00 0.00 177.39 176.94 3h3v n LEU 902 N -0.04 2.50 -3.71 2.23 4.77 -1.26 0.39 117.00 121.88 3h3v n LEU 902 Ca 0.05 -3.65 -0.13 0.00 -0.03 0.00 0.00 56.01 52.26 3h3v n LEU 902 Cb 0.18 -0.47 -0.10 0.00 -2.33 0.00 0.00 43.42 40.71 3h3v n LEU 902 CO 0.04 1.27 0.13 0.21 -1.33 0.00 0.00 177.39 177.71 3h3v s ASN 903 N -3.08 -0.50 0.00 -1.43 3.04 -1.21 -4.98 114.94 106.78 3h3v s ASN 903 Ca 0.37 0.94 0.21 0.00 0.04 0.00 0.00 52.86 54.43 3h3v s ASN 903 Cb 0.36 0.92 1.01 0.00 -1.54 0.00 0.00 41.25 42.01 3h3v s ASN 903 CO -0.07 -0.17 1.69 0.41 -3.04 0.00 0.00 177.10 175.92 3h3v n THR 904 N 3.15 0.42 -0.03 -5.21 -1.04 -1.26 -1.93 114.28 108.38 3h3v n THR 904 Ca -0.15 0.11 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 3h3v n THR 904 Cb 0.57 -0.74 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 3h3v n THR 904 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3h3v n ASP 905 N -1.38 0.26 -0.02 8.00 8.00 -1.26 -4.68 116.55 125.47 3h3v n ASP 905 Ca 0.08 -0.61 0.01 0.00 0.71 0.00 0.00 54.79 54.98 3h3v n ASP 905 Cb 0.21 0.64 0.02 0.00 -0.02 0.00 0.00 41.12 41.96 3h3v n ASP 905 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3h3v n HIS 906 N -0.64 0.00 -3.88 1.24 8.25 -1.20 -5.04 115.22 113.95 3h3v n HIS 906 Ca 0.00 -0.45 -0.27 0.00 -0.26 0.00 0.00 57.72 56.74 3h3v n HIS 906 Cb 0.01 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.03 3h3v n HIS 906 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3h3v s THR 907 N -0.99 5.31 0.07 1.59 -1.32 -0.81 -0.25 115.64 119.24 3h3v s THR 907 Ca 0.03 -0.56 -0.30 0.00 -1.21 0.00 0.00 61.69 59.65 3h3v s THR 907 Cb 0.03 -3.72 -0.09 0.00 -1.51 0.00 0.00 72.50 67.20 3h3v s THR 907 CO 0.00 -0.07 1.89 -0.76 -2.21 0.00 0.00 174.62 173.47 3h3v s LEU 908 N -3.14 4.41 0.23 9.08 1.43 -1.26 -4.89 118.68 124.54 3h3v s LEU 908 Ca 0.36 2.68 -0.31 0.00 -1.03 0.00 0.00 54.13 55.83 3h3v s LEU 908 Cb -0.11 -3.55 -0.11 0.00 0.03 0.00 0.00 46.19 42.45 3h3v s LEU 908 CO 0.28 -1.02 1.61 -0.62 0.23 0.00 0.00 176.35 176.83 3h3v s ASP 909 N 3.63 6.46 0.00 2.29 -1.08 -1.26 -4.82 116.67 121.88 3h3v s ASP 909 Ca 0.84 2.82 0.02 0.00 -0.52 0.00 0.00 52.55 55.71 3h3v s ASP 909 Cb -0.43 -2.61 0.13 0.00 -1.46 0.00 0.00 42.92 38.54 3h3v s ASP 909 CO 0.39 -0.88 0.51 -0.81 0.52 0.00 0.00 175.17 174.89 3h3v n PRO 910 N 3.14 0.09 0.19 4.34 -0.04 -1.26 -1.66 135.00 139.80 3h3v n PRO 910 Ca 0.12 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.66 3h3v n PRO 910 Cb 0.37 -1.37 0.20 0.00 -0.04 0.00 0.00 33.50 32.66 3h3v n PRO 910 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3h3v h SER 911 N 0.00 0.00 0.00 3.54 4.64 -1.97 -3.38 113.55 116.38 3h3v h SER 911 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h3v h SER 911 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3h3v h SER 911 CO 0.00 0.25 0.00 0.18 -0.87 0.00 0.00 176.83 176.39 3h3v n LEU 912 N -3.20 0.63 -4.77 5.97 4.77 -0.66 -3.99 117.00 115.75 3h3v n LEU 912 Ca 0.02 0.17 -0.39 0.00 -0.03 0.00 0.00 56.01 55.79 3h3v n LEU 912 Cb 0.58 -0.31 -0.04 0.00 -2.33 0.00 0.00 43.42 41.32 3h3v n LEU 912 CO 0.36 -0.31 0.79 -0.22 -1.33 0.00 0.00 177.39 176.68 3h3v s LEU 913 N -3.48 4.41 0.12 2.23 2.96 -1.25 0.14 118.68 123.81 3h3v s LEU 913 Ca 0.00 2.25 -0.14 0.00 -0.22 0.00 0.00 54.13 56.01 3h3v s LEU 913 Cb 0.00 -3.80 -0.04 0.00 0.50 0.00 0.00 46.19 42.85 3h3v s LEU 913 CO 0.00 -0.30 1.51 -0.08 -1.32 0.00 0.00 176.35 176.16 3h3v h GLU 914 N 3.37 0.75 -0.97 1.98 4.81 -1.82 -2.37 114.58 120.31 3h3v h GLU 914 Ca -0.47 -0.31 -0.12 0.00 -0.13 0.00 0.00 59.36 58.32 3h3v h GLU 914 Cb 1.22 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.49 3h3v h GLU 914 CO 0.65 0.92 0.16 -1.13 -0.73 0.00 0.00 179.01 178.88 3h3v n SER 915 N -4.33 3.07 0.00 1.04 3.41 -1.26 -4.71 113.62 110.84 3h3v n SER 915 Ca -0.02 -2.45 0.00 0.00 -0.26 0.00 0.00 58.87 56.14 3h3v n SER 915 Cb 0.38 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 3h3v n SER 915 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h3v n GLY 916 N 0.04 -3.57 0.20 5.00 0.00 -0.89 -2.88 105.19 103.08 3h3v n GLY 916 Ca 0.16 0.70 -0.03 0.00 0.00 0.00 0.00 46.02 46.86 3h3v n GLY 916 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h3v h SER 917 N 0.00 0.11 0.00 1.61 4.64 -1.86 -1.84 113.55 116.20 3h3v h SER 917 Ca 0.00 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3h3v h SER 917 Cb 0.00 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3h3v h SER 917 CO 0.00 0.09 0.00 -1.84 -0.87 0.00 0.00 176.83 174.21 3h3v n GLU 918 N -5.05 0.14 -0.13 4.77 0.28 -1.20 -2.18 120.64 117.26 3h3v n GLU 918 Ca 0.05 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.85 3h3v n GLU 918 Cb 0.22 -1.46 -0.12 0.00 1.43 0.00 0.00 31.44 31.51 3h3v n GLU 918 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 3h3v n ILE 919 N -0.96 1.49 -1.03 3.84 5.41 -0.70 -4.86 119.36 122.55 3h3v n ILE 919 Ca 0.03 -0.53 -0.40 0.00 1.00 0.00 0.00 62.75 62.85 3h3v n ILE 919 Cb 0.01 -1.51 -0.05 0.00 -0.71 0.00 0.00 39.64 37.38 3h3v n ILE 919 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 3h3v n LEU 920 N -3.46 -0.06 0.00 1.39 0.00 -0.93 0.67 117.00 114.61 3h3v n LEU 920 Ca -0.48 0.80 0.00 0.00 0.00 0.00 0.00 56.01 56.33 3h3v n LEU 920 Cb 0.97 -0.64 0.00 0.00 0.00 0.00 0.00 43.42 43.75 3h3v n LEU 920 CO 0.21 -1.36 0.00 0.61 0.00 0.00 0.00 177.39 176.85 3h3v n GLY 921 N 1.06 1.94 2.82 -3.96 0.00 1.29 -4.93 105.19 103.41 3h3v n GLY 921 Ca 0.14 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 3h3v n GLY 921 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3h3v n ASP 922 N 1.36 0.34 0.07 1.61 -0.08 0.21 -4.77 116.55 115.28 3h3v n ASP 922 Ca 0.00 0.26 -0.02 0.00 -1.51 0.00 0.00 54.79 53.52 3h3v n ASP 922 Cb 0.00 -0.75 0.22 0.00 2.34 0.00 0.00 41.12 42.93 3h3v n ASP 922 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3h3v h LEU 923 N 9.20 0.34 -1.20 -2.67 3.38 -1.91 -2.64 115.31 119.81 3h3v h LEU 923 Ca -0.05 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 3h3v h LEU 923 Cb 1.10 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3h3v h LEU 923 CO 1.08 0.67 -0.23 0.11 0.09 0.00 0.00 178.44 180.15 3h3v h LYS 924 N 0.29 0.00 0.05 1.13 1.57 -1.99 -3.06 116.57 114.56 3h3v h LYS 924 Ca 0.03 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 3h3v h LYS 924 Cb 0.74 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.06 3h3v h LYS 924 CO 0.06 0.23 -0.39 -0.07 -0.57 0.00 0.00 179.45 178.71 3h3v h LEU 925 N 0.00 0.18 0.00 2.94 3.38 -1.91 -3.21 115.31 116.69 3h3v h LEU 925 Ca -0.00 -0.96 0.00 0.00 0.09 0.00 0.00 57.88 57.01 3h3v h LEU 925 Cb 0.71 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3h3v h LEU 925 CO 0.03 1.18 0.08 0.00 0.09 0.00 0.00 178.44 179.83 3h3v n GLN 926 N -4.40 0.00 0.10 1.13 1.13 -1.01 0.34 117.38 114.68 3h3v n GLN 926 Ca -0.13 0.29 -0.18 0.00 -1.94 0.00 0.00 57.00 55.04 3h3v n GLN 926 Cb 0.63 -1.58 -0.12 0.00 0.11 0.00 0.00 30.24 29.27 3h3v n GLN 926 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3h3v h VAL 927 N 0.00 1.40 0.19 5.09 2.07 -1.54 -2.40 116.25 121.06 3h3v h VAL 927 Ca 0.00 -2.76 -0.29 0.00 0.82 0.00 0.00 66.70 64.47 3h3v h VAL 927 Cb 0.17 2.81 0.03 0.00 -1.52 0.00 0.00 31.29 32.78 3h3v h VAL 927 CO 0.00 0.82 -1.26 -0.07 0.02 0.00 0.00 177.57 177.08 3h3v h LEU 928 N 0.16 0.78 -2.02 2.57 3.38 -0.26 0.11 115.31 120.02 3h3v h LEU 928 Ca -0.16 -0.90 0.04 0.00 0.09 0.00 0.00 57.88 56.96 3h3v h LEU 928 Cb 1.92 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 3h3v h LEU 928 CO 0.22 1.61 0.11 -0.07 0.09 0.00 0.00 178.44 180.40 3h3v h LEU 929 N 0.07 0.00 0.00 1.67 -0.00 -1.38 1.30 115.31 116.96 3h3v h LEU 929 Ca -0.21 0.00 -0.24 0.00 -0.00 0.00 0.00 57.88 57.43 3h3v h LEU 929 Cb 1.98 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 42.59 3h3v h LEU 929 CO 0.24 0.00 -1.67 0.47 -0.00 0.00 0.00 178.44 177.47 3h3v n ASP 930 N -4.45 0.73 0.06 -0.43 8.00 -0.90 -1.75 116.55 117.82 3h3v n ASP 930 Ca 0.01 0.33 -0.05 0.00 0.71 0.00 0.00 54.79 55.79 3h3v n ASP 930 Cb 0.24 0.24 0.15 0.00 -0.02 0.00 0.00 41.12 41.73 3h3v n ASP 930 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3h3v h GLU 931 N 0.00 0.33 0.05 -1.24 4.81 0.87 -1.58 114.58 117.81 3h3v h GLU 931 Ca -0.25 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 58.79 3h3v h GLU 931 Cb 1.82 0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.21 3h3v h GLU 931 CO 0.06 0.74 -0.02 1.49 -0.73 0.00 0.00 179.01 180.55 3h3v h GLU 932 N 0.26 -0.06 -1.56 1.92 4.81 0.15 -3.14 114.58 116.96 3h3v h GLU 932 Ca 0.01 0.00 0.45 0.00 -0.13 0.00 0.00 59.36 59.70 3h3v h GLU 932 Cb 0.95 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.29 3h3v h GLU 932 CO 0.08 -0.04 1.12 -0.92 -0.73 0.00 0.00 179.01 178.52 3h3v h TYR 933 N -0.21 0.00 -0.44 0.92 3.20 -1.41 1.28 116.97 120.31 3h3v h TYR 933 Ca -0.01 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.73 3h3v h TYR 933 Cb 0.05 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 3h3v h TYR 933 CO 0.05 -0.00 -0.25 0.87 -1.64 0.00 0.00 178.16 177.18 3h3v h LYS 934 N 0.00 0.94 -0.01 1.82 1.57 -1.37 -2.89 116.57 116.64 3h3v h LYS 934 Ca 0.74 -0.42 -0.00 0.00 -1.87 0.00 0.00 60.65 59.11 3h3v h LYS 934 Cb 2.98 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 35.26 3h3v h LYS 934 CO -0.01 1.08 -0.00 0.37 -0.57 0.00 0.00 179.45 180.32 3h3v h GLN 935 N 0.80 0.01 0.00 3.15 5.75 0.16 -1.67 115.11 123.32 3h3v h GLN 935 Ca 0.10 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 3h3v h GLN 935 Cb 0.82 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.37 3h3v h GLN 935 CO 0.07 0.35 0.28 -0.07 -2.65 0.00 0.00 178.83 176.81 3h3v h LEU 936 N -0.33 0.00 0.03 -2.39 3.38 -1.25 0.24 115.31 115.00 3h3v h LEU 936 Ca 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 3h3v h LEU 936 Cb 0.34 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 3h3v h LEU 936 CO 0.00 0.00 -2.13 0.52 0.09 0.00 0.00 178.44 176.92 3h3v n VAL 937 N -2.62 1.57 0.04 1.22 0.31 -1.01 -2.70 118.33 115.13 3h3v n VAL 937 Ca -0.02 -0.73 0.04 0.00 -0.01 0.00 0.00 64.34 63.63 3h3v n VAL 937 Cb 0.32 -1.15 0.46 0.00 -0.91 0.00 0.00 33.84 32.55 3h3v n VAL 937 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 3h3v h LYS 938 N 0.02 0.45 0.62 5.55 3.64 0.32 -1.65 116.57 125.52 3h3v h LYS 938 Ca -0.46 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 58.87 3h3v h LYS 938 Cb 2.05 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 33.78 3h3v h LYS 938 CO 0.03 0.30 -0.30 -0.44 -2.27 0.00 0.00 179.45 176.78 3h3v h ASP 939 N 0.46 -0.71 -0.73 4.20 5.19 -1.04 0.99 116.42 124.79 3h3v h ASP 939 Ca 0.12 -0.00 0.09 0.00 -0.62 0.00 0.00 57.03 56.62 3h3v h ASP 939 Cb -0.04 0.18 -0.11 0.00 0.18 0.00 0.00 39.33 39.54 3h3v h ASP 939 CO -0.03 -0.45 -0.50 -0.09 -3.12 0.00 0.00 179.24 175.04 3h3v h ARG 940 N -0.91 -0.16 -0.74 3.56 9.65 -1.12 0.21 114.38 124.88 3h3v h ARG 940 Ca -0.09 0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.81 3h3v h ARG 940 Cb 0.67 0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 29.25 3h3v h ARG 940 CO 0.14 -0.11 0.48 0.87 2.80 0.00 0.00 179.97 184.16 3h3v h LYS 941 N -0.16 0.97 -0.04 0.20 1.79 -1.29 -2.31 116.57 115.73 3h3v h LYS 941 Ca 0.17 -0.06 0.03 0.00 -2.18 0.00 0.00 60.65 58.61 3h3v h LYS 941 Cb 0.53 -0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 30.93 3h3v h LYS 941 CO -0.79 0.65 -0.14 0.35 -1.08 0.00 0.00 179.45 178.45 3h3v h PHE 942 N 1.00 -0.35 -0.30 -1.35 -0.00 0.19 -2.21 116.94 113.92 3h3v h PHE 942 Ca 0.27 0.01 -0.01 0.00 -0.00 0.00 0.00 57.97 58.25 3h3v h PHE 942 Cb -0.10 0.16 -0.01 0.00 -0.00 0.00 0.00 35.95 36.00 3h3v h PHE 942 CO -0.02 -0.21 0.16 -0.07 -0.00 0.00 0.00 178.31 178.18 3h3v h LEU 943 N -0.21 0.38 0.00 0.59 3.38 -0.74 -1.50 115.31 117.21 3h3v h LEU 943 Ca 0.06 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3h3v h LEU 943 Cb 0.29 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3h3v h LEU 943 CO -0.16 0.37 0.00 0.54 0.09 0.00 0.00 178.44 179.27 3h3v n ARG 944 N -4.80 0.33 -0.00 1.13 1.74 -0.88 -0.76 116.66 113.42 3h3v n ARG 944 Ca -0.02 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.15 3h3v n ARG 944 Cb 0.08 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.92 3h3v n ARG 944 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3h3v n GLU 945 N -1.01 1.41 -0.04 5.56 2.13 -0.58 -4.17 120.64 123.95 3h3v n GLU 945 Ca 0.08 -0.02 -0.05 0.00 0.66 0.00 0.00 57.16 57.82 3h3v n GLU 945 Cb 0.04 -1.29 -0.05 0.00 0.27 0.00 0.00 31.44 30.40 3h3v n GLU 945 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3h3v n VAL 946 N -1.49 0.52 -2.74 6.31 0.31 -0.32 -4.70 118.33 116.20 3h3v n VAL 946 Ca 0.02 -0.25 -0.34 0.00 -0.01 0.00 0.00 64.34 63.77 3h3v n VAL 946 Cb 0.28 -0.82 -0.01 0.00 -0.91 0.00 0.00 33.84 32.39 3h3v n VAL 946 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3h3v n PHE 947 N -2.56 3.40 -0.34 3.52 3.01 0.06 -4.85 117.46 119.69 3h3v n PHE 947 Ca -0.14 -3.23 0.30 0.00 1.01 0.00 0.00 57.45 55.38 3h3v n PHE 947 Cb 0.70 -0.83 0.51 0.00 -0.01 0.00 0.00 39.48 39.84 3h3v n PHE 947 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3h3v n VAL 948 N -0.18 -0.22 0.02 -4.37 0.31 -1.26 -0.90 118.33 111.73 3h3v n VAL 948 Ca 0.40 1.42 -0.03 0.00 -0.01 0.00 0.00 64.34 66.11 3h3v n VAL 948 Cb 0.33 -2.32 -0.02 0.00 -0.91 0.00 0.00 33.84 30.92 3h3v n VAL 948 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 3h3v h ASP 949 N 0.00 -0.33 0.00 4.52 1.82 -1.90 -3.47 116.42 117.06 3h3v h ASP 949 Ca 0.67 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 57.35 3h3v h ASP 949 Cb 2.09 0.12 0.00 0.00 0.68 0.00 0.00 39.33 42.23 3h3v h ASP 949 CO -0.40 -0.12 0.00 0.61 -1.61 0.00 0.00 179.24 177.72 3h3v n GLY 950 N -1.10 0.75 3.67 -0.78 0.00 -0.08 -4.70 105.19 102.95 3h3v n GLY 950 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3h3v n GLY 950 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h3v n GLU 951 N 0.00 2.85 0.00 1.61 4.07 -1.26 -4.69 120.64 123.22 3h3v n GLU 951 Ca 0.00 1.04 0.09 0.00 -0.06 0.00 0.00 57.16 58.23 3h3v n GLU 951 Cb 0.00 -2.98 -0.01 0.00 -0.06 0.00 0.00 31.44 28.39 3h3v n GLU 951 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3h3v n ALA 952 N 6.96 3.40 -2.54 4.31 0.00 -1.26 -4.90 120.51 126.48 3h3v n ALA 952 Ca 0.19 -0.57 -0.40 0.00 0.00 0.00 0.00 53.44 52.66 3h3v n ALA 952 Cb 0.40 -0.65 -0.11 0.00 0.00 0.00 0.00 19.45 19.09 3h3v n ALA 952 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3h3v s ASN 953 N -2.16 6.06 0.04 0.00 0.01 -1.25 -0.37 114.94 117.26 3h3v s ASN 953 Ca 0.15 -0.33 -0.01 0.00 -0.71 0.00 0.00 52.86 51.96 3h3v s ASN 953 Cb 0.15 -2.14 -0.03 0.00 0.41 0.00 0.00 41.25 39.64 3h3v s ASN 953 CO 0.49 -0.20 -0.02 0.26 -1.51 0.00 0.00 177.10 176.12 3h3v s TRP 954 N 1.74 0.40 -0.05 2.20 0.52 0.15 -4.87 118.94 119.03 3h3v s TRP 954 Ca 0.06 -0.84 -0.30 0.00 0.02 0.00 0.00 56.10 55.04 3h3v s TRP 954 Cb -0.17 -0.30 -0.05 0.00 -1.15 0.00 0.00 33.47 31.80 3h3v s TRP 954 CO 0.11 -0.32 1.54 -1.25 0.02 0.00 0.00 176.95 177.04 3h3v s PRO 955 N -3.02 4.21 -0.09 4.98 0.04 -1.26 0.09 135.00 139.95 3h3v s PRO 955 Ca -0.01 2.07 -0.06 0.00 0.04 0.00 0.00 61.00 63.04 3h3v s PRO 955 Cb 0.01 -3.83 0.04 0.00 0.04 0.00 0.00 34.50 30.76 3h3v s PRO 955 CO -0.07 -0.76 0.22 -0.51 0.04 0.00 0.00 177.00 175.93 3h3v s LEU 956 N 3.47 0.74 0.78 -3.56 1.43 -0.67 -4.88 118.68 116.00 3h3v s LEU 956 Ca 0.68 0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 54.10 3h3v s LEU 956 Cb -0.32 0.70 0.01 0.00 0.03 0.00 0.00 46.19 46.62 3h3v s LEU 956 CO 0.27 -0.13 0.76 -0.81 0.23 0.00 0.00 176.35 176.67 3h3v n PRO 957 N 3.73 0.20 -2.17 1.29 -0.04 -1.26 -3.46 135.00 133.30 3h3v n PRO 957 Ca -0.21 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 3h3v n PRO 957 Cb 0.55 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 3h3v n PRO 957 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3h3v n VAL 958 N -2.85-12.57 -2.76 0.52 0.31 -1.26 -4.79 118.33 94.92 3h3v n VAL 958 Ca 0.11 2.97 -0.43 0.00 -0.01 0.00 0.00 64.34 66.99 3h3v n VAL 958 Cb 0.51 -5.74 -0.03 0.00 -0.91 0.00 0.00 33.84 27.67 3h3v n VAL 958 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3h3v s ASN 959 N -0.53 6.45 0.46 4.52 3.84 -1.26 -4.80 114.94 123.60 3h3v s ASN 959 Ca 0.00 -1.48 0.23 0.00 0.21 0.00 0.00 52.86 51.82 3h3v s ASN 959 Cb 0.00 -2.47 1.08 0.00 -0.55 0.00 0.00 41.25 39.31 3h3v s ASN 959 CO 0.00 -1.36 1.91 0.40 -2.79 0.00 0.00 177.10 175.26 3h3v h ILE 960 N 6.17 0.69 0.28 -5.21 2.04 -1.93 -2.58 117.51 116.98 3h3v h ILE 960 Ca 0.03 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 3h3v h ILE 960 Cb 1.03 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 3h3v h ILE 960 CO 1.24 0.22 -0.14 -0.09 0.00 0.00 0.00 178.15 179.38 3h3v h ARG 961 N 0.00 -0.37 0.04 2.37 2.43 -2.00 -3.17 114.38 113.68 3h3v h ARG 961 Ca -0.00 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3h3v h ARG 961 Cb 0.59 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 3h3v h ARG 961 CO 0.03 -0.24 -0.04 0.00 -1.51 0.00 0.00 179.97 178.20 3h3v h ARG 962 N -0.39 -0.09 -1.14 0.20 3.08 -1.98 -2.84 114.38 111.21 3h3v h ARG 962 Ca -0.04 0.01 0.40 0.00 0.07 0.00 0.00 59.98 60.42 3h3v h ARG 962 Cb 0.29 0.02 -0.12 0.00 0.08 0.00 0.00 29.97 30.24 3h3v h ARG 962 CO 0.06 -0.06 0.73 1.51 -1.07 0.00 0.00 179.97 181.14 3h3v n ILE 963 N -5.15 -0.22 0.01 2.04 3.06 -0.97 0.12 119.36 118.25 3h3v n ILE 963 Ca -0.07 1.52 -0.10 0.00 -2.50 0.00 0.00 62.75 61.60 3h3v n ILE 963 Cb 0.08 -2.49 -0.08 0.00 0.54 0.00 0.00 39.64 37.69 3h3v n ILE 963 CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 3h3v h ILE 964 N 0.00 0.91 -0.98 9.51 2.04 -1.47 -3.08 117.51 124.44 3h3v h ILE 964 Ca 0.74 -1.37 0.33 0.00 1.00 0.00 0.00 64.86 65.56 3h3v h ILE 964 Cb 2.36 1.62 -0.16 0.00 -0.74 0.00 0.00 36.82 39.90 3h3v h ILE 964 CO -0.40 0.27 0.44 1.56 0.00 0.00 0.00 178.15 180.01 3h3v h GLN 965 N -0.91 0.15 0.41 2.37 4.20 0.94 0.86 115.11 123.12 3h3v h GLN 965 Ca -0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 3h3v h GLN 965 Cb 0.54 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.29 3h3v h GLN 965 CO 0.02 0.10 -0.20 -0.91 -0.67 0.00 0.00 178.83 177.18 3h3v h ASN 966 N 0.15 -0.46 -0.71 1.46 2.35 -1.34 -2.19 115.58 114.84 3h3v h ASN 966 Ca 0.73 -0.03 0.16 0.00 -0.55 0.00 0.00 56.30 56.60 3h3v h ASN 966 Cb 1.72 0.12 -0.11 0.00 0.05 0.00 0.00 38.32 40.10 3h3v h ASN 966 CO -0.71 -0.26 0.10 0.00 -1.65 0.00 0.00 177.43 174.91 3h3v h ALA 967 N -0.07 0.84 -2.64 -0.83 0.00 0.57 -1.56 119.26 115.57 3h3v h ALA 967 Ca -0.06 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h3v h ALA 967 Cb 0.47 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3h3v h ALA 967 CO 0.09 -0.38 0.00 1.04 0.00 0.00 0.00 179.25 180.01 3h3v n GLN 968 N -5.23 0.00 0.00 0.00 1.13 0.14 -1.14 117.38 112.29 3h3v n GLN 968 Ca 0.13 0.39 0.00 0.00 -1.94 0.00 0.00 57.00 55.58 3h3v n GLN 968 Cb 0.44 -0.83 0.00 0.00 0.11 0.00 0.00 30.24 29.96 3h3v n GLN 968 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3h3v n GLN 969 N -0.84 0.89 0.02 -1.09 10.64 -1.11 -2.83 117.38 123.07 3h3v n GLN 969 Ca 0.00 0.00 0.11 0.00 -1.83 0.00 0.00 57.00 55.28 3h3v n GLN 969 Cb 0.00 -1.26 -0.09 0.00 -0.86 0.00 0.00 30.24 28.02 3h3v n GLN 969 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 3h3v n THR 970 N -0.17 0.17 -1.15 -0.39 -1.04 -0.29 -4.14 114.28 107.27 3h3v n THR 970 Ca 0.00 -0.43 0.07 0.00 -2.04 0.00 0.00 64.05 61.65 3h3v n THR 970 Cb 0.13 0.04 0.09 0.00 -1.82 0.00 0.00 70.33 68.77 3h3v n THR 970 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3h3v n PHE 971 N -2.24 0.00 -3.65 -1.42 3.01 -1.04 -4.99 117.46 107.12 3h3v n PHE 971 Ca -0.01 -0.73 -0.30 0.00 1.01 0.00 0.00 57.45 57.42 3h3v n PHE 971 Cb 0.52 -0.12 -0.06 0.00 -0.01 0.00 0.00 39.48 39.82 3h3v n PHE 971 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 3h3v n HIS 972 N -1.02 -0.82 -1.88 1.38 8.25 -1.16 -4.79 115.22 115.19 3h3v n HIS 972 Ca 0.11 0.48 -0.42 0.00 -0.26 0.00 0.00 57.72 57.63 3h3v n HIS 972 Cb 0.61 -1.34 -0.03 0.00 1.12 0.00 0.00 29.99 30.35 3h3v n HIS 972 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3h3v s ILE 973 N -2.64 2.51 -0.16 1.59 1.01 -1.21 -4.98 121.20 117.31 3h3v s ILE 973 Ca 0.56 0.33 -0.12 0.00 0.00 0.00 0.00 60.65 61.43 3h3v s ILE 973 Cb -0.33 -3.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 3h3v s ILE 973 CO 0.72 0.02 0.23 1.51 0.00 0.00 0.00 174.94 177.43 3h3v s ASP 974 N 1.32 6.38 0.00 3.58 -4.77 -1.26 -4.96 116.67 116.96 3h3v s ASP 974 Ca 0.72 0.44 -0.01 0.00 -3.30 0.00 0.00 52.55 50.39 3h3v s ASP 974 Cb -0.45 -2.14 -0.05 0.00 -1.09 0.00 0.00 42.92 39.19 3h3v s ASP 974 CO 0.32 0.17 1.30 1.41 0.70 0.00 0.00 175.17 179.07 3h3v n HIS 975 N 3.31 0.00 0.10 2.11 8.25 -1.26 -3.53 115.22 124.20 3h3v n HIS 975 Ca -0.14 -0.55 0.00 0.00 -0.26 0.00 0.00 57.72 56.77 3h3v n HIS 975 Cb 0.52 -0.59 0.00 0.00 1.12 0.00 0.00 29.99 31.05 3h3v n HIS 975 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3h3v n THR 976 N 2.15 0.06 -0.74 1.59 -2.24 -1.26 -5.12 114.28 108.71 3h3v n THR 976 Ca 0.07 0.02 -0.30 0.00 -2.27 0.00 0.00 64.05 61.57 3h3v n THR 976 Cb 0.30 -0.43 0.18 0.00 -2.10 0.00 0.00 70.33 68.28 3h3v n THR 976 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3h3v s LYS 977 N -1.72 0.70 0.71 -0.78 1.02 -1.23 -4.88 119.74 113.56 3h3v s LYS 977 Ca 0.00 1.32 -0.11 0.00 0.02 0.00 0.00 55.97 57.20 3h3v s LYS 977 Cb 0.00 -1.71 0.01 0.00 -0.52 0.00 0.00 37.83 35.62 3h3v s LYS 977 CO 0.00 -2.77 1.07 -1.25 -0.92 0.00 0.00 175.35 171.48 3h3v s PRO 978 N -4.65 2.85 0.00 -1.68 0.04 -1.26 -4.87 135.00 125.43 3h3v s PRO 978 Ca 0.66 0.77 0.00 0.00 0.04 0.00 0.00 61.00 62.48 3h3v s PRO 978 Cb -0.22 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.32 3h3v s PRO 978 CO 0.59 -1.12 0.00 0.45 0.04 0.00 0.00 177.00 176.97 3h3v n SER 979 N -3.11 0.00 0.00 6.66 2.88 0.38 -4.76 113.62 115.67 3h3v n SER 979 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 3h3v n SER 979 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 3h3v n SER 979 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3h3v n ASP 980 N 0.00 0.00 -4.66 -3.46 5.75 -1.26 -4.22 116.55 108.70 3h3v n ASP 980 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 54.79 54.43 3h3v n ASP 980 Cb 0.00 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.00 3h3v n ASP 980 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3h3v s LEU 981 N 0.00 3.99 0.69 -2.12 1.43 -1.26 -4.64 118.68 116.76 3h3v s LEU 981 Ca 0.00 0.12 -0.13 0.00 -1.03 0.00 0.00 54.13 53.09 3h3v s LEU 981 Cb 0.00 -2.03 0.01 0.00 0.03 0.00 0.00 46.19 44.20 3h3v s LEU 981 CO 0.00 0.14 1.08 -0.89 0.23 0.00 0.00 176.35 176.91 3h3v s THR 982 N 0.58 3.63 0.34 5.49 2.01 -1.26 -4.83 115.64 121.60 3h3v s THR 982 Ca 0.06 0.63 0.02 0.00 0.31 0.00 0.00 61.69 62.71 3h3v s THR 982 Cb -0.12 -3.20 0.24 0.00 0.01 0.00 0.00 72.50 69.42 3h3v s THR 982 CO 0.01 -0.60 1.98 0.40 -0.69 0.00 0.00 174.62 175.72 3h3v h ILE 983 N -0.41 1.17 -0.08 1.82 2.04 -1.99 0.74 117.51 120.80 3h3v h ILE 983 Ca -0.45 -0.40 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 3h3v h ILE 983 Cb 1.23 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 3h3v h ILE 983 CO 0.55 0.18 -0.20 0.50 0.00 0.00 0.00 178.15 179.18 3h3v h LYS 984 N 0.80 0.12 0.26 2.37 3.64 -1.98 -2.22 116.57 119.57 3h3v h LYS 984 Ca 0.21 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 3h3v h LYS 984 Cb -0.00 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3h3v h LYS 984 CO -0.04 0.33 -0.15 -0.44 -2.27 0.00 0.00 179.45 176.89 3h3v h ASP 985 N 0.12 -0.37 0.00 4.20 3.32 -1.19 -2.64 116.42 119.86 3h3v h ASP 985 Ca 0.02 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3h3v h ASP 985 Cb 0.43 0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.09 3h3v h ASP 985 CO 0.03 -0.23 0.00 -0.38 -1.72 0.00 0.00 179.24 176.94 3h3v n ILE 986 N -3.14 0.00 -0.61 0.35 5.41 -0.96 -1.29 119.36 119.12 3h3v n ILE 986 Ca -0.05 0.93 0.48 0.00 1.00 0.00 0.00 62.75 65.11 3h3v n ILE 986 Cb 0.15 -1.61 0.77 0.00 -0.71 0.00 0.00 39.64 38.25 3h3v n ILE 986 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3h3v h VAL 987 N 0.00 0.04 0.04 1.39 2.07 -1.56 -0.81 116.25 117.42 3h3v h VAL 987 Ca 0.00 -0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.43 3h3v h VAL 987 Cb 0.00 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.80 3h3v h VAL 987 CO 0.00 0.00 -0.41 -0.07 0.02 0.00 0.00 177.57 177.11 3h3v h LEU 988 N 0.01 0.12 -2.05 2.57 3.38 -1.29 -3.12 115.31 114.93 3h3v h LEU 988 Ca 0.90 -0.92 0.09 0.00 0.09 0.00 0.00 57.88 58.04 3h3v h LEU 988 Cb 3.38 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 44.08 3h3v h LEU 988 CO -0.15 1.18 0.24 1.23 0.09 0.00 0.00 178.44 181.03 3h3v h GLY 989 N -0.80 0.00 0.52 0.83 0.00 0.20 0.26 103.07 104.08 3h3v h GLY 989 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 3h3v h GLY 989 CO 0.01 0.00 -0.06 -2.08 0.00 0.00 0.00 176.54 174.41 3h3v h VAL 990 N 0.00 1.07 -0.10 4.60 2.07 -1.55 -0.05 116.25 122.29 3h3v h VAL 990 Ca 0.15 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.70 3h3v h VAL 990 Cb 0.62 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 3h3v h VAL 990 CO -0.00 0.23 0.24 0.50 0.02 0.00 0.00 177.57 178.56 3h3v h LYS 991 N -0.65 0.00 0.00 1.57 3.64 -0.93 -1.69 116.57 118.51 3h3v h LYS 991 Ca -0.02 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 3h3v h LYS 991 Cb 0.50 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3h3v h LYS 991 CO 0.03 0.00 -0.59 -0.44 -2.27 0.00 0.00 179.45 176.18 3h3v h ASP 992 N 0.00 0.00 -0.64 4.20 3.32 -0.93 -3.36 116.42 119.01 3h3v h ASP 992 Ca 0.05 -0.56 0.10 0.00 0.02 0.00 0.00 57.03 56.63 3h3v h ASP 992 Cb 0.52 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.97 3h3v h ASP 992 CO -0.00 1.12 -0.25 -0.11 -1.72 0.00 0.00 179.24 178.28 3h3v n LEU 993 N -4.56 -0.42 0.00 1.55 7.94 -0.05 -0.70 117.00 120.76 3h3v n LEU 993 Ca -0.18 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.84 3h3v n LEU 993 Cb 0.48 -0.25 0.00 0.00 0.53 0.00 0.00 43.42 44.18 3h3v n LEU 993 CO 0.21 -1.00 0.46 0.00 -1.11 0.00 0.00 177.39 175.95 3h3v n GLN 994 N -4.94 0.00 -0.18 1.96 6.02 -1.12 -1.97 117.38 117.15 3h3v n GLN 994 Ca 0.06 0.78 0.14 0.00 -0.01 0.00 0.00 57.00 57.97 3h3v n GLN 994 Cb 0.25 -1.42 0.21 0.00 1.02 0.00 0.00 30.24 30.31 3h3v n GLN 994 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3h3v n GLU 995 N -2.42 -0.00 0.03 -1.09 -0.58 0.12 0.81 120.64 117.51 3h3v n GLU 995 Ca 0.00 0.29 0.05 0.00 -0.42 0.00 0.00 57.16 57.08 3h3v n GLU 995 Cb 0.00 -0.66 -0.09 0.00 -0.57 0.00 0.00 31.44 30.12 3h3v n GLU 995 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3h3v n ASN 996 N -2.59 0.54 -3.21 1.62 3.02 -0.83 -4.62 115.26 109.18 3h3v n ASN 996 Ca 0.12 0.22 -0.19 0.00 -0.03 0.00 0.00 54.58 54.70 3h3v n ASN 996 Cb 0.52 0.81 -0.04 0.00 -0.61 0.00 0.00 39.78 40.47 3h3v n ASN 996 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3h3v n LEU 997 N -2.65 1.65 -4.63 3.41 4.77 0.24 -4.83 117.00 114.97 3h3v n LEU 997 Ca -0.08 -1.69 -0.43 0.00 -0.03 0.00 0.00 56.01 53.78 3h3v n LEU 997 Cb 0.72 -0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 3h3v n LEU 997 CO 0.43 -0.95 1.15 -0.76 -1.33 0.00 0.00 177.39 175.93 3h3v s LEU 998 N 0.14 3.87 0.00 2.23 1.02 -1.26 -4.92 118.68 119.76 3h3v s LEU 998 Ca 0.29 1.20 0.00 0.00 0.02 0.00 0.00 54.13 55.65 3h3v s LEU 998 Cb 0.07 -3.54 0.00 0.00 0.02 0.00 0.00 46.19 42.74 3h3v s LEU 998 CO 0.08 -1.10 0.00 0.52 0.02 0.00 0.00 176.35 175.87 3h3v n VAL 999 N 6.25 0.00 -3.17 -1.59 0.31 -1.26 -4.88 118.33 113.99 3h3v n VAL 999 Ca 0.15 0.23 -0.39 0.00 -0.01 0.00 0.00 64.34 64.32 3h3v n VAL 999 Cb 0.47 -1.02 -0.06 0.00 -0.91 0.00 0.00 33.84 32.31 3h3v n VAL 999 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3h3v s LEU 1000N -3.33 4.54 -0.13 7.52 1.43 -1.26 -5.00 118.68 122.44 3h3v s LEU 1000Ca 0.00 1.39 -0.05 0.00 -1.03 0.00 0.00 54.13 54.44 3h3v s LEU 1000Cb 0.00 -3.07 -0.25 0.00 0.03 0.00 0.00 46.19 42.90 3h3v s LEU 1000CO 0.00 0.24 0.30 -1.14 0.23 0.00 0.00 176.35 175.98 3h3v n ARG 1001N 1.60 0.74 0.00 1.70 0.63 -1.26 -4.80 116.66 115.28 3h3v n ARG 1001Ca -0.08 0.25 0.00 0.00 -0.92 0.00 0.00 57.85 57.10 3h3v n ARG 1001Cb 0.50 -1.69 0.00 0.00 0.45 0.00 0.00 32.46 31.72 3h3v n ARG 1001CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3h3v n GLY 1002N 2.01 0.00 0.21 5.14 0.00 -1.26 -4.91 105.19 106.38 3h3v n GLY 1002Ca -0.33 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.71 3h3v n GLY 1002CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3h3v n LYS 1003N 0.00 0.07 -0.78 1.61 3.00 -1.26 -4.75 118.16 116.05 3h3v n LYS 1003Ca 0.00 -0.91 0.00 0.00 -0.00 0.00 0.00 58.31 57.40 3h3v n LYS 1003Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 35.03 33.93 3h3v n LYS 1003CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 3h3v n ASN 1004N 0.24 1.59 0.00 3.14 0.23 -1.26 -5.02 115.26 114.19 3h3v n ASN 1004Ca 0.03 -0.44 0.00 0.00 -0.53 0.00 0.00 54.58 53.65 3h3v n ASN 1004Cb 0.15 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.85 3h3v n ASN 1004CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 3h3v n GLU 1005N -0.09 0.00 -0.25 -3.83 4.07 -1.26 -2.70 120.64 116.58 3h3v n GLU 1005Ca 0.00 0.37 -0.07 0.00 -0.06 0.00 0.00 57.16 57.40 3h3v n GLU 1005Cb 0.00 -1.01 -0.06 0.00 -0.06 0.00 0.00 31.44 30.31 3h3v n GLU 1005CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 3h3v n ILE 1006N -1.60 -0.41 0.05 6.31 5.41 -1.26 -0.37 119.36 127.49 3h3v n ILE 1006Ca 0.00 1.67 -0.06 0.00 1.00 0.00 0.00 62.75 65.36 3h3v n ILE 1006Cb 0.00 -2.09 -0.04 0.00 -0.71 0.00 0.00 39.64 36.81 3h3v n ILE 1006CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3h3v h ILE 1007N 0.00 0.00 -1.20 1.39 1.08 -1.98 -0.83 117.51 115.97 3h3v h ILE 1007Ca 0.10 0.00 0.38 0.00 -0.39 0.00 0.00 64.86 64.95 3h3v h ILE 1007Cb 0.25 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 33.87 3h3v h ILE 1007CO -0.57 0.00 0.75 1.56 -0.69 0.00 0.00 178.15 179.21 3h3v h GLN 1008N -0.28 0.17 -0.12 2.37 1.08 -1.10 1.32 115.11 118.54 3h3v h GLN 1008Ca -0.00 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.20 3h3v h GLN 1008Cb 0.28 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.65 3h3v h GLN 1008CO -0.10 0.12 0.00 -0.91 -0.95 0.00 0.00 178.83 176.99 3h3v h ASN 1009N 0.18 -0.04 -0.67 1.46 2.35 0.69 -1.97 115.58 117.58 3h3v h ASN 1009Ca 0.76 0.03 0.14 0.00 -0.55 0.00 0.00 56.30 56.67 3h3v h ASN 1009Cb 2.20 0.04 -0.10 0.00 0.05 0.00 0.00 38.32 40.51 3h3v h ASN 1009CO -0.44 -0.00 0.16 0.00 -1.65 0.00 0.00 177.43 175.50 3h3v h ALA 1010N 1.10 0.84 -0.24 -0.83 0.00 0.25 -2.04 119.26 118.34 3h3v h ALA 1010Ca 0.06 0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.14 3h3v h ALA 1010Cb 0.06 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3h3v h ALA 1010CO -0.09 -0.31 -0.20 0.37 0.00 0.00 0.00 179.25 179.01 3h3v h GLN 1011N 0.27 -0.07 -0.72 0.00 5.75 -0.69 0.44 115.11 120.09 3h3v h GLN 1011Ca 0.37 0.00 0.13 0.00 -0.15 0.00 0.00 58.65 59.00 3h3v h GLN 1011Cb 0.58 0.02 -0.13 0.00 1.07 0.00 0.00 27.48 29.02 3h3v h GLN 1011CO -0.45 -0.05 -0.32 0.00 -2.65 0.00 0.00 178.83 175.36 3h3v h ARG 1012N -0.07 -0.09 0.00 1.69 3.08 -1.24 -0.99 114.38 116.76 3h3v h ARG 1012Ca 0.04 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3h3v h ARG 1012Cb 0.18 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3h3v h ARG 1012CO -0.27 -0.06 0.00 -0.25 -1.07 0.00 0.00 179.97 178.32 3h3v n ASP 1013N -5.46 0.00 -0.57 7.04 8.00 0.08 -0.09 116.55 125.56 3h3v n ASP 1013Ca 0.07 0.76 0.45 0.00 0.71 0.00 0.00 54.79 56.78 3h3v n ASP 1013Cb 0.37 -0.26 0.73 0.00 -0.02 0.00 0.00 41.12 41.94 3h3v n ASP 1013CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h3v n ALA 1014N -1.68 1.58 -0.07 2.24 0.00 0.13 -2.38 120.51 120.33 3h3v n ALA 1014Ca 0.00 0.77 -0.04 0.00 0.00 0.00 0.00 53.44 54.18 3h3v n ALA 1014Cb 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.35 3h3v n ALA 1014CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h3v h VAL 1015N 0.00 0.00 0.00 0.00 2.07 -0.51 -3.43 116.25 114.38 3h3v h VAL 1015Ca 0.90 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3h3v h VAL 1015Cb 3.20 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.97 3h3v h VAL 1015CO -0.28 0.00 0.00 0.41 0.02 0.00 0.00 177.57 177.72 3h3v n THR 1016N -4.59 0.00 0.13 2.57 -1.04 0.88 -0.60 114.28 111.62 3h3v n THR 1016Ca -0.06 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.81 3h3v n THR 1016Cb 0.21 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.65 3h3v n THR 1016CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3h3v h LEU 1017N 0.00 -1.14 -0.83 -4.42 5.85 -1.85 -2.23 115.31 110.69 3h3v h LEU 1017Ca 0.00 0.13 0.19 0.00 0.84 0.00 0.00 57.88 59.03 3h3v h LEU 1017Cb 0.00 0.43 -0.15 0.00 0.37 0.00 0.00 40.66 41.30 3h3v h LEU 1017CO 0.00 -0.48 -0.10 0.15 -0.34 0.00 0.00 178.44 177.68 3h3v h PHE 1018N -0.64 -0.25 -0.30 1.25 3.57 -1.19 0.36 116.94 119.74 3h3v h PHE 1018Ca 0.02 0.07 0.06 0.00 3.53 0.00 0.00 57.97 61.65 3h3v h PHE 1018Cb 0.66 0.24 -0.08 0.00 2.79 0.00 0.00 35.95 39.56 3h3v h PHE 1018CO -0.33 -0.33 -0.40 0.00 -2.23 0.00 0.00 178.31 175.01 3h3v h LEU 1021N -0.03 0.44 0.46 0.00 5.85 -0.89 0.35 115.31 121.48 3h3v h LEU 1021Ca 0.36 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 59.12 3h3v h LEU 1021Cb 0.60 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.62 3h3v h LEU 1021CO -0.86 0.26 -0.22 0.25 -0.34 0.00 0.00 178.44 177.52 3h3v h LEU 1022N 0.58 -0.52 -2.80 2.25 5.85 0.52 -1.31 115.31 119.87 3h3v h LEU 1022Ca 0.33 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 59.01 3h3v h LEU 1022Cb 0.33 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 3h3v h LEU 1022CO -0.25 -0.29 -0.00 0.03 -0.34 0.00 0.00 178.44 177.59 3h3v h ARG 1023N -0.73 0.00 -0.01 1.25 3.08 0.81 -0.26 114.38 118.51 3h3v h ARG 1023Ca -0.06 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 3h3v h ARG 1023Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 3h3v h ARG 1023CO 0.10 0.00 -0.09 1.03 -1.07 0.00 0.00 179.97 179.95 3h3v h SER 1024N 0.00 0.10 -0.24 7.04 0.87 0.20 -3.25 113.55 118.27 3h3v h SER 1024Ca -0.00 -0.70 0.00 0.00 -1.23 0.00 0.00 61.79 59.86 3h3v h SER 1024Cb 0.06 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 3h3v h SER 1024CO 0.00 0.79 0.00 0.54 -0.53 0.00 0.00 176.83 177.63 3h3v n ARG 1025N -4.66 1.67 -2.66 2.24 5.12 -0.54 -4.01 116.66 113.81 3h3v n ARG 1025Ca -0.09 -1.02 -0.05 0.00 -1.93 0.00 0.00 57.85 54.76 3h3v n ARG 1025Cb 0.39 -1.28 0.04 0.00 -1.16 0.00 0.00 32.46 30.45 3h3v n ARG 1025CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3h3v n LEU 1026N 0.30 2.22 -4.83 0.55 4.77 -0.21 -4.74 117.00 115.05 3h3v n LEU 1026Ca 0.12 -3.35 -0.33 0.00 -0.03 0.00 0.00 56.01 52.42 3h3v n LEU 1026Cb 0.26 0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 41.60 3h3v n LEU 1026CO 0.09 1.24 0.54 0.00 -1.33 0.00 0.00 177.39 177.93 3h3v s ALA 1027N -3.74 3.17 0.15 -1.18 0.00 -1.23 -4.86 121.76 114.08 3h3v s ALA 1027Ca 0.32 0.22 -0.28 0.00 0.00 0.00 0.00 51.96 52.23 3h3v s ALA 1027Cb 0.34 -2.97 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 3h3v s ALA 1027CO -0.03 0.21 1.57 1.15 0.00 0.00 0.00 175.76 178.66 3h3v h THR 1028N 1.89 0.08 0.02 0.00 2.02 -1.92 0.22 112.91 115.23 3h3v h THR 1028Ca -0.48 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.70 3h3v h THR 1028Cb 1.18 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 3h3v h THR 1028CO 0.63 0.00 -0.17 0.03 0.37 0.00 0.00 175.52 176.38 3h3v h ARG 1029N -0.30 -0.23 -0.84 6.66 2.47 -1.84 -2.05 114.38 118.26 3h3v h ARG 1029Ca 0.14 0.02 0.13 0.00 -1.26 0.00 0.00 59.98 59.00 3h3v h ARG 1029Cb 0.58 0.05 -0.14 0.00 -1.65 0.00 0.00 29.97 28.81 3h3v h ARG 1029CO -0.62 -0.15 -0.40 -0.09 0.56 0.00 0.00 179.97 179.27 3h3v h ARG 1030N -0.23 -0.07 -0.86 0.04 2.43 -1.72 1.00 114.38 114.96 3h3v h ARG 1030Ca 0.00 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.31 3h3v h ARG 1030Cb 0.24 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.72 3h3v h ARG 1030CO -0.10 -0.05 0.46 0.28 -1.51 0.00 0.00 179.97 179.05 3h3v h VAL 1031N -0.07 0.76 0.05 0.20 2.07 -0.70 -1.68 116.25 116.88 3h3v h VAL 1031Ca 0.28 -0.23 -0.36 0.00 0.82 0.00 0.00 66.70 67.21 3h3v h VAL 1031Cb 0.57 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.33 3h3v h VAL 1031CO -0.87 0.12 -2.14 0.18 0.02 0.00 0.00 177.57 174.89 3h3v n LEU 1032N -4.84 2.14 -0.04 2.57 4.77 -0.08 -3.70 117.00 117.82 3h3v n LEU 1032Ca 0.17 0.12 -0.01 0.00 -0.03 0.00 0.00 56.01 56.26 3h3v n LEU 1032Cb 0.41 -0.66 -0.00 0.00 -2.33 0.00 0.00 43.42 40.84 3h3v n LEU 1032CO 0.22 0.76 -0.07 -0.61 -1.33 0.00 0.00 177.39 176.36 3h3v h GLN 1033N 0.03 0.00 0.10 3.23 4.15 0.93 -3.34 115.11 120.21 3h3v h GLN 1033Ca -0.46 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 58.95 3h3v h GLN 1033Cb 2.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.71 3h3v h GLN 1033CO 0.03 0.00 -0.05 0.93 -1.93 0.00 0.00 178.83 177.81 3h3v h GLU 1034N -0.79 -0.13 -3.57 1.69 5.08 -1.44 -3.38 114.58 112.05 3h3v h GLU 1034Ca 0.00 0.01 -0.74 0.00 -1.00 0.00 0.00 59.36 57.63 3h3v h GLU 1034Cb 0.11 0.03 -0.32 0.00 0.50 0.00 0.00 28.75 29.07 3h3v h GLU 1034CO 0.00 -0.09 -0.06 1.52 -1.00 0.00 0.00 179.01 179.38 3h3v s TYR 1035N -3.08 3.73 -0.43 4.33 -0.85 -0.84 -5.03 117.35 115.18 3h3v s TYR 1035Ca -0.02 -2.59 -0.42 0.00 -0.52 0.00 0.00 57.07 53.52 3h3v s TYR 1035Cb 0.00 -3.46 -0.17 0.00 0.38 0.00 0.00 41.96 38.71 3h3v s TYR 1035CO 0.06 -0.87 1.98 0.54 -1.52 0.00 0.00 175.55 175.74 3h3v n ARG 1036N 3.22 0.44 -5.14 -3.49 5.12 -1.25 -4.47 116.66 111.09 3h3v n ARG 1036Ca 0.15 0.14 -0.29 0.00 -1.93 0.00 0.00 57.85 55.92 3h3v n ARG 1036Cb 0.40 -1.82 -0.16 0.00 -1.16 0.00 0.00 32.46 29.73 3h3v n ARG 1036CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3h3v s LEU 1037N 5.28 2.04 0.88 0.55 1.43 -1.24 -4.89 118.68 122.73 3h3v s LEU 1037Ca 1.11 -0.42 -0.13 0.00 -1.03 0.00 0.00 54.13 53.66 3h3v s LEU 1037Cb -1.28 -1.19 0.15 0.00 0.03 0.00 0.00 46.19 43.89 3h3v s LEU 1037CO 0.65 0.28 1.23 0.42 0.23 0.00 0.00 176.35 179.16 3h3v s THR 1038N -0.51 2.04 0.37 5.49 -4.23 -1.26 -4.63 115.64 112.90 3h3v s THR 1038Ca 0.08 -0.07 0.05 0.00 -1.18 0.00 0.00 61.69 60.57 3h3v s THR 1038Cb -0.09 -2.97 0.23 0.00 1.34 0.00 0.00 72.50 71.01 3h3v s THR 1038CO -0.01 0.00 1.98 0.50 -0.54 0.00 0.00 174.62 176.56 3h3v h LYS 1039N -1.29 0.63 0.37 3.99 1.63 -1.92 -2.49 116.57 117.49 3h3v h LYS 1039Ca -0.44 -0.07 -0.02 0.00 -0.85 0.00 0.00 60.65 59.27 3h3v h LYS 1039Cb 1.27 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 3h3v h LYS 1039CO 0.48 0.48 -0.18 0.37 -3.45 0.00 0.00 179.45 177.16 3h3v h GLN 1040N 0.63 -0.47 -0.78 1.90 4.15 -1.96 -2.30 115.11 116.28 3h3v h GLN 1040Ca 0.16 0.03 0.10 0.00 0.77 0.00 0.00 58.65 59.72 3h3v h GLN 1040Cb 0.06 0.11 -0.11 0.00 0.21 0.00 0.00 27.48 27.74 3h3v h GLN 1040CO -0.02 -0.32 -0.35 0.00 -1.93 0.00 0.00 178.83 176.21 3h3v n ALA 1041N -2.33 -0.22 0.15 3.38 0.00 -1.14 -0.50 120.51 119.84 3h3v n ALA 1041Ca -0.06 0.74 -0.16 0.00 0.00 0.00 0.00 53.44 53.96 3h3v n ALA 1041Cb 0.19 -0.27 -0.08 0.00 0.00 0.00 0.00 19.45 19.29 3h3v n ALA 1041CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3h3v h PHE 1042N 0.00 -1.30 -0.42 0.00 3.57 -1.48 0.71 116.94 118.03 3h3v h PHE 1042Ca 0.22 0.03 0.12 0.00 3.53 0.00 0.00 57.97 61.87 3h3v h PHE 1042Cb 0.42 0.54 -0.02 0.00 2.79 0.00 0.00 35.95 39.68 3h3v h PHE 1042CO -0.72 -0.57 0.47 -0.44 -2.23 0.00 0.00 178.31 174.83 3h3v h ASP 1043N -0.75 0.00 0.01 0.41 3.32 -0.19 0.33 116.42 119.55 3h3v h ASP 1043Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h3v h ASP 1043Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3h3v h ASP 1043CO -0.21 0.00 -0.01 -0.25 -1.72 0.00 0.00 179.24 177.05 3h3v h TRP 1044N 0.00 -0.01 -0.73 4.55 7.01 -0.04 -2.80 115.95 123.92 3h3v h TRP 1044Ca 0.20 -0.00 0.16 0.00 2.11 0.00 0.00 58.89 61.36 3h3v h TRP 1044Cb 1.14 0.00 -0.12 0.00 -2.10 0.00 0.00 29.16 28.09 3h3v h TRP 1044CO 0.00 0.01 0.07 0.28 -2.79 0.00 0.00 178.44 176.01 3h3v h VAL 1045N -1.00 0.42 0.52 2.65 2.07 0.31 0.02 116.25 121.23 3h3v h VAL 1045Ca -0.00 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 3h3v h VAL 1045Cb 0.03 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.02 3h3v h VAL 1045CO 0.00 0.03 -0.49 -0.07 0.02 0.00 0.00 177.57 177.06 3h3v h LEU 1046N 0.16 -1.35 -0.74 2.57 3.38 -0.53 -1.37 115.31 117.43 3h3v h LEU 1046Ca 0.40 0.11 0.11 0.00 0.09 0.00 0.00 57.88 58.59 3h3v h LEU 1046Cb 0.71 0.44 -0.13 0.00 0.09 0.00 0.00 40.66 41.77 3h3v h LEU 1046CO -0.59 -0.66 -0.40 -1.28 0.09 0.00 0.00 178.44 175.59 3h3v h SER 1047N -1.00 -1.42 -0.01 -0.43 0.87 -0.76 -2.05 113.55 108.75 3h3v h SER 1047Ca -0.07 0.27 0.01 0.00 -1.23 0.00 0.00 61.79 60.77 3h3v h SER 1047Cb 0.86 0.69 -0.01 0.00 -0.44 0.00 0.00 62.40 63.51 3h3v h SER 1047CO -0.05 -0.30 -0.02 0.78 -0.53 0.00 0.00 176.83 176.71 3h3v h ASN 1048N -0.12 -0.06 -0.90 6.23 2.35 -1.07 -1.58 115.58 120.44 3h3v h ASN 1048Ca 0.25 0.01 0.25 0.00 -0.55 0.00 0.00 56.30 56.25 3h3v h ASN 1048Cb 0.56 0.03 -0.15 0.00 0.05 0.00 0.00 38.32 38.81 3h3v h ASN 1048CO -0.80 -0.03 0.19 0.40 -1.65 0.00 0.00 177.43 175.55 3h3v h ILE 1049N -0.03 0.24 0.00 2.81 2.04 -0.56 0.44 117.51 122.45 3h3v h ILE 1049Ca 0.01 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.82 3h3v h ILE 1049Cb 0.05 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 3h3v h ILE 1049CO -0.03 0.03 0.00 1.21 0.00 0.00 0.00 178.15 179.36 3h3v n GLU 1050N -5.29 0.00 -0.54 2.37 2.13 -0.67 -1.27 120.64 117.37 3h3v n GLU 1050Ca 0.22 0.00 0.41 0.00 0.66 0.00 0.00 57.16 58.45 3h3v n GLU 1050Cb 0.71 -0.71 0.65 0.00 0.27 0.00 0.00 31.44 32.37 3h3v n GLU 1050CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h3v n ALA 1051N -1.66 1.46 0.08 4.31 0.00 -0.73 0.33 120.51 124.29 3h3v n ALA 1051Ca 0.00 0.60 -0.08 0.00 0.00 0.00 0.00 53.44 53.96 3h3v n ALA 1051Cb 0.00 -0.93 -0.07 0.00 0.00 0.00 0.00 19.45 18.45 3h3v n ALA 1051CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3h3v h GLN 1052N 0.00 0.06 0.50 0.00 4.15 -0.13 -3.11 115.11 116.58 3h3v h GLN 1052Ca 0.77 -0.09 -0.02 0.00 0.77 0.00 0.00 58.65 60.07 3h3v h GLN 1052Cb 2.93 0.03 0.00 0.00 0.21 0.00 0.00 27.48 30.66 3h3v h GLN 1052CO -0.12 0.98 -0.24 0.35 -1.93 0.00 0.00 178.83 177.87 3h3v h PHE 1053N 0.03 -0.62 0.00 3.99 3.57 0.69 -2.75 116.94 121.85 3h3v h PHE 1053Ca -0.03 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.45 3h3v h PHE 1053Cb 1.68 0.21 0.00 0.00 2.79 0.00 0.00 35.95 40.62 3h3v h PHE 1053CO 0.01 -0.39 0.28 1.28 -2.23 0.00 0.00 178.31 177.27 3h3v n LEU 1054N -4.35 0.01 -0.02 0.59 4.77 -0.56 0.14 117.00 117.58 3h3v n LEU 1054Ca -0.08 0.23 -0.22 0.00 -0.03 0.00 0.00 56.01 55.91 3h3v n LEU 1054Cb 0.26 -0.23 -0.13 0.00 -2.33 0.00 0.00 43.42 40.99 3h3v n LEU 1054CO 0.20 -0.23 -0.77 0.54 -1.33 0.00 0.00 177.39 175.80 3h3v n ARG 1055N -1.24 0.72 0.00 3.23 1.74 -1.12 -4.11 116.66 115.88 3h3v n ARG 1055Ca -0.00 0.33 0.02 0.00 -0.77 0.00 0.00 57.85 57.43 3h3v n ARG 1055Cb 0.28 -1.71 0.12 0.00 -1.02 0.00 0.00 32.46 30.13 3h3v n ARG 1055CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3h3v n SER 1056N -3.69 0.00 -4.78 0.55 7.64 0.36 -4.75 113.62 108.95 3h3v n SER 1056Ca -0.32 -0.40 -0.29 0.00 1.01 0.00 0.00 58.87 58.86 3h3v n SER 1056Cb 0.97 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 64.28 3h3v n SER 1056CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3h3v s VAL 1057N -2.00 2.57 0.36 0.44 1.01 -1.18 -2.00 120.40 119.59 3h3v s VAL 1057Ca 0.06 0.18 -0.13 0.00 0.00 0.00 0.00 61.98 62.09 3h3v s VAL 1057Cb 0.03 -2.89 -0.08 0.00 0.00 0.00 0.00 36.38 33.44 3h3v s VAL 1057CO 0.05 -0.24 0.75 -0.69 0.00 0.00 0.00 175.10 174.96 3h3v s VAL 1058N -3.17 4.73 -0.33 2.92 1.01 0.06 -3.81 120.40 121.81 3h3v s VAL 1058Ca 0.62 0.81 -0.14 0.00 0.00 0.00 0.00 61.98 63.27 3h3v s VAL 1058Cb -0.15 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 3h3v s VAL 1058CO 0.54 -0.33 0.29 -1.00 0.00 0.00 0.00 175.10 174.60 3h3v s HIS 1059N -2.15 3.22 -0.24 5.22 3.76 -1.26 -4.96 115.29 118.87 3h3v s HIS 1059Ca 0.53 -0.07 -0.34 0.00 -0.15 0.00 0.00 55.06 55.03 3h3v s HIS 1059Cb -0.10 -2.55 -0.11 0.00 1.11 0.00 0.00 32.58 30.93 3h3v s HIS 1059CO 0.23 -0.36 2.06 -2.30 -0.85 0.00 0.00 174.74 173.53 3h3v n PRO 1060N 5.23 1.56 0.00 8.40 -0.02 -1.26 -1.23 135.00 147.67 3h3v n PRO 1060Ca -0.11 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 3h3v n PRO 1060Cb 0.50 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 3h3v n PRO 1060CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h3v n GLY 1061N 5.57 1.11 3.65 -1.23 0.00 -0.84 -4.87 105.19 108.58 3h3v n GLY 1061Ca 0.33 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 3h3v n GLY 1061CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3v n GLU 1062N 0.00 2.65 -0.70 1.61 -0.58 -0.37 -2.15 120.64 121.10 3h3v n GLU 1062Ca 0.00 0.93 -0.06 0.00 -0.42 0.00 0.00 57.16 57.61 3h3v n GLU 1062Cb 0.00 -3.04 -0.09 0.00 -0.57 0.00 0.00 31.44 27.74 3h3v n GLU 1062CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3h3v n MET 1063N 7.75 1.40 -0.04 3.49 2.81 -1.26 -2.23 117.12 129.03 3h3v n MET 1063Ca 0.22 -0.52 -0.01 0.00 -1.81 0.00 0.00 57.70 55.58 3h3v n MET 1063Cb 0.41 -1.58 -0.01 0.00 -0.71 0.00 0.00 33.22 31.33 3h3v n MET 1063CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3h3v n VAL 1064N 2.16 -0.06 -0.40 2.03 0.31 -1.22 -1.20 118.33 119.95 3h3v n VAL 1064Ca 0.22 0.21 -0.08 0.00 -0.01 0.00 0.00 64.34 64.69 3h3v n VAL 1064Cb 0.66 -0.26 -0.05 0.00 -0.91 0.00 0.00 33.84 33.27 3h3v n VAL 1064CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3h3v h GLY 1065N 0.00 -0.54 0.98 2.92 0.00 -0.94 0.99 103.07 106.48 3h3v h GLY 1065Ca 0.02 0.70 0.00 0.00 0.00 0.00 0.00 47.33 48.06 3h3v h GLY 1065CO -0.08 -0.04 0.17 -2.08 0.00 0.00 0.00 176.54 174.50 3h3v h VAL 1066N -0.01 1.06 0.00 4.60 2.07 -1.07 0.83 116.25 123.72 3h3v h VAL 1066Ca 0.22 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.62 3h3v h VAL 1066Cb 0.48 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 3h3v h VAL 1066CO -0.94 0.06 0.00 -0.11 0.02 0.00 0.00 177.57 176.60 3h3v n LEU 1067N -4.92 0.00 -0.36 2.57 -0.00 0.42 -0.69 117.00 114.03 3h3v n LEU 1067Ca -0.02 0.78 0.26 0.00 -0.00 0.00 0.00 56.01 57.03 3h3v n LEU 1067Cb 0.03 -0.28 0.51 0.00 -0.00 0.00 0.00 43.42 43.68 3h3v n LEU 1067CO 0.34 -0.28 1.18 0.00 -0.00 0.00 0.00 177.39 178.63 3h3v h ALA 1068N -1.80 2.20 0.05 1.96 0.00 0.89 0.29 119.26 122.85 3h3v h ALA 1068Ca 0.00 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.05 3h3v h ALA 1068Cb 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3h3v h ALA 1068CO 0.00 -0.73 -0.23 0.00 0.00 0.00 0.00 179.25 178.29 3h3v h ALA 1069N 1.70 -0.35 0.10 0.00 0.00 0.13 -2.87 119.26 117.97 3h3v h ALA 1069Ca 0.69 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.58 3h3v h ALA 1069Cb 1.76 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.94 3h3v h ALA 1069CO -0.44 -0.75 -0.05 1.96 0.00 0.00 0.00 179.25 179.97 3h3v h GLN 1070N -0.40 -0.13 -0.98 0.00 4.20 0.18 -2.80 115.11 115.18 3h3v h GLN 1070Ca 0.05 0.01 0.28 0.00 0.06 0.00 0.00 58.65 59.05 3h3v h GLN 1070Cb 0.45 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.22 3h3v h GLN 1070CO -0.18 0.06 1.07 0.77 -0.67 0.00 0.00 178.83 179.89 3h3v h SER 1071N -0.29 0.00 0.01 1.46 0.02 -0.82 -0.31 113.55 113.63 3h3v h SER 1071Ca -0.01 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.58 3h3v h SER 1071Cb 0.24 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.73 3h3v h SER 1071CO 0.02 0.00 -1.96 -0.38 -1.14 0.00 0.00 176.83 173.37 3h3v n ILE 1072N -3.40 1.54 1.20 3.27 5.41 -1.08 -4.26 119.36 122.04 3h3v n ILE 1072Ca 0.22 -0.26 0.00 0.00 1.00 0.00 0.00 62.75 63.71 3h3v n ILE 1072Cb 1.38 -1.92 0.00 0.00 -0.71 0.00 0.00 39.64 38.39 3h3v n ILE 1072CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3h3v n GLY 1073N 1.42 0.79 0.05 7.39 0.00 -0.55 -3.22 105.19 111.07 3h3v n GLY 1073Ca -0.43 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.54 3h3v n GLY 1073CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h3v n GLU 1074N -0.11 0.33 0.00 1.61 0.00 -0.23 -4.05 120.64 118.18 3h3v n GLU 1074Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 57.16 57.41 3h3v n GLU 1074Cb 0.17 -1.21 0.00 0.00 0.00 0.00 0.00 31.44 30.41 3h3v n GLU 1074CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 3h3v n PRO 1075N -3.79 0.71 -0.02 5.31 -0.04 -1.23 -0.87 135.00 135.08 3h3v n PRO 1075Ca -0.08 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.37 3h3v n PRO 1075Cb 0.28 -1.33 -0.12 0.00 -0.04 0.00 0.00 33.50 32.29 3h3v n PRO 1075CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3v n ALA 1076N 0.09 1.94 0.00 0.55 0.00 -1.20 -4.10 120.51 117.80 3h3v n ALA 1076Ca 0.00 -0.77 -0.09 0.00 0.00 0.00 0.00 53.44 52.58 3h3v n ALA 1076Cb 0.17 -0.70 -0.14 0.00 0.00 0.00 0.00 19.45 18.78 3h3v n ALA 1076CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3h3v h THR 1077N 0.00 1.07 0.00 0.00 2.02 -1.15 -3.31 112.91 111.53 3h3v h THR 1077Ca -0.25 -2.88 0.00 0.00 0.77 0.00 0.00 66.41 64.05 3h3v h THR 1077Cb 1.69 2.54 0.00 0.00 -1.74 0.00 0.00 68.15 70.64 3h3v h THR 1077CO 0.04 0.62 0.00 0.00 0.37 0.00 0.00 175.52 176.55 3h3v n GLN 1078N -3.14 0.83 -3.28 6.66 1.13 -1.20 -4.67 117.38 113.71 3h3v n GLN 1078Ca -0.13 0.00 -0.46 0.00 -1.94 0.00 0.00 57.00 54.47 3h3v n GLN 1078Cb 1.02 -1.18 -0.03 0.00 0.11 0.00 0.00 30.24 30.16 3h3v n GLN 1078CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 3h3v s MET 1079N -1.56 3.30 -0.62 -1.09 -1.94 -1.25 -5.01 119.30 111.13 3h3v s MET 1079Ca 0.00 -2.00 -0.15 0.00 -1.71 0.00 0.00 55.69 51.82 3h3v s MET 1079Cb 0.00 -4.39 0.16 0.00 2.01 0.00 0.00 34.83 32.61 3h3v s MET 1079CO 0.00 -1.36 0.57 0.99 -0.01 0.00 0.00 175.02 175.21 3h3v s THR 1080N 1.14 5.29 0.00 2.05 2.01 -1.26 -4.90 115.64 119.97 3h3v s THR 1080Ca 0.12 -1.79 0.00 0.00 0.31 0.00 0.00 61.69 60.33 3h3v s THR 1080Cb -0.19 -4.36 0.00 0.00 0.01 0.00 0.00 72.50 67.96 3h3v s THR 1080CO -0.03 -0.91 0.00 0.18 -0.69 0.00 0.00 174.62 173.17 3h3v n LEU 1081N 4.87 0.00 0.00 4.42 4.77 -1.26 -5.18 117.00 124.62 3h3v n LEU 1081Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3h3v n LEU 1081Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3h3v n LEU 1081CO 0.48 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.83 3h3v n LYS 1092N 0.00 0.00 -1.63 3.23 5.02 -1.26 -4.94 118.16 118.58 3h3v n LYS 1092Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 3h3v n LYS 1092Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 3h3v n LYS 1092CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3h3v n LYS 1093N 0.00 3.20 -4.38 1.97 5.02 -1.26 -4.88 118.16 117.82 3h3v n LYS 1093Ca 0.00 -2.54 -0.30 0.00 -2.02 0.00 0.00 58.31 53.45 3h3v n LYS 1093Cb 0.00 -3.10 -0.11 0.00 -0.02 0.00 0.00 35.03 31.79 3h3v n LYS 1093CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h3v s VAL 1094N 2.65 3.04 -0.22 -0.18 1.01 -1.26 -5.05 120.40 120.39 3h3v s VAL 1094Ca 0.54 -1.30 -0.36 0.00 0.00 0.00 0.00 61.98 60.86 3h3v s VAL 1094Cb 0.15 -2.37 -0.12 0.00 0.00 0.00 0.00 36.38 34.04 3h3v s VAL 1094CO -0.08 0.19 1.94 0.41 0.00 0.00 0.00 175.10 177.56 3h3v n THR 1095N 1.02 0.40 -4.34 3.92 -1.04 -1.26 -4.91 114.28 108.07 3h3v n THR 1095Ca -0.15 -0.15 -0.19 0.00 -2.04 0.00 0.00 64.05 61.52 3h3v n THR 1095Cb 0.52 -1.67 -0.09 0.00 -1.82 0.00 0.00 70.33 67.28 3h3v n THR 1095CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3h3v s SER 1096N 4.97 1.60 0.36 8.00 1.04 -1.26 -4.73 113.70 123.67 3h3v s SER 1096Ca 0.99 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 55.85 3h3v s SER 1096Cb -0.83 0.40 0.00 0.00 0.10 0.00 0.00 66.02 65.69 3h3v s SER 1096CO 0.54 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 174.48 3h3v n GLY 1097N -0.60 -0.21 0.45 7.32 0.00 -1.26 -3.78 105.19 107.11 3h3v n GLY 1097Ca 0.01 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 3h3v n GLY 1097CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h3v h VAL 1098N 0.00 0.02 -0.90 1.61 2.07 -1.92 -0.65 116.25 116.48 3h3v h VAL 1098Ca 0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 3h3v h VAL 1098Cb 0.00 0.02 -0.07 0.00 -1.52 0.00 0.00 31.29 29.72 3h3v h VAL 1098CO 0.00 0.00 0.58 1.55 0.02 0.00 0.00 177.57 179.72 3h3v h PRO 1099N -0.42 0.83 0.30 1.57 0.13 -2.00 -0.65 132.00 131.76 3h3v h PRO 1099Ca 0.08 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3h3v h PRO 1099Cb 0.61 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 31.54 3h3v h PRO 1099CO -0.57 0.55 -0.26 -0.09 -0.23 0.00 0.00 178.00 177.40 3h3v h ARG 1100N 0.86 -0.56 -0.62 0.86 9.65 -1.31 0.26 114.38 123.51 3h3v h ARG 1100Ca 0.43 0.04 0.09 0.00 -1.10 0.00 0.00 59.98 59.44 3h3v h ARG 1100Cb 0.48 0.13 -0.07 0.00 -1.39 0.00 0.00 29.97 29.11 3h3v h ARG 1100CO -0.19 -0.37 0.24 1.25 2.80 0.00 0.00 179.97 183.70 3h3v h LEU 1101N -0.58 0.25 0.07 3.80 5.85 -0.39 -1.75 115.31 122.55 3h3v h LEU 1101Ca -0.02 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3h3v h LEU 1101Cb 0.52 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3h3v h LEU 1101CO -0.04 0.15 -0.16 0.50 -0.34 0.00 0.00 178.44 178.55 3h3v h LYS 1102N 0.43 -0.24 -0.56 1.25 3.64 -0.56 -1.09 116.57 119.43 3h3v h LYS 1102Ca 0.31 0.02 0.18 0.00 -1.27 0.00 0.00 60.65 59.89 3h3v h LYS 1102Cb 0.38 0.05 -0.10 0.00 -0.41 0.00 0.00 32.23 32.15 3h3v h LYS 1102CO -0.30 -0.16 0.11 -1.91 -2.27 0.00 0.00 179.45 174.92 3h3v n GLU 1103N -3.32 -0.04 0.05 1.90 2.13 0.85 -1.55 120.64 120.65 3h3v n GLU 1103Ca -0.03 0.82 -0.02 0.00 0.66 0.00 0.00 57.16 58.59 3h3v n GLU 1103Cb 0.13 -1.36 -0.01 0.00 0.27 0.00 0.00 31.44 30.47 3h3v n GLU 1103CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3h3v h ILE 1104N 0.00 0.00 0.00 6.31 2.04 -0.42 -3.08 117.51 122.37 3h3v h ILE 1104Ca 0.39 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 66.16 3h3v h ILE 1104Cb 0.90 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3h3v h ILE 1104CO -0.50 0.00 0.52 -0.07 0.00 0.00 0.00 178.15 178.11 3h3v h LEU 1105N -0.21 0.00 0.04 1.44 3.38 -0.19 0.60 115.31 120.36 3h3v h LEU 1105Ca -0.01 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.66 3h3v h LEU 1105Cb 0.10 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3h3v h LEU 1105CO 0.02 0.00 -1.65 0.78 0.09 0.00 0.00 178.44 177.68 3h3v h ASN 1106N 0.00 0.12 -3.83 -0.43 2.35 -1.42 -0.78 115.58 111.59 3h3v h ASN 1106Ca 0.00 -0.23 -0.15 0.00 -0.55 0.00 0.00 56.30 55.37 3h3v h ASN 1106Cb 1.05 -0.04 0.08 0.00 0.05 0.00 0.00 38.32 39.46 3h3v h ASN 1106CO 0.00 1.20 -0.38 0.52 -1.65 0.00 0.00 177.43 177.13 3h3v n VAL 1107N -3.21 -3.29 -2.96 2.81 0.31 0.21 -4.63 118.33 107.57 3h3v n VAL 1107Ca -0.17 -0.32 -0.40 0.00 -0.01 0.00 0.00 64.34 63.44 3h3v n VAL 1107Cb 1.04 -3.90 -0.06 0.00 -0.91 0.00 0.00 33.84 30.01 3h3v n VAL 1107CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h3v s ALA 1108N -3.17 3.40 0.00 3.52 0.00 -1.17 -5.02 121.76 119.31 3h3v s ALA 1108Ca 0.05 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.36 3h3v s ALA 1108Cb -0.01 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.11 3h3v s ALA 1108CO 0.35 0.19 0.39 1.17 0.00 0.00 0.00 175.76 177.86 3h3v n LYS 1109N 2.11 0.00 -2.33 0.00 3.00 -1.26 -4.41 118.16 115.27 3h3v n LYS 1109Ca -0.04 0.00 -0.35 0.00 -0.00 0.00 0.00 58.31 57.92 3h3v n LYS 1109Cb 0.49 -0.89 -0.03 0.00 0.00 0.00 0.00 35.03 34.60 3h3v n LYS 1109CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 3h3v s ASN 1110N -1.81 5.94 0.21 3.14 4.22 -1.26 -4.97 114.94 120.42 3h3v s ASN 1110Ca 0.00 -1.73 -0.30 0.00 -2.14 0.00 0.00 52.86 48.69 3h3v s ASN 1110Cb 0.00 -2.58 -0.08 0.00 1.28 0.00 0.00 41.25 39.87 3h3v s ASN 1110CO 0.00 -2.08 1.19 0.00 -2.04 0.00 0.00 177.10 174.17 3h3v s MET 1111N 5.51 4.51 0.13 3.55 0.23 -1.26 -4.93 119.30 127.03 3h3v s MET 1111Ca 0.59 1.89 -0.27 0.00 -1.03 0.00 0.00 55.69 56.88 3h3v s MET 1111Cb 0.00 -3.22 -0.07 0.00 -1.53 0.00 0.00 34.83 30.01 3h3v s MET 1111CO 0.05 -0.05 1.46 0.87 -2.03 0.00 0.00 175.02 175.32 3h3v h LYS 1112N 4.90 -0.09 -5.69 3.16 1.57 -1.98 -3.36 116.57 115.07 3h3v h LYS 1112Ca -0.45 0.01 -0.62 0.00 -1.87 0.00 0.00 60.65 57.72 3h3v h LYS 1112Cb 1.21 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 33.47 3h3v h LYS 1112CO 0.73 -0.06 -0.33 0.99 -0.57 0.00 0.00 179.45 180.21 3h3v s THR 1113N -5.15 5.27 -0.18 -0.16 2.01 -1.26 -4.99 115.64 111.19 3h3v s THR 1113Ca -0.11 0.55 -0.11 0.00 0.31 0.00 0.00 61.69 62.34 3h3v s THR 1113Cb 0.09 -3.60 -0.08 0.00 0.01 0.00 0.00 72.50 68.92 3h3v s THR 1113CO 0.52 0.51 -0.26 -0.81 -0.69 0.00 0.00 174.62 173.89 3h3v n PRO 1114N 2.61 0.41 -0.69 4.92 -0.04 -1.26 -4.89 135.00 136.07 3h3v n PRO 1114Ca -0.15 0.18 0.07 0.00 -0.04 0.00 0.00 63.50 63.57 3h3v n PRO 1114Cb 0.53 -1.20 -0.02 0.00 -0.04 0.00 0.00 33.50 32.76 3h3v n PRO 1114CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3h3v n SER 1115N -3.96 -3.27 0.00 3.54 2.88 -1.26 -4.31 113.62 107.24 3h3v n SER 1115Ca -0.33 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 3h3v n SER 1115Cb 0.69 -2.30 0.00 0.00 -0.75 0.00 0.00 64.21 61.85 3h3v n SER 1115CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3h3v n LEU 1116N -2.34 0.00 -4.51 2.46 7.94 -1.26 -4.57 117.00 114.71 3h3v n LEU 1116Ca -0.00 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.46 3h3v n LEU 1116Cb 0.57 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.46 3h3v n LEU 1116CO 0.01 0.00 0.48 -0.89 -1.11 0.00 0.00 177.39 175.87 3h3v s THR 1117N 0.00 4.72 -0.20 1.96 2.01 -0.09 -2.17 115.64 121.87 3h3v s THR 1117Ca 0.00 0.13 -0.09 0.00 0.31 0.00 0.00 61.69 62.05 3h3v s THR 1117Cb 0.00 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.17 3h3v s THR 1117CO 0.00 -0.74 0.09 0.68 -0.69 0.00 0.00 174.62 173.97 3h3v s VAL 1118N 3.08 5.02 0.30 3.82 -7.23 -0.16 -1.10 120.40 124.12 3h3v s VAL 1118Ca 0.25 0.05 -0.05 0.00 -1.81 0.00 0.00 61.98 60.42 3h3v s VAL 1118Cb -0.14 -3.28 -0.05 0.00 0.56 0.00 0.00 36.38 33.46 3h3v s VAL 1118CO 0.19 0.43 0.57 -0.31 -0.31 0.00 0.00 175.10 175.67 3h3v s TYR 1119N 0.52 3.48 0.00 2.82 1.51 -1.26 -1.68 117.35 122.73 3h3v s TYR 1119Ca 0.05 0.65 0.00 0.00 -1.01 0.00 0.00 57.07 56.76 3h3v s TYR 1119Cb -0.12 -2.12 0.00 0.00 -0.11 0.00 0.00 41.96 39.61 3h3v s TYR 1119CO 0.00 0.15 0.00 1.28 -1.11 0.00 0.00 175.55 175.87 3h3v n LEU 1120N -1.00 0.00 -4.89 -1.29 4.32 -1.26 -1.43 117.00 111.44 3h3v n LEU 1120Ca -0.02 0.00 -0.32 0.00 -0.02 0.00 0.00 56.01 55.66 3h3v n LEU 1120Cb 0.54 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.29 3h3v n LEU 1120CO 0.48 -0.45 -0.17 -0.70 -1.22 0.00 0.00 177.39 175.33 3h3v s GLU 1121N 0.00 3.36 0.12 3.23 2.12 -0.15 -0.03 118.70 127.35 3h3v s GLU 1121Ca 0.00 -0.42 -0.06 0.00 0.36 0.00 0.00 54.97 54.85 3h3v s GLU 1121Cb 0.00 -3.02 0.17 0.00 0.26 0.00 0.00 34.13 31.54 3h3v s GLU 1121CO 0.00 0.63 0.74 -2.30 -0.54 0.00 0.00 175.26 173.80 3h3v n PRO 1122N 0.60 -0.08 -0.04 4.30 -0.02 -1.26 -2.29 135.00 136.21 3h3v n PRO 1122Ca -0.08 0.74 -0.03 0.00 -2.02 0.00 0.00 63.50 62.12 3h3v n PRO 1122Cb 0.52 -1.10 -0.02 0.00 -0.02 0.00 0.00 33.50 32.87 3h3v n PRO 1122CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3h3v h GLY 1123N 0.00 -0.02 -7.13 -1.23 0.00 -1.99 -3.43 103.07 89.27 3h3v h GLY 1123Ca 0.20 0.01 -0.14 0.00 0.00 0.00 0.00 47.33 47.39 3h3v h GLY 1123CO -0.48 -0.01 0.95 1.42 0.00 0.00 0.00 176.54 178.41 3h3v n HIS 1124N -4.77 0.51 0.00 5.60 8.25 -0.97 -4.79 115.22 119.05 3h3v n HIS 1124Ca -0.02 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 3h3v n HIS 1124Cb 0.08 -1.49 0.00 0.00 1.12 0.00 0.00 29.99 29.70 3h3v n HIS 1124CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h3v n ALA 1125N 11.72 0.00 0.94 -1.41 0.00 -1.26 -4.24 120.51 126.25 3h3v n ALA 1125Ca 0.48 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.92 3h3v n ALA 1125Cb 0.33 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.79 3h3v n ALA 1125CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3v n ALA 1126N -3.00 2.57 -0.77 0.00 0.00 -1.26 -3.16 120.51 114.89 3h3v n ALA 1126Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 53.44 53.01 3h3v n ALA 1126Cb 0.00 -1.01 -0.06 0.00 0.00 0.00 0.00 19.45 18.38 3h3v n ALA 1126CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3h3v n ASP 1127N 0.26 2.18 -0.10 0.00 -0.08 -1.26 -4.76 116.55 112.79 3h3v n ASP 1127Ca 0.01 -2.50 -0.01 0.00 -1.51 0.00 0.00 54.79 50.79 3h3v n ASP 1127Cb 0.42 -0.87 -0.00 0.00 2.34 0.00 0.00 41.12 43.01 3h3v n ASP 1127CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99 3h3v n GLN 1128N 6.62 -0.07 0.09 -0.67 -0.06 -1.26 0.15 117.38 122.16 3h3v n GLN 1128Ca 0.42 0.38 -0.08 0.00 -2.00 0.00 0.00 57.00 55.73 3h3v n GLN 1128Cb 0.32 -0.56 0.01 0.00 -4.06 0.00 0.00 30.24 25.95 3h3v n GLN 1128CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 3h3v h GLU 1129N 0.00 0.18 -1.04 3.69 4.81 -1.99 -3.19 114.58 117.04 3h3v h GLU 1129Ca 0.07 -0.19 0.28 0.00 -0.13 0.00 0.00 59.36 59.40 3h3v h GLU 1129Cb 0.13 0.05 -0.12 0.00 0.63 0.00 0.00 28.75 29.44 3h3v h GLU 1129CO -0.24 0.92 0.63 0.37 -0.73 0.00 0.00 179.01 179.96 3h3v h GLN 1130N 0.10 0.42 0.48 1.92 5.75 0.92 0.15 115.11 124.84 3h3v h GLN 1130Ca -0.04 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.43 3h3v h GLN 1130Cb 1.46 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.90 3h3v h GLN 1130CO 0.13 0.28 -0.41 0.00 -2.65 0.00 0.00 178.83 176.17 3h3v h ALA 1131N 1.72 -0.94 -0.54 3.38 0.00 -1.51 -2.60 119.26 118.78 3h3v h ALA 1131Ca 0.67 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.51 3h3v h ALA 1131Cb 1.51 0.57 -0.11 0.00 0.00 0.00 0.00 17.79 19.77 3h3v h ALA 1131CO -0.45 -1.06 -0.35 0.87 0.00 0.00 0.00 179.25 178.26 3h3v h LYS 1132N -0.88 -0.19 -1.04 0.00 1.57 -0.88 0.43 116.57 115.57 3h3v h LYS 1132Ca -0.05 0.01 0.27 0.00 -1.87 0.00 0.00 60.65 59.01 3h3v h LYS 1132Cb 0.76 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 33.03 3h3v h LYS 1132CO -0.03 -0.13 0.67 -0.07 -0.57 0.00 0.00 179.45 179.32 3h3v h LEU 1133N -0.20 0.44 0.12 2.94 3.38 -1.11 -0.37 115.31 120.51 3h3v h LEU 1133Ca 0.21 0.08 -0.28 0.00 0.09 0.00 0.00 57.88 57.98 3h3v h LEU 1133Cb 0.55 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 3h3v h LEU 1133CO -0.64 0.09 -1.40 0.40 0.09 0.00 0.00 178.44 176.97 3h3v h ILE 1134N 0.39 1.05 -0.56 1.22 2.04 -0.49 -3.34 117.51 117.82 3h3v h ILE 1134Ca 0.59 -2.42 0.11 0.00 1.00 0.00 0.00 64.86 64.14 3h3v h ILE 1134Cb 1.51 2.75 -0.10 0.00 -0.74 0.00 0.00 36.82 40.25 3h3v h ILE 1134CO -0.29 0.72 -0.02 -0.09 0.00 0.00 0.00 178.15 178.47 3h3v h ARG 1135N -0.27 0.09 -1.75 2.37 2.43 0.76 0.19 114.38 118.20 3h3v h ARG 1135Ca -0.30 -0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 58.63 3h3v h ARG 1135Cb 1.78 -0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 31.22 3h3v h ARG 1135CO 0.08 0.06 0.23 -1.13 -1.51 0.00 0.00 179.97 177.69 3h3v n SER 1136N -5.28 6.05 0.00 -3.80 3.41 -0.25 -1.53 113.62 112.22 3h3v n SER 1136Ca 0.07 -2.85 0.00 0.00 -0.26 0.00 0.00 58.87 55.83 3h3v n SER 1136Cb 0.31 -1.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.13 3h3v n SER 1136CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h3v n ALA 1137N 0.92 0.03 0.00 7.33 0.00 0.65 -4.77 120.51 124.67 3h3v n ALA 1137Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.69 3h3v n ALA 1137Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 3h3v n ALA 1137CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3h3v n ILE 1138N -0.01 0.00 -1.55 0.00 5.41 -1.02 -3.92 119.36 118.27 3h3v n ILE 1138Ca 0.00 0.00 -0.26 0.00 1.00 0.00 0.00 62.75 63.49 3h3v n ILE 1138Cb 0.03 -0.48 -0.07 0.00 -0.71 0.00 0.00 39.64 38.42 3h3v n ILE 1138CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 3h3v n GLU 1139N -2.37 0.71 -1.68 0.38 2.13 -0.58 -0.48 120.64 118.76 3h3v n GLU 1139Ca 0.00 -0.36 -0.58 0.00 0.66 0.00 0.00 57.16 56.88 3h3v n GLU 1139Cb 0.41 -3.30 -0.07 0.00 0.27 0.00 0.00 31.44 28.75 3h3v n GLU 1139CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 3h3v n HIS 1140N 16.23 1.84 -4.27 4.31 -0.00 -0.76 -3.85 115.22 128.71 3h3v n HIS 1140Ca 0.45 0.66 -0.19 0.00 -0.00 0.00 0.00 57.72 58.64 3h3v n HIS 1140Cb 0.44 -2.39 -0.15 0.00 -0.00 0.00 0.00 29.99 27.89 3h3v n HIS 1140CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 3h3v s THR 1141N 2.67 0.62 0.08 3.57 2.01 -0.32 -4.87 115.64 119.40 3h3v s THR 1141Ca 0.96 -0.26 0.10 0.00 0.31 0.00 0.00 61.69 62.80 3h3v s THR 1141Cb -1.11 -0.58 -0.03 0.00 0.01 0.00 0.00 72.50 70.79 3h3v s THR 1141CO 0.63 0.21 -0.26 0.42 -0.69 0.00 0.00 174.62 174.93 3h3v s THR 1142N 0.34 2.24 0.37 -0.82 -4.23 -1.26 0.24 115.64 112.52 3h3v s THR 1142Ca -0.05 -1.54 0.21 0.00 -1.18 0.00 0.00 61.69 59.14 3h3v s THR 1142Cb -0.09 -1.93 0.36 0.00 1.34 0.00 0.00 72.50 72.18 3h3v s THR 1142CO 0.00 0.24 1.59 0.25 -0.54 0.00 0.00 174.62 176.16 3h3v h LEU 1143N 4.37 0.33 -0.31 4.79 5.85 -1.80 0.56 115.31 129.11 3h3v h LEU 1143Ca -0.48 0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.54 3h3v h LEU 1143Cb 1.15 0.25 -0.06 0.00 0.37 0.00 0.00 40.66 42.37 3h3v h LEU 1143CO 0.42 -0.40 -0.10 0.50 -0.34 0.00 0.00 178.44 178.53 3h3v h LYS 1144N 0.03 -0.03 0.00 1.25 3.64 -1.78 -0.67 116.57 119.02 3h3v h LYS 1144Ca 0.84 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.22 3h3v h LYS 1144Cb 2.24 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 34.07 3h3v h LYS 1144CO -0.73 -0.02 0.07 -1.13 -2.27 0.00 0.00 179.45 175.38 3h3v n SER 1145N -5.28 0.26 -0.03 4.20 3.41 0.20 -2.11 113.62 114.27 3h3v n SER 1145Ca 0.00 0.58 -0.01 0.00 -0.26 0.00 0.00 58.87 59.19 3h3v n SER 1145Cb 0.19 -0.60 -0.09 0.00 -0.26 0.00 0.00 64.21 63.45 3h3v n SER 1145CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3h3v n VAL 1146N -1.84 0.43 -2.19 -3.33 0.24 -0.35 -5.00 118.33 106.28 3h3v n VAL 1146Ca -0.01 -0.38 -0.42 0.00 -2.04 0.00 0.00 64.34 61.49 3h3v n VAL 1146Cb 0.09 -0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.13 3h3v n VAL 1146CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3h3v s THR 1147N -2.51 3.73 0.01 3.34 2.01 -0.62 -1.48 115.64 120.11 3h3v s THR 1147Ca -0.05 1.04 -0.16 0.00 0.31 0.00 0.00 61.69 62.84 3h3v s THR 1147Cb 0.05 -3.67 -0.35 0.00 0.01 0.00 0.00 72.50 68.54 3h3v s THR 1147CO 0.47 -0.03 0.94 0.40 -0.69 0.00 0.00 174.62 175.71 3h3v h ILE 1148N 5.13 1.24 -2.01 1.82 2.04 0.01 -3.47 117.51 122.26 3h3v h ILE 1148Ca -0.37 -2.66 0.05 0.00 1.00 0.00 0.00 64.86 62.89 3h3v h ILE 1148Cb 1.17 3.01 -0.19 0.00 -0.74 0.00 0.00 36.82 40.07 3h3v h ILE 1148CO 0.92 0.81 0.43 0.00 0.00 0.00 0.00 178.15 180.32 3h3v s ALA 1149N -2.59 -1.84 0.03 1.87 0.00 -1.15 -5.01 121.76 113.08 3h3v s ALA 1149Ca -0.10 1.25 0.08 0.00 0.00 0.00 0.00 51.96 53.18 3h3v s ALA 1149Cb 0.04 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 3h3v s ALA 1149CO 0.93 -0.49 -0.23 -1.54 0.00 0.00 0.00 175.76 174.42 3h3v s SER 1150N -1.73 2.79 -0.00 0.00 1.04 -1.26 -1.04 113.70 113.49 3h3v s SER 1150Ca -0.01 -0.52 -0.05 0.00 0.48 0.00 0.00 55.95 55.85 3h3v s SER 1150Cb -0.01 -0.26 -0.00 0.00 0.10 0.00 0.00 66.02 65.85 3h3v s SER 1150CO -0.02 0.23 0.10 -1.61 0.98 0.00 0.00 173.24 172.93 3h3v s GLU 1151N -1.01 0.37 -0.30 4.02 2.02 -0.53 -4.97 118.70 118.30 3h3v s GLU 1151Ca 0.09 -0.31 0.03 0.00 0.02 0.00 0.00 54.97 54.80 3h3v s GLU 1151Cb -0.09 0.15 0.08 0.00 0.10 0.00 0.00 34.13 34.37 3h3v s GLU 1151CO 0.01 -0.08 -0.02 0.96 0.02 0.00 0.00 175.26 176.15 3h3v s ILE 1152N -1.07 2.07 0.66 -1.63 -4.36 -1.26 0.21 121.20 115.82 3h3v s ILE 1152Ca -0.12 -1.89 0.03 0.00 -0.26 0.00 0.00 60.65 58.41 3h3v s ILE 1152Cb -0.07 -2.37 0.11 0.00 1.25 0.00 0.00 42.46 41.39 3h3v s ILE 1152CO 0.01 -0.33 0.91 -0.31 0.24 0.00 0.00 174.94 175.47 3h3v s TYR 1153N 1.07 1.55 -0.50 1.37 1.51 -1.13 -4.93 117.35 116.29 3h3v s TYR 1153Ca 0.01 -0.44 0.03 0.00 -1.01 0.00 0.00 57.07 55.67 3h3v s TYR 1153Cb -0.19 -2.71 0.13 0.00 -0.11 0.00 0.00 41.96 39.08 3h3v s TYR 1153CO -0.08 -1.49 0.25 -0.47 -1.11 0.00 0.00 175.55 172.65 3h3v s TYR 1154N -2.96 3.30 -0.39 2.71 5.04 -1.26 -2.14 117.35 121.65 3h3v s TYR 1154Ca 0.64 -3.09 0.04 0.00 -2.44 0.00 0.00 57.07 52.22 3h3v s TYR 1154Cb -0.06 -2.89 0.11 0.00 0.35 0.00 0.00 41.96 39.48 3h3v s TYR 1154CO 0.42 -0.79 0.12 0.34 -1.34 0.00 0.00 175.55 174.31 3h3v s ASP 1155N 0.03 4.53 0.00 4.32 -1.08 -0.94 -4.92 116.67 118.62 3h3v s ASP 1155Ca 0.16 -2.38 0.30 0.00 -0.52 0.00 0.00 52.55 50.11 3h3v s ASP 1155Cb -0.24 -1.54 1.35 0.00 -1.46 0.00 0.00 42.92 41.03 3h3v s ASP 1155CO -0.02 -0.34 1.98 -0.81 0.52 0.00 0.00 175.17 176.51 3h3v n PRO 1156N 3.95 0.17 -3.00 4.34 -0.04 -1.20 -4.36 135.00 134.87 3h3v n PRO 1156Ca 0.04 -0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.06 3h3v n PRO 1156Cb 0.39 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.31 3h3v n PRO 1156CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3h3v s ASP 1157N -2.83 6.35 0.00 3.54 2.15 -1.26 -4.73 116.67 119.89 3h3v s ASP 1157Ca 0.20 -1.57 0.00 0.00 0.43 0.00 0.00 52.55 51.61 3h3v s ASP 1157Cb 0.20 -2.36 0.00 0.00 -0.30 0.00 0.00 42.92 40.46 3h3v s ASP 1157CO 0.50 -1.16 0.45 -0.81 -0.17 0.00 0.00 175.17 173.97 3h3v n PRO 1158N 6.65 0.46 -0.71 4.34 -0.04 -1.26 -2.46 135.00 141.97 3h3v n PRO 1158Ca 0.04 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.49 3h3v n PRO 1158Cb 0.46 -1.27 -0.01 0.00 -0.04 0.00 0.00 33.50 32.64 3h3v n PRO 1158CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3h3v n ARG 1159N 0.75 0.00 0.00 0.54 1.74 -1.26 -5.12 116.66 113.31 3h3v n ARG 1159Ca 0.00 -0.79 0.00 0.00 -0.77 0.00 0.00 57.85 56.29 3h3v n ARG 1159Cb 0.22 -0.12 0.00 0.00 -1.02 0.00 0.00 32.46 31.55 3h3v n ARG 1159CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3h3v n SER 1160N 0.07 0.00 -4.78 0.55 3.41 -1.03 -4.96 113.62 106.88 3h3v n SER 1160Ca -0.03 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.34 3h3v n SER 1160Cb 0.69 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.59 3h3v n SER 1160CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3h3v s THR 1161N -2.00 4.29 -0.62 6.66 2.01 -1.26 -4.59 115.64 120.12 3h3v s THR 1161Ca 0.00 -1.37 0.25 0.00 0.31 0.00 0.00 61.69 60.87 3h3v s THR 1161Cb 0.00 -3.27 0.17 0.00 0.01 0.00 0.00 72.50 69.41 3h3v s THR 1161CO 0.00 -0.27 1.51 0.58 -0.69 0.00 0.00 174.62 175.75 3h3v h VAL 1162N 1.77 0.00 -3.12 3.82 2.07 -1.95 -3.44 116.25 115.40 3h3v h VAL 1162Ca -0.48 -0.58 -0.60 0.00 0.82 0.00 0.00 66.70 65.86 3h3v h VAL 1162Cb 1.23 1.36 -0.06 0.00 -1.52 0.00 0.00 31.29 32.30 3h3v h VAL 1162CO 0.61 0.00 -0.20 -0.63 0.02 0.00 0.00 177.57 177.37 3h3v s ILE 1163N -3.16 5.09 0.02 4.57 1.01 -1.26 -5.02 121.20 122.45 3h3v s ILE 1163Ca 0.08 0.84 -0.26 0.00 0.00 0.00 0.00 60.65 61.30 3h3v s ILE 1163Cb 0.12 -3.73 -0.16 0.00 0.01 0.00 0.00 42.46 38.70 3h3v s ILE 1163CO 0.67 0.50 1.25 1.55 0.00 0.00 0.00 174.94 178.91 3h3v h PRO 1164N 5.37 -0.57 -0.98 2.79 0.13 -2.02 -3.28 132.00 133.44 3h3v h PRO 1164Ca -0.48 0.04 0.15 0.00 -0.87 0.00 0.00 66.00 64.84 3h3v h PRO 1164Cb 1.20 0.13 -0.16 0.00 0.13 0.00 0.00 31.00 32.31 3h3v h PRO 1164CO 0.66 -0.27 -0.39 0.93 -0.23 0.00 0.00 178.00 178.70 3h3v h GLU 1165N -0.88 -0.01 0.00 0.86 5.08 -1.99 0.65 114.58 118.29 3h3v h GLU 1165Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3h3v h GLU 1165Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 3h3v h GLU 1165CO 0.10 -0.01 0.00 -0.25 -1.00 0.00 0.00 179.01 177.85 3h3v n ASP 1166N -5.47 0.00 0.40 1.42 9.92 -1.24 -4.00 116.55 117.59 3h3v n ASP 1166Ca 0.10 -0.44 -0.19 0.00 -0.53 0.00 0.00 54.79 53.72 3h3v n ASP 1166Cb 0.40 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.78 3h3v n ASP 1166CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 3h3v h GLU 1167N 0.00 -1.11 -0.66 -1.24 4.39 0.26 -3.26 114.58 112.96 3h3v h GLU 1167Ca 0.00 0.08 0.13 0.00 0.34 0.00 0.00 59.36 59.91 3h3v h GLU 1167Cb 0.00 0.25 -0.13 0.00 -0.10 0.00 0.00 28.75 28.78 3h3v h GLU 1167CO 0.00 -0.74 -0.18 1.49 -1.16 0.00 0.00 179.01 178.42 3h3v h GLU 1168N -1.15 -0.01 -0.50 2.33 4.81 -1.77 -2.71 114.58 115.58 3h3v h GLU 1168Ca -0.10 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.28 3h3v h GLU 1168Cb 0.93 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 3h3v h GLU 1168CO 0.09 -0.01 0.40 0.82 -0.73 0.00 0.00 179.01 179.58 3h3v h ILE 1169N -0.01 0.60 0.10 2.32 2.04 -1.84 -3.18 117.51 117.55 3h3v h ILE 1169Ca 0.31 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.17 3h3v h ILE 1169Cb 0.49 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 3h3v h ILE 1169CO -0.69 0.00 -0.05 0.40 0.00 0.00 0.00 178.15 177.81 3h3v h ILE 1170N 0.00 0.00 -0.43 -0.67 2.04 -1.58 -3.12 117.51 113.75 3h3v h ILE 1170Ca 0.24 -0.02 0.12 0.00 1.00 0.00 0.00 64.86 66.20 3h3v h ILE 1170Cb 1.03 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3h3v h ILE 1170CO -0.00 0.00 0.54 1.56 0.00 0.00 0.00 178.15 180.24 3h3v h GLN 1171N -0.16 0.00 0.00 2.37 4.20 -1.71 0.14 115.11 119.95 3h3v h GLN 1171Ca -0.01 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.56 3h3v h GLN 1171Cb 0.10 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3h3v h GLN 1171CO 0.02 0.00 -0.63 -0.07 -0.67 0.00 0.00 178.83 177.48 3h3v h LEU 1172N 0.00 0.00 -5.11 1.46 3.38 -1.58 -3.32 115.31 110.15 3h3v h LEU 1172Ca 0.20 0.00 -0.76 0.00 0.09 0.00 0.00 57.88 57.42 3h3v h LEU 1172Cb 1.27 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.74 3h3v h LEU 1172CO -0.00 0.63 0.87 1.57 0.09 0.00 0.00 178.44 181.60 3h3v n HIS 1173N -3.45 3.01 0.00 1.13 -0.00 0.48 -4.20 115.22 112.19 3h3v n HIS 1173Ca 0.00 -2.45 0.00 0.00 0.46 0.00 0.00 57.72 55.73 3h3v n HIS 1173Cb 0.71 -1.08 0.00 0.00 -0.12 0.00 0.00 29.99 29.51 3h3v n HIS 1173CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 3h3v n PHE 1174N -0.47 0.00 -4.30 1.57 3.01 -1.25 -5.03 117.46 110.98 3h3v n PHE 1174Ca 0.51 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.73 3h3v n PHE 1174Cb 0.28 0.03 -0.08 0.00 -0.01 0.00 0.00 39.48 39.70 3h3v n PHE 1174CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3h3v s SER 1175N -3.57 4.36 0.00 4.37 1.04 -1.26 -5.18 113.70 113.46 3h3v s SER 1175Ca 0.00 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.79 3h3v s SER 1175Cb 0.00 -0.76 0.00 0.00 0.10 0.00 0.00 66.02 65.36 3h3v s SER 1175CO 0.00 0.05 0.14 0.18 0.98 0.00 0.00 173.24 174.59 3h3v n LEU 1176N -0.47 0.00 0.00 2.42 4.77 -1.26 -4.98 117.00 117.48 3h3v n LEU 1176Ca -0.08 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 3h3v n LEU 1176Cb 0.57 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 3h3v n LEU 1176CO 0.38 -0.36 0.00 0.00 -1.33 0.00 0.00 177.39 176.08 3h3v n GLN 1187N 2.05 0.00 0.00 3.23 10.64 -1.26 -5.17 117.38 126.87 3h3v n GLN 1187Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 3h3v n GLN 1187Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 3h3v n GLN 1187CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3h3v n GLN 1188N 0.00 0.00 -3.65 2.61 6.02 -1.26 -4.86 117.38 116.24 3h3v n GLN 1188Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.84 3h3v n GLN 1188Cb 0.00 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.19 3h3v n GLN 1188CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3h3v s SER 1189N -0.03 -0.40 0.00 1.08 0.15 -1.26 -4.45 113.70 108.78 3h3v s SER 1189Ca 0.00 0.36 0.27 0.00 0.70 0.00 0.00 55.95 57.28 3h3v s SER 1189Cb 0.00 0.42 0.94 0.00 -1.71 0.00 0.00 66.02 65.67 3h3v s SER 1189CO 0.00 -0.53 1.70 -0.81 1.20 0.00 0.00 173.24 174.80 3h3v n PRO 1190N 1.08 0.38 -3.04 5.44 -0.04 -1.26 -4.84 135.00 132.71 3h3v n PRO 1190Ca -0.20 -0.16 -0.41 0.00 -0.04 0.00 0.00 63.50 62.68 3h3v n PRO 1190Cb 0.57 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 3h3v n PRO 1190CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3h3v s TRP 1191N -2.73 3.19 0.24 0.54 0.23 -1.26 -2.20 118.94 116.94 3h3v s TRP 1191Ca 0.20 0.63 -0.05 0.00 -2.03 0.00 0.00 56.10 54.85 3h3v s TRP 1191Cb 0.19 -3.12 -0.05 0.00 0.03 0.00 0.00 33.47 30.52 3h3v s TRP 1191CO 0.56 -0.54 0.49 -1.17 0.96 0.00 0.00 176.95 177.24 3h3v s LEU 1192N 2.78 4.15 -0.20 2.99 2.96 -0.91 -4.42 118.68 126.03 3h3v s LEU 1192Ca 0.28 0.66 -0.03 0.00 -0.22 0.00 0.00 54.13 54.82 3h3v s LEU 1192Cb -0.14 -3.44 0.06 0.00 0.50 0.00 0.00 46.19 43.16 3h3v s LEU 1192CO 0.13 -0.10 0.04 -0.22 -1.32 0.00 0.00 176.35 174.88 3h3v s LEU 1193N -3.22 1.13 0.15 -0.68 2.96 -0.99 -2.83 118.68 115.20 3h3v s LEU 1193Ca 0.43 -0.84 -0.06 0.00 -0.22 0.00 0.00 54.13 53.43 3h3v s LEU 1193Cb -0.11 -0.57 -0.06 0.00 0.50 0.00 0.00 46.19 45.95 3h3v s LEU 1193CO 0.27 -0.32 0.41 -0.60 -1.32 0.00 0.00 176.35 174.80 3h3v s ARG 1194N 1.88 3.67 -0.20 1.98 6.06 0.55 -3.43 118.95 129.46 3h3v s ARG 1194Ca -0.00 0.01 -0.04 0.00 -2.50 0.00 0.00 55.73 53.20 3h3v s ARG 1194Cb -0.17 -2.83 0.10 0.00 0.06 0.00 0.00 34.95 32.10 3h3v s ARG 1194CO -0.09 0.45 0.28 -0.51 -2.50 0.00 0.00 175.30 172.94 3h3v s LEU 1195N -2.57 -0.32 -0.33 -0.88 1.43 -1.17 -1.45 118.68 113.38 3h3v s LEU 1195Ca 0.41 0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.52 3h3v s LEU 1195Cb -0.12 0.70 -0.01 0.00 0.03 0.00 0.00 46.19 46.78 3h3v s LEU 1195CO 0.23 -0.30 0.22 -0.70 0.23 0.00 0.00 176.35 176.03 3h3v s GLU 1196N 2.42 3.46 0.41 1.70 2.12 -0.20 -2.25 118.70 126.36 3h3v s GLU 1196Ca 0.07 -0.66 -0.03 0.00 0.36 0.00 0.00 54.97 54.70 3h3v s GLU 1196Cb -0.15 -3.75 -0.04 0.00 0.26 0.00 0.00 34.13 30.45 3h3v s GLU 1196CO -0.12 -0.44 0.68 -0.51 -0.54 0.00 0.00 175.26 174.33 3h3v s LEU 1197N 1.70 3.81 0.05 2.70 1.43 -1.03 0.72 118.68 128.06 3h3v s LEU 1197Ca 0.06 0.75 -0.24 0.00 -1.03 0.00 0.00 54.13 53.67 3h3v s LEU 1197Cb -0.17 -3.66 -0.06 0.00 0.03 0.00 0.00 46.19 42.33 3h3v s LEU 1197CO 0.10 -0.43 0.73 -0.62 0.23 0.00 0.00 176.35 176.35 3h3v s ASP 1198N -3.95 7.18 0.05 2.29 -1.08 -0.55 -4.48 116.67 116.13 3h3v s ASP 1198Ca 0.45 1.41 -0.21 0.00 -0.52 0.00 0.00 52.55 53.67 3h3v s ASP 1198Cb -0.10 -2.45 -0.13 0.00 -1.46 0.00 0.00 42.92 38.78 3h3v s ASP 1198CO 0.40 0.05 1.43 -0.09 0.52 0.00 0.00 175.17 177.48 3h3v h ARG 1199N 5.54 0.28 -0.26 4.34 2.43 -1.96 -2.87 114.38 121.88 3h3v h ARG 1199Ca -0.44 -0.11 -0.16 0.00 -0.81 0.00 0.00 59.98 58.45 3h3v h ARG 1199Cb 1.20 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 3h3v h ARG 1199CO 0.70 0.57 -0.50 0.00 -1.51 0.00 0.00 179.97 179.23 3h3v h ALA 1200N 0.70 0.64 0.00 2.80 0.00 -2.00 -2.97 119.26 118.44 3h3v h ALA 1200Ca 0.04 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 3h3v h ALA 1200Cb 0.47 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3h3v h ALA 1200CO 0.01 0.68 -0.01 0.00 0.00 0.00 0.00 179.25 179.93 3h3v h ALA 1201N 0.88 1.40 -0.24 0.00 0.00 -1.92 0.28 119.26 119.66 3h3v h ALA 1201Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3h3v h ALA 1201Cb 1.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3h3v h ALA 1201CO 0.10 0.01 0.00 -1.33 0.00 0.00 0.00 179.25 178.03 3h3v n MET 1202N -3.68 2.13 0.00 0.00 2.00 -1.09 -3.36 117.12 113.12 3h3v n MET 1202Ca -0.03 -1.11 0.00 0.00 0.00 0.00 0.00 57.70 56.56 3h3v n MET 1202Cb 0.09 -1.55 0.00 0.00 0.00 0.00 0.00 33.22 31.76 3h3v n MET 1202CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3h3v n ASN 1203N 0.27 1.51 -0.26 7.83 3.02 0.06 -1.54 115.26 126.15 3h3v n ASN 1203Ca 0.10 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.69 3h3v n ASN 1203Cb 0.45 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.89 3h3v n ASN 1203CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 3h3v h ASP 1204N 0.00 0.85 -2.81 6.41 1.82 -1.61 -2.82 116.42 118.27 3h3v h ASP 1204Ca 0.00 -0.00 -0.61 0.00 -0.39 0.00 0.00 57.03 56.03 3h3v h ASP 1204Cb 0.94 -0.19 -0.41 0.00 0.68 0.00 0.00 39.33 40.36 3h3v h ASP 1204CO 0.00 0.56 -0.69 0.29 -1.61 0.00 0.00 179.24 177.80 3h3v n LYS 1205N -4.47 1.46 -0.82 0.28 5.02 -1.22 -5.08 118.16 113.34 3h3v n LYS 1205Ca 0.12 -4.15 -0.32 0.00 -2.02 0.00 0.00 58.31 51.94 3h3v n LYS 1205Cb 0.17 -2.11 -0.05 0.00 -0.02 0.00 0.00 35.03 33.03 3h3v n LYS 1205CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3h3v n ASP 1206N 2.06 0.53 -3.98 4.39 -0.08 -1.07 -4.58 116.55 113.83 3h3v n ASP 1206Ca 0.23 0.56 -0.09 0.00 -1.51 0.00 0.00 54.79 53.99 3h3v n ASP 1206Cb 0.39 -0.42 -0.08 0.00 2.34 0.00 0.00 41.12 43.35 3h3v n ASP 1206CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3h3v s LEU 1207N 1.32 1.43 -0.05 -2.67 1.43 -0.59 -4.93 118.68 114.62 3h3v s LEU 1207Ca 0.49 -0.88 0.03 0.00 -1.03 0.00 0.00 54.13 52.74 3h3v s LEU 1207Cb -0.70 0.86 0.01 0.00 0.03 0.00 0.00 46.19 46.39 3h3v s LEU 1207CO 0.38 -0.78 -0.11 -0.89 0.23 0.00 0.00 176.35 175.18 3h3v s THR 1208N -3.94 1.02 0.48 5.49 2.01 -1.26 -4.92 115.64 114.51 3h3v s THR 1208Ca 0.13 -0.45 0.20 0.00 0.31 0.00 0.00 61.69 61.88 3h3v s THR 1208Cb 0.05 -0.91 0.37 0.00 0.01 0.00 0.00 72.50 72.02 3h3v s THR 1208CO -0.04 0.32 1.97 0.24 -0.69 0.00 0.00 174.62 176.41 3h3v h MET 1209N 6.64 0.21 0.05 4.92 0.00 -1.97 0.28 114.93 125.05 3h3v h MET 1209Ca -0.33 -0.01 -0.00 0.00 0.00 0.00 0.00 59.70 59.36 3h3v h MET 1209Cb 1.18 -0.05 -0.00 0.00 0.00 0.00 0.00 31.60 32.73 3h3v h MET 1209CO 0.48 0.14 -0.04 0.78 0.00 0.00 0.00 176.91 178.27 3h3v h GLY 1210N 0.22 -0.56 -0.70 8.32 0.00 -1.94 -2.83 103.07 105.56 3h3v h GLY 1210Ca 0.30 0.24 0.06 0.00 0.00 0.00 0.00 47.33 47.93 3h3v h GLY 1210CO -0.06 -0.21 -0.41 -1.06 0.00 0.00 0.00 176.54 174.80 3h3v n GLN 1211N -2.43 -0.31 0.00 4.80 6.02 -0.25 -0.77 117.38 124.43 3h3v n GLN 1211Ca -0.01 1.35 0.00 0.00 -0.01 0.00 0.00 57.00 58.33 3h3v n GLN 1211Cb 0.04 -2.00 0.00 0.00 1.02 0.00 0.00 30.24 29.30 3h3v n GLN 1211CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3h3v n VAL 1212N -4.58 0.00 -0.28 5.09 0.31 -0.08 -0.88 118.33 117.91 3h3v n VAL 1212Ca 0.01 0.55 0.00 0.00 -0.01 0.00 0.00 64.34 64.89 3h3v n VAL 1212Cb 0.18 -0.83 0.13 0.00 -0.91 0.00 0.00 33.84 32.42 3h3v n VAL 1212CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3h3v h GLY 1213N 0.00 1.17 -0.80 2.92 0.00 -1.39 -0.39 103.07 104.59 3h3v h GLY 1213Ca 0.00 -0.32 0.19 0.00 0.00 0.00 0.00 47.33 47.20 3h3v h GLY 1213CO 0.00 0.20 -0.07 1.18 0.00 0.00 0.00 176.54 177.85 3h3v n GLU 1214N -4.71 -0.07 0.26 4.80 -0.58 0.05 0.13 120.64 120.53 3h3v n GLU 1214Ca 0.11 1.22 -0.11 0.00 -0.42 0.00 0.00 57.16 57.95 3h3v n GLU 1214Cb 0.19 -1.88 -0.05 0.00 -0.57 0.00 0.00 31.44 29.13 3h3v n GLU 1214CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 3h3v h ARG 1215N 0.00 -0.69 -0.80 3.49 9.65 0.46 -2.71 114.38 123.79 3h3v h ARG 1215Ca 0.44 0.05 0.18 0.00 -1.10 0.00 0.00 59.98 59.55 3h3v h ARG 1215Cb 0.83 0.16 -0.15 0.00 -1.39 0.00 0.00 29.97 29.42 3h3v h ARG 1215CO -0.78 -0.45 -0.06 0.82 2.80 0.00 0.00 179.97 182.29 3h3v h ILE 1216N -1.18 0.25 0.18 1.20 2.04 0.12 0.67 117.51 120.79 3h3v h ILE 1216Ca -0.07 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.77 3h3v h ILE 1216Cb 0.56 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3h3v h ILE 1216CO 0.12 0.01 -0.17 0.50 0.00 0.00 0.00 178.15 178.61 3h3v h LYS 1217N 0.05 -0.36 0.00 2.37 3.64 0.11 -0.59 116.57 121.79 3h3v h LYS 1217Ca 0.43 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.83 3h3v h LYS 1217Cb 0.74 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 3h3v h LYS 1217CO -0.75 -0.24 0.00 0.00 -2.27 0.00 0.00 179.45 176.19 3h3v n GLN 1218N -5.29 0.01 0.12 1.90 10.64 -0.16 0.14 117.38 124.75 3h3v n GLN 1218Ca -0.08 0.22 -0.23 0.00 -1.83 0.00 0.00 57.00 55.08 3h3v n GLN 1218Cb 0.21 -1.52 -0.15 0.00 -0.86 0.00 0.00 30.24 27.92 3h3v n GLN 1218CO 0.00 0.00 0.00 1.15 -1.83 0.00 0.00 177.06 176.38 3h3v h THR 1219N 0.00 1.21 0.00 -0.39 2.02 0.18 -3.39 112.91 112.54 3h3v h THR 1219Ca 0.00 -2.69 -0.41 0.00 0.77 0.00 0.00 66.41 64.07 3h3v h THR 1219Cb 0.29 2.96 -0.07 0.00 -1.74 0.00 0.00 68.15 69.60 3h3v h THR 1219CO 0.00 0.83 -2.45 0.49 0.37 0.00 0.00 175.52 174.76 3h3v n PHE 1220N -3.66 0.00 0.00 3.16 3.01 -0.70 -5.07 117.46 114.19 3h3v n PHE 1220Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.28 3h3v n PHE 1220Cb 1.09 -0.95 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 3h3v n PHE 1220CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3h3v n LYS 1221N -3.74 0.00 -2.01 -1.08 5.02 0.38 -4.58 118.16 112.15 3h3v n LYS 1221Ca -0.48 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.39 3h3v n LYS 1221Cb 0.92 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.93 3h3v n LYS 1221CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3h3v n ASN 1222N 7.74 5.56 -0.01 4.39 4.13 -1.26 -3.19 115.26 132.62 3h3v n ASN 1222Ca 0.00 -2.99 0.00 0.00 1.68 0.00 0.00 54.58 53.27 3h3v n ASN 1222Cb 0.00 -1.52 0.00 0.00 -1.54 0.00 0.00 39.78 36.72 3h3v n ASN 1222CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 3h3v n ASP 1223N 4.12 0.00 -3.65 6.41 5.68 -1.26 -5.11 116.55 122.74 3h3v n ASP 1223Ca 0.50 -0.03 -0.06 0.00 -0.50 0.00 0.00 54.79 54.70 3h3v n ASP 1223Cb 0.34 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.25 3h3v n ASP 1223CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 3h3v s LEU 1224N 0.00 -0.82 -0.20 -2.12 2.96 -1.19 -3.76 118.68 113.55 3h3v s LEU 1224Ca 0.00 1.35 -0.10 0.00 -0.22 0.00 0.00 54.13 55.17 3h3v s LEU 1224Cb 0.00 2.04 -0.05 0.00 0.50 0.00 0.00 46.19 48.68 3h3v s LEU 1224CO 0.00 -0.22 0.13 0.12 -1.32 0.00 0.00 176.35 175.05 3h3v s PHE 1225N 2.10 3.37 0.03 5.38 5.36 -0.84 -4.73 117.98 128.65 3h3v s PHE 1225Ca -0.08 0.27 0.01 0.00 -0.96 0.00 0.00 56.93 56.18 3h3v s PHE 1225Cb -0.09 -2.17 -0.02 0.00 -0.34 0.00 0.00 43.02 40.40 3h3v s PHE 1225CO -0.17 0.23 -0.06 0.08 -1.46 0.00 0.00 175.22 173.84 3h3v s VAL 1226N 0.49 0.37 0.24 3.12 1.01 -1.26 -1.57 120.40 122.80 3h3v s VAL 1226Ca 0.07 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.03 3h3v s VAL 1226Cb -0.12 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 3h3v s VAL 1226CO -0.01 -0.44 0.19 -0.63 0.00 0.00 0.00 175.10 174.22 3h3v s ILE 1227N -1.45 0.00 -0.04 2.22 1.01 0.12 -4.97 121.20 118.09 3h3v s ILE 1227Ca -0.12 -1.96 -0.29 0.00 0.00 0.00 0.00 60.65 58.28 3h3v s ILE 1227Cb -0.10 -2.49 0.10 0.00 0.01 0.00 0.00 42.46 39.98 3h3v s ILE 1227CO -0.00 0.00 0.84 -1.66 0.00 0.00 0.00 174.94 174.12 3h3v s TRP 1228N -3.93 -0.44 0.00 3.97 -2.14 -1.26 -0.72 118.94 114.41 3h3v s TRP 1228Ca 0.39 0.54 0.00 0.00 2.66 0.00 0.00 56.10 59.69 3h3v s TRP 1228Cb 0.05 0.49 0.00 0.00 -3.10 0.00 0.00 33.47 30.91 3h3v s TRP 1228CO 0.16 -0.54 0.00 -1.13 -2.66 0.00 0.00 176.95 172.78 3h3v n SER 1229N 0.26 0.00 -3.83 -2.66 3.41 -0.77 -5.01 113.62 105.01 3h3v n SER 1229Ca -0.12 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.36 3h3v n SER 1229Cb 0.60 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.41 3h3v n SER 1229CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3h3v s GLU 1230N 0.00 0.07 0.34 4.33 2.02 -1.26 -4.88 118.70 119.33 3h3v s GLU 1230Ca 0.00 0.13 0.06 0.00 0.02 0.00 0.00 54.97 55.18 3h3v s GLU 1230Cb 0.00 -0.00 0.22 0.00 0.10 0.00 0.00 34.13 34.45 3h3v s GLU 1230CO 0.00 -0.04 0.61 -0.25 0.02 0.00 0.00 175.26 175.61 3h3v n ASP 1231N 3.24 0.00 0.06 -0.19 8.00 -1.26 0.62 116.55 127.02 3h3v n ASP 1231Ca -0.15 0.33 -0.21 0.00 0.71 0.00 0.00 54.79 55.48 3h3v n ASP 1231Cb 0.58 -0.06 -0.13 0.00 -0.02 0.00 0.00 41.12 41.48 3h3v n ASP 1231CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 3h3v h ASN 1232N 0.00 0.65 -2.85 -2.24 -0.73 -2.00 -3.47 115.58 104.94 3h3v h ASN 1232Ca 0.12 -0.87 -0.41 0.00 1.87 0.00 0.00 56.30 57.02 3h3v h ASN 1232Cb 1.31 -0.21 0.22 0.00 0.27 0.00 0.00 38.32 39.91 3h3v h ASN 1232CO -0.00 1.45 -0.27 0.47 -0.37 0.00 0.00 177.43 178.71 3h3v n ASP 1233N -4.01 -2.62 -0.91 1.15 8.00 0.20 -4.95 116.55 113.42 3h3v n ASP 1233Ca -0.13 -0.37 0.12 0.00 0.71 0.00 0.00 54.79 55.11 3h3v n ASP 1233Cb 0.87 -1.10 0.11 0.00 -0.02 0.00 0.00 41.12 40.97 3h3v n ASP 1233CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 3h3v n GLU 1234N -4.51 2.22 -3.64 -1.24 0.28 -1.26 -4.81 120.64 107.67 3h3v n GLU 1234Ca 0.05 -1.82 -0.27 0.00 -0.16 0.00 0.00 57.16 54.96 3h3v n GLU 1234Cb 0.56 -1.46 -0.17 0.00 1.43 0.00 0.00 31.44 31.80 3h3v n GLU 1234CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 3h3v s LYS 1235N -2.03 0.21 -0.14 3.44 2.20 -1.26 -5.04 119.74 117.12 3h3v s LYS 1235Ca 0.28 -0.19 -0.29 0.00 -0.36 0.00 0.00 55.97 55.40 3h3v s LYS 1235Cb 0.20 -1.87 -0.02 0.00 -1.51 0.00 0.00 37.83 34.63 3h3v s LYS 1235CO 0.32 -0.68 1.26 -0.51 -0.36 0.00 0.00 175.35 175.38 3h3v s LEU 1236N 2.07 4.21 0.00 5.43 1.43 -1.26 -4.84 118.68 125.71 3h3v s LEU 1236Ca 0.02 1.74 -0.04 0.00 -1.03 0.00 0.00 54.13 54.81 3h3v s LEU 1236Cb -0.16 -3.54 -0.00 0.00 0.03 0.00 0.00 46.19 42.51 3h3v s LEU 1236CO -0.10 -0.72 0.07 -0.63 0.23 0.00 0.00 176.35 175.19 3h3v s ILE 1237N 3.20 0.08 -0.18 -0.59 1.01 -1.26 -2.45 121.20 121.00 3h3v s ILE 1237Ca 0.55 -0.64 -0.00 0.00 0.00 0.00 0.00 60.65 60.56 3h3v s ILE 1237Cb -0.23 -0.32 0.04 0.00 0.01 0.00 0.00 42.46 41.97 3h3v s ILE 1237CO 0.17 -0.35 -0.06 -0.63 0.00 0.00 0.00 174.94 174.06 3h3v s ILE 1238N -1.15 1.24 0.18 2.92 1.01 -0.95 -1.85 121.20 122.60 3h3v s ILE 1238Ca -0.13 -0.77 0.04 0.00 0.00 0.00 0.00 60.65 59.80 3h3v s ILE 1238Cb -0.07 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 3h3v s ILE 1238CO 0.00 0.10 0.25 -0.13 0.00 0.00 0.00 174.94 175.17 3h3v s ARG 1239N 1.57 3.24 -0.28 2.79 0.52 0.10 -3.04 118.95 123.85 3h3v s ARG 1239Ca -0.00 -0.76 -0.28 0.00 -0.52 0.00 0.00 55.73 54.17 3h3v s ARG 1239Cb -0.16 -2.82 0.19 0.00 0.52 0.00 0.00 34.95 32.68 3h3v s ARG 1239CO -0.08 0.48 1.37 0.00 0.02 0.00 0.00 175.30 177.09 3h3v s ARG 1241N -0.78 0.82 0.00 0.00 0.52 -0.61 -2.35 118.95 116.55 3h3v s ARG 1241Ca 0.08 -1.34 0.00 0.00 -0.52 0.00 0.00 55.73 53.95 3h3v s ARG 1241Cb -0.02 -0.05 0.00 0.00 0.52 0.00 0.00 34.95 35.40 3h3v s ARG 1241CO -0.09 -0.08 0.00 0.28 0.02 0.00 0.00 175.30 175.42 3h3v n VAL 1242N -0.03 0.00 0.00 3.52 0.31 -1.26 -1.99 118.33 118.88 3h3v n VAL 1242Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 3h3v n VAL 1242Cb 0.61 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 3h3v n VAL 1242CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 3h3v n VAL 1243N 0.00 0.00 -0.83 2.52 3.14 -1.25 -4.03 118.33 117.88 3h3v n VAL 1243Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 3h3v n VAL 1243Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 3h3v n VAL 1243CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3h3v n ALA 1254N 0.00 0.00 0.00 1.55 0.00 -1.26 -4.94 120.51 115.86 3h3v n ALA 1254Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h3v n ALA 1254Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3h3v n ALA 1254CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3h3v n GLU 1255N -2.00 0.00 -0.08 0.00 1.02 -1.26 -5.10 120.64 113.23 3h3v n GLU 1255Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 3h3v n GLU 1255Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.29 3h3v n GLU 1255CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3h3v n GLU 1256N 0.00 0.69 -0.29 3.49 1.02 -1.26 -4.22 120.64 120.06 3h3v n GLU 1256Ca 0.00 0.17 0.15 0.00 -0.02 0.00 0.00 57.16 57.46 3h3v n GLU 1256Cb 0.00 -1.60 0.41 0.00 -0.02 0.00 0.00 31.44 30.23 3h3v n GLU 1256CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 3h3v h ASP 1257N 0.02 0.61 0.21 1.62 3.32 -1.99 0.64 116.42 120.85 3h3v h ASP 1257Ca -0.50 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 3h3v h ASP 1257Cb 2.01 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.50 3h3v h ASP 1257CO -0.00 0.26 -0.10 -0.74 -1.72 0.00 0.00 179.24 176.93 3h3v h HIS 1258N 0.61 -0.26 -0.01 4.55 2.76 -2.01 -3.33 115.15 117.47 3h3v h HIS 1258Ca 0.50 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.66 3h3v h HIS 1258Cb 0.95 0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.99 3h3v h HIS 1258CO -0.00 -0.00 -0.01 0.52 -1.30 0.00 0.00 177.93 177.13 3h3v h MET 1259N -0.49 0.02 -5.09 5.26 2.86 -1.38 -3.37 114.93 112.73 3h3v h MET 1259Ca -0.03 -0.01 -0.42 0.00 -2.06 0.00 0.00 59.70 57.18 3h3v h MET 1259Cb 0.37 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.04 3h3v h MET 1259CO 0.05 0.60 1.38 -0.11 1.06 0.00 0.00 176.91 179.88 3h3v n LEU 1260N -4.79 3.07 0.00 1.22 7.94 0.21 0.89 117.00 125.53 3h3v n LEU 1260Ca -0.09 -2.90 0.00 0.00 -1.11 0.00 0.00 56.01 51.91 3h3v n LEU 1260Cb 0.30 -1.46 0.00 0.00 0.53 0.00 0.00 43.42 42.80 3h3v n LEU 1260CO 0.34 -1.56 0.00 1.17 -1.11 0.00 0.00 177.39 176.22 3h3v n LYS 1261N 7.85 0.00 0.03 1.96 4.81 -1.26 -4.80 118.16 126.75 3h3v n LYS 1261Ca 0.46 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.81 3h3v n LYS 1261Cb 0.44 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.36 3h3v n LYS 1261CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 3h3v h LYS 1262N 0.00 0.03 0.00 1.64 1.57 0.34 -2.95 116.57 117.20 3h3v h LYS 1262Ca 0.00 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 3h3v h LYS 1262Cb 0.00 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3h3v h LYS 1262CO 0.00 0.81 -0.13 0.82 -0.57 0.00 0.00 179.45 180.38 3h3v h ILE 1263N 0.01 0.23 -0.42 1.86 2.04 -1.79 -2.33 117.51 117.11 3h3v h ILE 1263Ca -0.15 -1.31 -0.07 0.00 1.00 0.00 0.00 64.86 64.32 3h3v h ILE 1263Cb 1.90 2.10 -0.01 0.00 -0.74 0.00 0.00 36.82 40.07 3h3v h ILE 1263CO 0.11 0.13 -0.02 -0.08 0.00 0.00 0.00 178.15 178.29 3h3v h GLU 1264N 0.00 0.75 0.15 2.37 4.57 -1.77 -3.03 114.58 117.61 3h3v h GLU 1264Ca -0.00 -0.25 -0.24 0.00 -1.18 0.00 0.00 59.36 57.69 3h3v h GLU 1264Cb 1.09 -0.06 0.03 0.00 -0.16 0.00 0.00 28.75 29.65 3h3v h GLU 1264CO 0.02 0.84 -1.03 -0.91 -1.18 0.00 0.00 179.01 176.74 3h3v h ASN 1265N 0.58 0.64 -0.28 1.04 2.35 -1.48 -2.98 115.58 115.46 3h3v h ASN 1265Ca 0.12 -0.90 0.08 0.00 -0.55 0.00 0.00 56.30 55.04 3h3v h ASN 1265Cb 0.51 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 3h3v h ASN 1265CO 0.03 1.49 0.50 0.74 -1.65 0.00 0.00 177.43 178.54 3h3v h THR 1266N -0.11 0.18 0.02 2.81 2.02 -1.46 0.88 112.91 117.25 3h3v h THR 1266Ca -0.17 0.00 -0.28 0.00 0.77 0.00 0.00 66.41 66.73 3h3v h THR 1266Cb 1.79 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.72 3h3v h THR 1266CO 0.20 0.00 -1.55 0.24 0.37 0.00 0.00 175.52 174.78 3h3v h MET 1267N 0.00 0.03 -0.00 6.66 2.86 -1.48 -2.59 114.93 120.42 3h3v h MET 1267Ca 0.13 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3h3v h MET 1267Cb 1.13 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.81 3h3v h MET 1267CO -0.00 0.70 -0.13 1.28 1.06 0.00 0.00 176.91 179.81 3h3v n LEU 1268N -3.17 0.25 0.00 1.22 4.77 0.29 -4.18 117.00 116.19 3h3v n LEU 1268Ca -0.14 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3h3v n LEU 1268Cb 1.03 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 3h3v n LEU 1268CO 0.46 0.05 0.00 -0.62 -1.33 0.00 0.00 177.39 175.95 3h3v n GLU 1269N -1.30 2.08 -0.02 3.23 1.02 -0.54 -4.46 120.64 120.65 3h3v n GLU 1269Ca 0.10 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.20 3h3v n GLU 1269Cb 0.31 -0.17 -0.13 0.00 -0.02 0.00 0.00 31.44 31.42 3h3v n GLU 1269CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3h3v n ASN 1270N 0.00 0.53 -4.70 1.62 3.02 -0.99 -4.93 115.26 109.80 3h3v n ASN 1270Ca 0.00 0.24 -0.42 0.00 -0.03 0.00 0.00 54.58 54.37 3h3v n ASN 1270Cb 0.00 0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 39.67 3h3v n ASN 1270CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h3v s ILE 1271N -2.78 4.43 0.18 2.41 1.01 -1.11 -5.04 121.20 120.31 3h3v s ILE 1271Ca -0.06 1.74 0.11 0.00 0.00 0.00 0.00 60.65 62.44 3h3v s ILE 1271Cb 0.08 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 3h3v s ILE 1271CO 0.83 0.10 -0.22 -0.89 0.00 0.00 0.00 174.94 174.76 3h3v s THR 1272N 1.36 2.49 0.04 2.92 2.01 -1.26 -3.73 115.64 119.47 3h3v s THR 1272Ca 0.55 -1.94 0.00 0.00 0.31 0.00 0.00 61.69 60.61 3h3v s THR 1272Cb -0.25 -2.19 0.00 0.00 0.01 0.00 0.00 72.50 70.07 3h3v s THR 1272CO 0.26 -0.09 0.00 0.18 -0.69 0.00 0.00 174.62 174.28 3h3v n LEU 1273N 0.30 0.40 -4.52 4.42 4.32 0.14 -4.85 117.00 117.22 3h3v n LEU 1273Ca -0.13 0.06 -0.24 0.00 -0.02 0.00 0.00 56.01 55.68 3h3v n LEU 1273Cb 0.56 -0.12 -0.09 0.00 -1.62 0.00 0.00 43.42 42.15 3h3v n LEU 1273CO 0.30 -0.60 -0.44 -0.13 -1.22 0.00 0.00 177.39 175.30 3h3v s ARG 1274N -1.38 1.83 0.67 3.23 0.52 -1.19 -4.95 118.95 117.68 3h3v s ARG 1274Ca 0.00 -1.70 0.00 0.00 -0.52 0.00 0.00 55.73 53.51 3h3v s ARG 1274Cb 0.00 -1.86 0.00 0.00 0.52 0.00 0.00 34.95 33.61 3h3v s ARG 1274CO 0.00 0.32 0.00 0.41 0.02 0.00 0.00 175.30 176.05 3h3v n GLY 1275N -0.70 -1.99 3.55 -3.53 0.00 -1.25 -1.18 105.19 100.09 3h3v n GLY 1275Ca -0.05 -1.38 -0.28 0.00 0.00 0.00 0.00 46.02 44.31 3h3v n GLY 1275CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h3v s VAL 1276N -0.66 3.12 0.87 1.61 1.01 0.37 -4.75 120.40 121.98 3h3v s VAL 1276Ca 0.00 -1.56 -0.11 0.00 0.00 0.00 0.00 61.98 60.31 3h3v s VAL 1276Cb 0.00 -2.50 0.12 0.00 0.00 0.00 0.00 36.38 34.00 3h3v s VAL 1276CO 0.00 -0.02 1.14 -1.83 0.00 0.00 0.00 175.10 174.39 3h3v s GLU 1277N -2.55 1.32 0.00 2.72 -1.05 -1.26 -3.29 118.70 114.59 3h3v s GLU 1277Ca 0.22 1.51 0.00 0.00 -0.15 0.00 0.00 54.97 56.56 3h3v s GLU 1277Cb -0.10 -1.76 0.00 0.00 -0.44 0.00 0.00 34.13 31.83 3h3v s GLU 1277CO 0.14 -2.40 0.00 0.09 0.95 0.00 0.00 175.26 174.03 3h3v n ASN 1278N -3.98 0.00 -4.55 0.83 3.02 -1.26 -4.65 115.26 104.67 3h3v n ASN 1278Ca 0.12 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.25 3h3v n ASN 1278Cb 0.52 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.65 3h3v n ASN 1278CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h3v s ILE 1279N -0.12 3.75 0.00 2.41 1.01 -1.21 -4.05 121.20 122.99 3h3v s ILE 1279Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 60.65 61.07 3h3v s ILE 1279Cb 0.00 -4.91 0.00 0.00 0.01 0.00 0.00 42.46 37.56 3h3v s ILE 1279CO 0.00 -1.82 0.00 -0.62 0.00 0.00 0.00 174.94 172.50 3h3v n GLU 1280N 9.30 0.00 -1.25 2.79 1.02 -1.26 -1.83 120.64 129.41 3h3v n GLU 1280Ca 0.03 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 3h3v n GLU 1280Cb 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.88 3h3v n GLU 1280CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3h3v n ARG 1281N 0.00 0.00 -3.70 3.49 1.74 -1.26 -4.49 116.66 112.44 3h3v n ARG 1281Ca 0.00 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 3h3v n ARG 1281Cb 0.00 -0.90 -0.14 0.00 -1.02 0.00 0.00 32.46 30.40 3h3v n ARG 1281CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h3v s VAL 1282N -0.97 -0.19 0.13 1.55 1.01 -1.26 -2.75 120.40 117.92 3h3v s VAL 1282Ca 0.57 0.25 0.09 0.00 0.00 0.00 0.00 61.98 62.89 3h3v s VAL 1282Cb -0.81 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 3h3v s VAL 1282CO 0.51 0.10 -0.20 -0.69 0.00 0.00 0.00 175.10 174.82 3h3v s VAL 1283N 1.81 1.82 0.40 2.92 1.01 -0.68 -4.99 120.40 122.70 3h3v s VAL 1283Ca -0.03 -1.73 -0.09 0.00 0.00 0.00 0.00 61.98 60.12 3h3v s VAL 1283Cb -0.12 -1.73 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 3h3v s VAL 1283CO -0.07 -0.16 0.75 -0.04 0.00 0.00 0.00 175.10 175.58 3h3v s MET 1284N -2.32 3.73 -0.23 2.72 -1.94 -1.26 -1.67 119.30 118.33 3h3v s MET 1284Ca 0.11 0.39 -0.11 0.00 -1.71 0.00 0.00 55.69 54.37 3h3v s MET 1284Cb -0.08 -2.41 0.08 0.00 2.01 0.00 0.00 34.83 34.43 3h3v s MET 1284CO 0.06 -0.04 0.54 -1.64 -0.01 0.00 0.00 175.02 173.93 3h3v s MET 1285N -3.94 0.52 -0.57 2.03 -1.94 -0.04 -4.92 119.30 110.44 3h3v s MET 1285Ca 0.50 1.08 -0.20 0.00 -1.71 0.00 0.00 55.69 55.36 3h3v s MET 1285Cb -0.10 0.22 0.08 0.00 2.01 0.00 0.00 34.83 37.04 3h3v s MET 1285CO 0.33 -0.18 0.74 0.21 -0.01 0.00 0.00 175.02 176.11 3h3v s LYS 1286N 1.90 3.10 0.21 2.03 2.20 -1.26 0.37 119.74 128.29 3h3v s LYS 1286Ca -0.08 -1.01 0.04 0.00 -0.36 0.00 0.00 55.97 54.57 3h3v s LYS 1286Cb -0.08 -4.18 -0.03 0.00 -1.51 0.00 0.00 37.83 32.02 3h3v s LYS 1286CO -0.16 -1.47 0.30 0.71 -0.36 0.00 0.00 175.35 174.37 3h3v s TYR 1287N 2.98 3.40 -0.23 4.03 4.12 -1.07 -4.93 117.35 125.65 3h3v s TYR 1287Ca 0.16 0.01 -0.16 0.00 0.02 0.00 0.00 57.07 57.10 3h3v s TYR 1287Cb -0.20 -1.57 -0.04 0.00 -1.52 0.00 0.00 41.96 38.63 3h3v s TYR 1287CO 0.10 0.48 0.42 -0.51 0.02 0.00 0.00 175.55 176.06 3h3v s ASP 1288N -3.67 6.39 -0.42 2.29 1.01 -1.26 -2.07 116.67 118.94 3h3v s ASP 1288Ca 0.34 0.46 0.02 0.00 0.71 0.00 0.00 52.55 54.07 3h3v s ASP 1288Cb -0.10 -2.24 0.13 0.00 1.01 0.00 0.00 42.92 41.73 3h3v s ASP 1288CO 0.28 -0.16 0.22 -0.60 0.21 0.00 0.00 175.17 175.13 3h3v s ARG 1289N 1.75 1.14 0.38 8.23 3.52 -1.26 -4.97 118.95 127.75 3h3v s ARG 1289Ca 0.18 -1.84 -0.24 0.00 -0.13 0.00 0.00 55.73 53.70 3h3v s ARG 1289Cb -0.15 -2.17 -0.12 0.00 -1.56 0.00 0.00 34.95 30.95 3h3v s ARG 1289CO 0.09 -1.16 0.79 1.63 -0.81 0.00 0.00 175.30 175.84 3h3v n LYS 1290N 3.71 0.94 -3.50 5.12 5.02 -1.26 -3.40 118.16 124.79 3h3v n LYS 1290Ca 0.08 0.34 -0.09 0.00 -2.02 0.00 0.00 58.31 56.62 3h3v n LYS 1290Cb 0.35 -1.72 -0.02 0.00 -0.02 0.00 0.00 35.03 33.62 3h3v n LYS 1290CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h3v s VAL 1291N -1.30 0.00 0.07 -0.18 1.01 -0.18 -4.90 120.40 114.92 3h3v s VAL 1291Ca 0.63 0.00 -0.31 0.00 0.00 0.00 0.00 61.98 62.29 3h3v s VAL 1291Cb -0.63 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 34.65 3h3v s VAL 1291CO 0.58 0.00 1.90 -2.65 0.00 0.00 0.00 175.10 174.93 3h3v n PRO 1292N -0.18 2.76 -3.20 2.72 -0.02 -1.26 0.38 135.00 136.19 3h3v n PRO 1292Ca -0.10 1.01 -0.38 0.00 -2.02 0.00 0.00 63.50 62.01 3h3v n PRO 1292Cb 0.62 -2.92 -0.06 0.00 -0.02 0.00 0.00 33.50 31.12 3h3v n PRO 1292CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h3v s SER 1293N 3.57 7.09 0.50 2.55 0.15 0.10 -4.89 113.70 122.76 3h3v s SER 1293Ca 0.86 1.33 0.32 0.00 0.70 0.00 0.00 55.95 59.16 3h3v s SER 1293Cb -0.48 -2.38 1.43 0.00 -1.71 0.00 0.00 66.02 62.87 3h3v s SER 1293CO 0.41 0.20 1.78 1.55 1.20 0.00 0.00 173.24 178.37 3h3v h PRO 1294N 4.16 0.11 0.00 5.44 0.13 -1.95 0.68 132.00 140.57 3h3v h PRO 1294Ca -0.49 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3h3v h PRO 1294Cb 1.21 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3h3v h PRO 1294CO 0.64 0.07 0.00 0.00 -0.23 0.00 0.00 178.00 178.49 3h3v h THR 1295N 0.11 0.00 0.00 1.56 1.03 -2.02 -3.48 112.91 110.12 3h3v h THR 1295Ca 0.60 -0.48 0.00 0.00 -0.01 0.00 0.00 66.41 66.52 3h3v h THR 1295Cb 2.13 1.41 0.00 0.00 -1.07 0.00 0.00 68.15 70.61 3h3v h THR 1295CO -0.11 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.01 3h3v n GLY 1296N 0.19 3.51 3.68 2.99 0.00 0.24 -3.55 105.19 112.25 3h3v n GLY 1296Ca 0.02 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 3h3v n GLY 1296CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3v s GLU 1297N 0.00 1.15 -0.13 1.61 2.02 -1.26 -4.11 118.70 117.98 3h3v s GLU 1297Ca 0.00 1.25 -0.12 0.00 0.02 0.00 0.00 54.97 56.12 3h3v s GLU 1297Cb 0.00 -1.76 -0.05 0.00 0.10 0.00 0.00 34.13 32.42 3h3v s GLU 1297CO 0.00 -2.44 0.27 0.71 0.02 0.00 0.00 175.26 173.81 3h3v s TYR 1298N -2.74 3.53 0.13 1.61 1.51 -1.26 0.03 117.35 120.16 3h3v s TYR 1298Ca 0.65 0.63 -0.05 0.00 -1.01 0.00 0.00 57.07 57.29 3h3v s TYR 1298Cb -0.21 -2.23 -0.02 0.00 -0.11 0.00 0.00 41.96 39.39 3h3v s TYR 1298CO 0.58 0.42 0.15 0.08 -1.11 0.00 0.00 175.55 175.67 3h3v s VAL 1299N -0.13 0.11 -0.48 0.71 1.01 0.16 -4.84 120.40 116.94 3h3v s VAL 1299Ca 0.17 -1.61 -0.28 0.00 0.00 0.00 0.00 61.98 60.26 3h3v s VAL 1299Cb -0.13 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 3h3v s VAL 1299CO 0.05 -0.50 1.69 -0.54 0.00 0.00 0.00 175.10 175.80 3h3v s LYS 1300N -3.98 3.13 -0.68 2.72 1.02 -1.26 -1.01 119.74 119.67 3h3v s LYS 1300Ca 0.17 0.89 0.05 0.00 0.02 0.00 0.00 55.97 57.10 3h3v s LYS 1300Cb 0.06 -4.22 0.25 0.00 -0.52 0.00 0.00 37.83 33.40 3h3v s LYS 1300CO -0.02 -2.12 0.81 -1.91 -0.92 0.00 0.00 175.35 171.19 3h3v n GLU 1301N 8.68 2.69 -1.44 1.68 2.13 -1.22 -4.96 120.64 128.20 3h3v n GLU 1301Ca 0.19 -4.66 -0.43 0.00 0.66 0.00 0.00 57.16 52.92 3h3v n GLU 1301Cb 0.49 -2.28 -0.00 0.00 0.27 0.00 0.00 31.44 29.92 3h3v n GLU 1301CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3h3v n PRO 1302N 0.92 0.52 -3.82 5.31 -0.04 -1.26 -4.31 135.00 132.32 3h3v n PRO 1302Ca 0.29 0.19 -0.13 0.00 -0.04 0.00 0.00 63.50 63.81 3h3v n PRO 1302Cb 0.40 -1.42 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 3h3v n PRO 1302CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3h3v s GLU 1303N -1.44 0.08 0.61 0.54 -1.05 -0.88 -4.37 118.70 112.20 3h3v s GLU 1303Ca 0.62 0.17 -0.17 0.00 -0.15 0.00 0.00 54.97 55.44 3h3v s GLU 1303Cb -0.66 -0.02 -0.02 0.00 -0.44 0.00 0.00 34.13 32.98 3h3v s GLU 1303CO 0.59 -0.06 1.13 -1.58 0.95 0.00 0.00 175.26 176.29 3h3v s TRP 1304N 0.36 2.58 0.09 4.83 0.52 -1.19 -2.58 118.94 123.55 3h3v s TRP 1304Ca -0.03 1.55 -0.16 0.00 0.02 0.00 0.00 56.10 57.49 3h3v s TRP 1304Cb -0.04 -3.26 0.03 0.00 -1.15 0.00 0.00 33.47 29.05 3h3v s TRP 1304CO -0.01 -1.75 0.37 0.08 0.02 0.00 0.00 176.95 175.66 3h3v s VAL 1305N -2.03 0.07 -0.14 4.03 1.01 0.16 -4.45 120.40 119.06 3h3v s VAL 1305Ca 0.71 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 3h3v s VAL 1305Cb -0.23 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3h3v s VAL 1305CO 0.35 -0.34 0.07 -0.76 0.00 0.00 0.00 175.10 174.42 3h3v s LEU 1306N -2.47 3.91 0.01 3.92 1.43 -0.68 -0.86 118.68 123.94 3h3v s LEU 1306Ca -0.00 0.21 0.06 0.00 -1.03 0.00 0.00 54.13 53.36 3h3v s LEU 1306Cb 0.01 -1.95 -0.03 0.00 0.03 0.00 0.00 46.19 44.25 3h3v s LEU 1306CO -0.08 0.29 -0.16 -1.61 0.23 0.00 0.00 176.35 175.03 3h3v s GLU 1307N -0.36 2.27 0.00 1.70 2.02 -0.67 -0.99 118.70 122.67 3h3v s GLU 1307Ca 0.09 -0.86 0.00 0.00 0.02 0.00 0.00 54.97 54.23 3h3v s GLU 1307Cb -0.12 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.83 3h3v s GLU 1307CO 0.02 0.58 0.00 -2.37 0.02 0.00 0.00 175.26 173.50 3h3v n THR 1308N 1.82 0.00 -1.80 3.63 5.66 -0.92 -1.68 114.28 120.99 3h3v n THR 1308Ca -0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 3h3v n THR 1308Cb 0.52 -0.23 0.00 0.00 -1.55 0.00 0.00 70.33 69.08 3h3v n THR 1308CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3h3v n ASP 1309N -1.06 0.00 -3.51 1.09 -0.08 -1.11 -4.31 116.55 107.57 3h3v n ASP 1309Ca 0.00 -1.46 -0.13 0.00 -1.51 0.00 0.00 54.79 51.69 3h3v n ASP 1309Cb 0.00 -0.09 -0.05 0.00 2.34 0.00 0.00 41.12 43.32 3h3v n ASP 1309CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 3h3v s GLY 1310N -0.46 1.17 -0.34 0.27 0.00 -1.26 -4.38 107.32 102.31 3h3v s GLY 1310Ca 0.00 -1.32 -0.01 0.00 0.00 0.00 0.00 44.72 43.39 3h3v s GLY 1310CO 0.00 -0.89 0.19 0.14 0.00 0.00 0.00 173.10 172.54 3h3v s VAL 1311N -3.37 0.09 -0.49 1.40 1.01 -1.26 -4.26 120.40 113.53 3h3v s VAL 1311Ca 0.28 -1.49 0.08 0.00 0.00 0.00 0.00 61.98 60.85 3h3v s VAL 1311Cb -0.00 -1.09 0.35 0.00 0.00 0.00 0.00 36.38 35.64 3h3v s VAL 1311CO 0.16 -0.93 0.87 -3.20 0.00 0.00 0.00 175.10 172.00 3h3v n ASN 1312N 4.33 2.99 -0.03 3.32 2.85 -1.26 -4.98 115.26 122.48 3h3v n ASN 1312Ca 0.08 -3.40 -0.01 0.00 -0.11 0.00 0.00 54.58 51.14 3h3v n ASN 1312Cb 0.38 -0.58 -0.01 0.00 1.24 0.00 0.00 39.78 40.81 3h3v n ASN 1312CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 3h3v h LEU 1313N 2.98 -0.18 -0.85 1.20 5.85 -1.95 0.34 115.31 122.70 3h3v h LEU 1313Ca 0.12 0.03 0.28 0.00 0.84 0.00 0.00 57.88 59.14 3h3v h LEU 1313Cb 0.71 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.75 3h3v h LEU 1313CO 0.69 -0.02 0.57 -1.54 -0.34 0.00 0.00 178.44 177.79 3h3v n SER 1314N -3.12 0.09 -0.06 1.25 3.41 -1.26 -1.21 113.62 112.72 3h3v n SER 1314Ca 0.00 0.71 -0.07 0.00 -0.26 0.00 0.00 58.87 59.25 3h3v n SER 1314Cb 0.02 -0.35 -0.07 0.00 -0.26 0.00 0.00 64.21 63.55 3h3v n SER 1314CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h3v n GLU 1315N -3.59 1.36 0.00 4.33 1.02 -0.79 -4.38 120.64 118.59 3h3v n GLU 1315Ca 0.23 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 3h3v n GLU 1315Cb 0.93 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 31.09 3h3v n GLU 1315CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3h3v n VAL 1316N -2.62 0.00 -0.10 2.62 0.31 0.04 -2.20 118.33 116.38 3h3v n VAL 1316Ca -0.19 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 63.96 3h3v n VAL 1316Cb 0.78 -0.31 -0.08 0.00 -0.91 0.00 0.00 33.84 33.33 3h3v n VAL 1316CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 3h3v n MET 1317N -0.49 0.46 0.00 5.55 0.00 -1.02 -4.41 117.12 117.20 3h3v n MET 1317Ca 0.00 0.15 0.03 0.00 -0.00 0.00 0.00 57.70 57.88 3h3v n MET 1317Cb 0.00 -1.31 0.15 0.00 0.00 0.00 0.00 33.22 32.06 3h3v n MET 1317CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 3h3v n THR 1318N -3.47 0.56 -2.03 1.12 -2.24 -0.94 -4.74 114.28 102.55 3h3v n THR 1318Ca -0.37 0.14 -0.38 0.00 -2.27 0.00 0.00 64.05 61.17 3h3v n THR 1318Cb 0.83 -1.05 0.01 0.00 -2.10 0.00 0.00 70.33 68.02 3h3v n THR 1318CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3h3v s VAL 1319N -2.34 2.61 0.28 2.28 1.01 -1.24 -5.01 120.40 117.98 3h3v s VAL 1319Ca 0.07 0.47 -0.19 0.00 0.00 0.00 0.00 61.98 62.33 3h3v s VAL 1319Cb 0.04 -3.25 -0.09 0.00 0.00 0.00 0.00 36.38 33.08 3h3v s VAL 1319CO 0.08 0.01 0.76 -2.16 0.00 0.00 0.00 175.10 173.79 3h3v s PRO 1320N -2.70 4.20 0.00 2.72 0.04 -1.26 -4.09 135.00 133.90 3h3v s PRO 1320Ca 0.66 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.56 3h3v s PRO 1320Cb -0.35 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.52 3h3v s PRO 1320CO 0.42 0.28 0.00 0.41 0.04 0.00 0.00 177.00 178.15 3h3v n GLY 1321N 0.25 2.29 3.99 0.56 0.00 -1.26 -5.00 105.19 106.03 3h3v n GLY 1321Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 3h3v n GLY 1321CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h3v s ILE 1322N -2.62 2.50 -0.75 -0.61 -4.36 -1.26 -0.98 121.20 113.13 3h3v s ILE 1322Ca 0.00 -1.09 -0.02 0.00 -0.26 0.00 0.00 60.65 59.27 3h3v s ILE 1322Cb 0.00 -2.59 0.19 0.00 1.25 0.00 0.00 42.46 41.31 3h3v s ILE 1322CO 0.00 0.00 0.59 -0.62 0.24 0.00 0.00 174.94 175.15 3h3v s ASP 1323N -4.44 5.57 0.00 4.36 -1.08 0.96 -4.48 116.67 117.55 3h3v s ASP 1323Ca 0.55 -3.26 0.00 0.00 -0.52 0.00 0.00 52.55 49.32 3h3v s ASP 1323Cb -0.07 -1.88 0.00 0.00 -1.46 0.00 0.00 42.92 39.52 3h3v s ASP 1323CO 0.34 -0.28 0.00 -0.81 0.52 0.00 0.00 175.17 174.93 3h3v n PRO 1324N 2.94 0.00 -1.39 4.34 -0.04 -1.26 -0.85 135.00 138.74 3h3v n PRO 1324Ca 0.14 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.60 3h3v n PRO 1324Cb 0.38 -1.46 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 3h3v n PRO 1324CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3h3v n THR 1325N 1.19 0.04 -1.27 0.52 -1.04 -1.26 -4.80 114.28 107.67 3h3v n THR 1325Ca 0.00 -0.72 0.00 0.00 -2.04 0.00 0.00 64.05 61.29 3h3v n THR 1325Cb 0.00 0.84 0.00 0.00 -1.82 0.00 0.00 70.33 69.35 3h3v n THR 1325CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3h3v n ARG 1326N 0.25 0.00 -2.17 -2.82 1.74 -0.03 -5.11 116.66 108.53 3h3v n ARG 1326Ca -0.06 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.61 3h3v n ARG 1326Cb 0.98 -0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.39 3h3v n ARG 1326CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 3h3v s ILE 1327N 0.00 3.02 -0.05 0.55 2.07 -1.19 -4.53 121.20 121.08 3h3v s ILE 1327Ca 0.00 0.89 -0.02 0.00 -1.41 0.00 0.00 60.65 60.11 3h3v s ILE 1327Cb 0.00 -3.57 0.04 0.00 0.13 0.00 0.00 42.46 39.06 3h3v s ILE 1327CO 0.00 0.15 0.10 -0.47 -1.91 0.00 0.00 174.94 172.81 3h3v s TYR 1328N -0.22 -0.06 -0.29 3.50 5.04 -0.26 -5.01 117.35 120.06 3h3v s TYR 1328Ca 0.55 0.36 0.01 0.00 -2.44 0.00 0.00 57.07 55.55 3h3v s TYR 1328Cb -0.38 -0.26 0.06 0.00 0.35 0.00 0.00 41.96 41.73 3h3v s TYR 1328CO 0.42 -0.17 -0.04 0.99 -1.34 0.00 0.00 175.55 175.40 3h3v s THR 1329N 1.63 2.57 0.66 4.34 2.01 -1.26 -0.92 115.64 124.67 3h3v s THR 1329Ca -0.03 -1.58 0.11 0.00 0.31 0.00 0.00 61.69 60.50 3h3v s THR 1329Cb -0.12 -2.52 0.12 0.00 0.01 0.00 0.00 72.50 69.98 3h3v s THR 1329CO -0.04 -0.11 1.31 -0.55 -0.69 0.00 0.00 174.62 174.53 3h3v h ASN 1330N 7.87 0.00 -0.19 3.53 7.08 -1.81 -3.11 115.58 128.95 3h3v h ASN 1330Ca -0.19 0.00 -0.58 0.00 -3.08 0.00 0.00 56.30 52.46 3h3v h ASN 1330Cb 1.05 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 37.30 3h3v h ASN 1330CO 0.50 0.00 2.06 -0.24 -2.08 0.00 0.00 177.43 177.67 3h3v n SER 1331N -2.68 2.98 -0.30 6.14 2.88 -1.26 -4.66 113.62 116.72 3h3v n SER 1331Ca 0.01 -2.72 0.12 0.00 -1.33 0.00 0.00 58.87 54.95 3h3v n SER 1331Cb 0.83 -1.38 0.29 0.00 -0.75 0.00 0.00 64.21 63.19 3h3v n SER 1331CO 0.00 0.00 0.00 2.19 -1.23 0.00 0.00 175.04 176.00 3h3v h PHE 1332N 8.15 0.56 -0.97 0.66 -0.00 -1.90 0.27 116.94 123.71 3h3v h PHE 1332Ca 0.39 0.04 0.32 0.00 -0.00 0.00 0.00 57.97 58.72 3h3v h PHE 1332Cb 0.75 -0.11 -0.16 0.00 -0.00 0.00 0.00 35.95 36.43 3h3v h PHE 1332CO 1.27 -0.07 0.41 0.97 -0.00 0.00 0.00 178.31 180.89 3h3v h ILE 1333N 0.36 0.19 0.38 0.88 -0.00 -1.90 0.14 117.51 117.56 3h3v h ILE 1333Ca 0.54 -0.06 -0.02 0.00 -0.00 0.00 0.00 64.86 65.32 3h3v h ILE 1333Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 36.82 37.84 3h3v h ILE 1333CO -0.54 0.03 -0.18 0.44 -0.00 0.00 0.00 178.15 177.90 3h3v h ASP 1334N 0.18 -0.43 0.00 2.19 3.32 -0.83 -3.02 116.42 117.82 3h3v h ASP 1334Ca 0.70 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.68 3h3v h ASP 1334Cb 1.63 0.11 0.00 0.00 0.22 0.00 0.00 39.33 41.29 3h3v h ASP 1334CO -0.70 0.02 0.00 -0.38 -1.72 0.00 0.00 179.24 176.46 3h3v n ILE 1335N -5.12 0.00 -0.10 0.35 5.41 0.25 0.01 119.36 120.15 3h3v n ILE 1335Ca -0.08 0.00 -0.24 0.00 1.00 0.00 0.00 62.75 63.43 3h3v n ILE 1335Cb 0.24 -0.98 -0.11 0.00 -0.71 0.00 0.00 39.64 38.08 3h3v n ILE 1335CO 0.00 0.00 0.00 0.80 0.00 0.00 0.00 176.55 177.35 3h3v n MET 1336N -0.79 0.62 0.06 0.38 1.56 0.13 -3.54 117.12 115.53 3h3v n MET 1336Ca 0.00 0.37 0.13 0.00 -0.27 0.00 0.00 57.70 57.93 3h3v n MET 1336Cb 0.00 -1.63 0.48 0.00 2.15 0.00 0.00 33.22 34.22 3h3v n MET 1336CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 3h3v n GLU 1337N -4.07 0.14 -0.08 2.12 1.02 0.10 -1.86 120.64 118.02 3h3v n GLU 1337Ca -0.41 0.17 -0.10 0.00 -0.02 0.00 0.00 57.16 56.79 3h3v n GLU 1337Cb 0.85 -1.68 -0.03 0.00 -0.02 0.00 0.00 31.44 30.55 3h3v n GLU 1337CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3h3v n VAL 1338N -1.94 1.45 0.13 2.62 0.31 -0.93 -4.71 118.33 115.26 3h3v n VAL 1338Ca 0.05 0.11 0.01 0.00 -0.01 0.00 0.00 64.34 64.51 3h3v n VAL 1338Cb 0.36 -2.20 0.00 0.00 -0.91 0.00 0.00 33.84 31.08 3h3v n VAL 1338CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3h3v h LEU 1339N -0.87 0.00 0.00 7.52 3.38 -1.73 -3.50 115.31 120.11 3h3v h LEU 1339Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3h3v h LEU 1339Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3h3v h LEU 1339CO -0.04 0.58 0.00 0.61 0.09 0.00 0.00 178.44 179.67 3h3v n GLY 1340N 1.25 1.95 0.00 0.83 0.00 -0.78 -4.73 105.19 103.71 3h3v n GLY 1340Ca 0.02 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.89 3h3v n GLY 1340CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3h3v n ILE 1341N 2.06 0.00 -0.12 -0.61 3.06 -1.10 -0.37 119.36 122.28 3h3v n ILE 1341Ca 0.00 0.00 -0.05 0.00 -2.50 0.00 0.00 62.75 60.20 3h3v n ILE 1341Cb 0.00 0.00 -0.04 0.00 0.54 0.00 0.00 39.64 40.14 3h3v n ILE 1341CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 3h3v h GLU 1342N 0.00 -0.06 -0.46 9.51 4.39 -1.91 1.21 114.58 127.26 3h3v h GLU 1342Ca 0.00 0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.84 3h3v h GLU 1342Cb 0.00 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3h3v h GLU 1342CO 0.00 -0.04 0.38 0.00 -1.16 0.00 0.00 179.01 178.19 3h3v h ALA 1343N -0.56 2.31 0.67 3.43 0.00 -0.99 0.20 119.26 124.31 3h3v h ALA 1343Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3h3v h ALA 1343Cb 0.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3h3v h ALA 1343CO -0.32 -0.61 -0.34 0.78 0.00 0.00 0.00 179.25 178.76 3h3v h GLY 1344N 0.00 -0.98 -0.75 0.00 0.00 0.14 -2.70 103.07 98.78 3h3v h GLY 1344Ca 0.22 0.38 0.07 0.00 0.00 0.00 0.00 47.33 47.99 3h3v h GLY 1344CO -0.00 -0.35 -0.44 -2.13 0.00 0.00 0.00 176.54 173.61 3h3v n ARG 1345N -5.50 -0.33 -0.25 4.80 0.63 0.67 -0.27 116.66 116.41 3h3v n ARG 1345Ca -0.13 1.37 -0.03 0.00 -0.92 0.00 0.00 57.85 58.14 3h3v n ARG 1345Cb 0.38 -2.02 -0.01 0.00 0.45 0.00 0.00 32.46 31.27 3h3v n ARG 1345CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3h3v n ALA 1346N -3.20 -0.20 0.08 5.13 0.00 -1.05 0.58 120.51 121.87 3h3v n ALA 1346Ca 0.02 0.60 -0.13 0.00 0.00 0.00 0.00 53.44 53.93 3h3v n ALA 1346Cb 0.20 -0.21 -0.08 0.00 0.00 0.00 0.00 19.45 19.35 3h3v n ALA 1346CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3v h ALA 1347N 0.68 -0.16 -0.66 0.00 0.00 -0.33 1.36 119.26 120.15 3h3v h ALA 1347Ca 0.18 -0.10 0.14 0.00 0.00 0.00 0.00 54.91 55.12 3h3v h ALA 1347Cb 0.34 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 3h3v h ALA 1347CO -0.62 -0.51 0.11 1.25 0.00 0.00 0.00 179.25 179.48 3h3v h LEU 1348N -0.32 -0.07 0.24 0.00 5.85 0.10 0.60 115.31 121.71 3h3v h LEU 1348Ca -0.02 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3h3v h LEU 1348Cb 0.26 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.50 3h3v h LEU 1348CO 0.03 -0.05 -0.11 0.22 -0.34 0.00 0.00 178.44 178.19 3h3v h TYR 1349N 0.22 -0.30 -0.89 1.25 3.20 0.39 -2.60 116.97 118.25 3h3v h TYR 1349Ca 0.36 -0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.41 3h3v h TYR 1349Cb 0.59 0.10 -0.17 0.00 1.54 0.00 0.00 36.73 38.79 3h3v h TYR 1349CO -0.29 0.07 -0.19 -0.22 -1.64 0.00 0.00 178.16 175.90 3h3v h LYS 1350N -0.75 0.01 0.59 1.82 3.64 0.39 0.45 116.57 122.72 3h3v h LYS 1350Ca -0.03 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3h3v h LYS 1350Cb 0.50 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.32 3h3v h LYS 1350CO 0.05 0.00 -0.28 1.49 -2.27 0.00 0.00 179.45 178.44 3h3v h GLU 1351N 0.01 -0.76 -1.26 1.90 4.57 0.11 -0.78 114.58 118.35 3h3v h GLU 1351Ca 0.44 0.05 0.44 0.00 -1.18 0.00 0.00 59.36 59.11 3h3v h GLU 1351Cb 0.70 0.17 -0.14 0.00 -0.16 0.00 0.00 28.75 29.32 3h3v h GLU 1351CO -0.90 -0.51 0.79 0.28 -1.18 0.00 0.00 179.01 177.48 3h3v h VAL 1352N -0.80 0.07 0.58 0.32 2.07 -0.91 0.29 116.25 117.87 3h3v h VAL 1352Ca -0.08 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 3h3v h VAL 1352Cb 0.61 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3h3v h VAL 1352CO 0.13 0.01 -0.28 0.22 0.02 0.00 0.00 177.57 177.67 3h3v h TYR 1353N 0.06 -0.73 0.00 1.57 3.20 -0.58 -2.97 116.97 117.53 3h3v h TYR 1353Ca 0.84 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.69 3h3v h TYR 1353Cb 2.54 0.24 0.00 0.00 1.54 0.00 0.00 36.73 41.05 3h3v h TYR 1353CO -0.01 -0.44 0.27 -0.91 -1.64 0.00 0.00 178.16 175.44 3h3v h ASN 1354N -1.20 0.00 0.00 -2.11 2.35 0.98 -0.34 115.58 115.27 3h3v h ASN 1354Ca -0.08 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 3h3v h ASN 1354Cb 0.61 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.98 3h3v h ASN 1354CO 0.13 0.00 -0.00 0.58 -1.65 0.00 0.00 177.43 176.49 3h3v h VAL 1355N 0.00 1.30 0.00 2.81 2.07 -1.01 -2.66 116.25 118.76 3h3v h VAL 1355Ca 0.00 -1.96 0.00 0.00 0.82 0.00 0.00 66.70 65.56 3h3v h VAL 1355Cb 0.55 2.45 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 3h3v h VAL 1355CO 0.00 0.44 0.00 -0.38 0.02 0.00 0.00 177.57 177.65 3h3v n ILE 1356N -4.66 0.78 -0.04 4.57 5.41 -0.41 -3.18 119.36 121.83 3h3v n ILE 1356Ca -0.07 0.18 -0.11 0.00 1.00 0.00 0.00 62.75 63.75 3h3v n ILE 1356Cb 0.35 -0.92 -0.14 0.00 -0.71 0.00 0.00 39.64 38.21 3h3v n ILE 1356CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h3v n ALA 1357N -1.56 1.41 0.31 -1.39 0.00 -0.27 -3.78 120.51 115.22 3h3v n ALA 1357Ca 0.04 -0.88 0.20 0.00 0.00 0.00 0.00 53.44 52.80 3h3v n ALA 1357Cb 0.22 -0.65 0.95 0.00 0.00 0.00 0.00 19.45 19.96 3h3v n ALA 1357CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h3v h SER 1358N 0.01 0.00 0.97 0.00 4.64 -1.43 -1.32 113.55 116.42 3h3v h SER 1358Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3h3v h SER 1358Cb 2.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.15 3h3v h SER 1358CO 0.06 0.01 -0.25 0.47 -0.87 0.00 0.00 176.83 176.25 3h3v n ASP 1359N -3.12 0.46 0.00 4.97 8.00 -1.25 -4.95 116.55 120.66 3h3v n ASP 1359Ca -0.01 0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.75 3h3v n ASP 1359Cb 0.19 -0.25 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 3h3v n ASP 1359CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h3v n GLY 1360N 1.42 2.96 3.29 0.44 0.00 -0.50 -5.03 105.19 107.77 3h3v n GLY 1360Ca 0.05 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 3h3v n GLY 1360CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h3v n SER 1361N 1.72 -2.91 -4.25 1.61 7.64 -1.25 -4.92 113.62 111.26 3h3v n SER 1361Ca 0.00 0.80 -0.32 0.00 1.01 0.00 0.00 58.87 60.36 3h3v n SER 1361Cb 0.00 -0.88 -0.16 0.00 -1.01 0.00 0.00 64.21 62.16 3h3v n SER 1361CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 3h3v s TYR 1362N -1.69 2.65 0.02 1.43 5.04 -1.26 -4.38 117.35 119.15 3h3v s TYR 1362Ca 0.59 -0.99 0.07 0.00 -2.44 0.00 0.00 57.07 54.30 3h3v s TYR 1362Cb -0.63 -1.77 -0.02 0.00 0.35 0.00 0.00 41.96 39.89 3h3v s TYR 1362CO 0.63 -0.40 -0.20 0.08 -1.34 0.00 0.00 175.55 174.32 3h3v s VAL 1363N 0.43 1.62 -0.36 3.14 1.01 -1.26 -4.62 120.40 120.36 3h3v s VAL 1363Ca -0.15 -1.06 -0.23 0.00 0.00 0.00 0.00 61.98 60.54 3h3v s VAL 1363Cb -0.17 -1.38 0.01 0.00 0.00 0.00 0.00 36.38 34.83 3h3v s VAL 1363CO 0.06 0.29 0.75 0.21 0.00 0.00 0.00 175.10 176.41 3h3v s ASN 1364N -0.91 6.52 0.00 3.32 3.04 -1.23 -4.95 114.94 120.73 3h3v s ASN 1364Ca 0.07 0.31 0.00 0.00 0.04 0.00 0.00 52.86 53.28 3h3v s ASN 1364Cb -0.08 -2.38 0.00 0.00 -1.54 0.00 0.00 41.25 37.25 3h3v s ASN 1364CO 0.01 -0.70 0.00 0.00 -3.04 0.00 0.00 177.10 173.37 3h3v n TYR 1365N 6.33 0.00 0.00 0.43 9.36 -1.26 -1.02 117.16 131.01 3h3v n TYR 1365Ca 0.02 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.24 3h3v n TYR 1365Cb 0.48 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.19 3h3v n TYR 1365CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 3h3v n ARG 1366N -0.18 0.00 0.12 2.98 1.85 -1.26 -0.04 116.66 120.13 3h3v n ARG 1366Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.80 3h3v n ARG 1366Cb 0.00 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.39 3h3v n ARG 1366CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 3h3v h HIS 1367N 0.00 -0.30 -0.73 2.89 3.86 -1.43 0.57 115.15 120.02 3h3v h HIS 1367Ca 0.00 -0.01 0.12 0.00 -1.16 0.00 0.00 60.37 59.33 3h3v h HIS 1367Cb 0.00 0.10 -0.09 0.00 1.06 0.00 0.00 27.41 28.48 3h3v h HIS 1367CO 0.00 -0.18 0.31 0.52 0.86 0.00 0.00 177.93 179.43 3h3v h MET 1368N -0.48 0.47 0.20 2.45 2.86 -1.26 0.08 114.93 119.25 3h3v h MET 1368Ca -0.03 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3h3v h MET 1368Cb 0.25 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 3h3v h MET 1368CO 0.05 0.31 -0.53 0.00 1.06 0.00 0.00 176.91 177.81 3h3v h ALA 1369N 1.50 -1.04 -0.39 6.32 0.00 -0.45 0.55 119.26 125.75 3h3v h ALA 1369Ca 0.38 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.21 3h3v h ALA 1369Cb 0.53 0.87 -0.07 0.00 0.00 0.00 0.00 17.79 19.12 3h3v h ALA 1369CO -0.35 -1.15 -0.49 1.25 0.00 0.00 0.00 179.25 178.51 3h3v h LEU 1370N -0.81 -1.64 -0.09 0.00 5.85 0.20 0.36 115.31 119.16 3h3v h LEU 1370Ca -0.02 0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.96 3h3v h LEU 1370Cb 0.79 0.68 -0.06 0.00 0.37 0.00 0.00 40.66 42.43 3h3v h LEU 1370CO -0.24 -0.34 -0.40 0.25 -0.34 0.00 0.00 178.44 177.36 3h3v h LEU 1371N -0.32 -1.25 -2.00 2.25 5.85 -0.81 0.35 115.31 119.38 3h3v h LEU 1371Ca 0.07 0.16 0.28 0.00 0.84 0.00 0.00 57.88 59.24 3h3v h LEU 1371Cb 0.51 0.51 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 3h3v h LEU 1371CO -0.54 -0.43 0.70 1.62 -0.34 0.00 0.00 178.44 179.46 3h3v h VAL 1372N -0.50 0.51 0.09 1.05 3.04 0.88 -1.13 116.25 120.19 3h3v h VAL 1372Ca 0.07 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.76 3h3v h VAL 1372Cb 0.62 0.51 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 3h3v h VAL 1372CO -0.37 0.00 -0.04 0.44 -1.01 0.00 0.00 177.57 176.59 3h3v h ASP 1373N 0.00 -0.10 -1.14 3.17 3.32 0.33 -2.57 116.42 119.42 3h3v h ASP 1373Ca 0.46 -0.23 0.43 0.00 0.02 0.00 0.00 57.03 57.71 3h3v h ASP 1373Cb 1.87 0.03 -0.15 0.00 0.22 0.00 0.00 39.33 41.29 3h3v h ASP 1373CO -0.00 0.49 0.68 0.52 -1.72 0.00 0.00 179.24 179.20 3h3v n VAL 1374N -4.83 -0.32 0.07 -1.35 0.31 0.78 0.30 118.33 113.28 3h3v n VAL 1374Ca -0.04 1.84 -0.20 0.00 -0.01 0.00 0.00 64.34 65.93 3h3v n VAL 1374Cb 0.16 -3.01 -0.11 0.00 -0.91 0.00 0.00 33.84 29.97 3h3v n VAL 1374CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 3h3v h MET 1375N 0.00 0.60 0.01 5.55 2.86 -1.48 -3.39 114.93 119.09 3h3v h MET 1375Ca 0.83 -0.73 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3h3v h MET 1375Cb 2.44 0.23 0.00 0.00 0.06 0.00 0.00 31.60 34.33 3h3v h MET 1375CO -0.60 1.32 -0.01 0.00 1.06 0.00 0.00 176.91 178.68 3h3v h THR 1376N 0.30 1.47 0.00 2.22 1.03 0.50 -2.91 112.91 115.52 3h3v h THR 1376Ca -0.15 -1.49 0.00 0.00 -0.01 0.00 0.00 66.41 64.76 3h3v h THR 1376Cb 1.80 2.46 0.00 0.00 -1.07 0.00 0.00 68.15 71.34 3h3v h THR 1376CO 0.22 0.38 0.00 0.35 -0.01 0.00 0.00 175.52 176.46 3h3v n THR 1377N -4.79 0.00 0.00 0.00 -2.24 -0.07 -3.20 114.28 103.98 3h3v n THR 1377Ca -0.09 0.51 0.00 0.00 -2.27 0.00 0.00 64.05 62.20 3h3v n THR 1377Cb 0.32 -0.97 0.00 0.00 -2.10 0.00 0.00 70.33 67.57 3h3v n THR 1377CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3v n GLN 1378N -0.10 0.00 0.03 -0.78 1.13 -1.26 -4.49 117.38 111.91 3h3v n GLN 1378Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 3h3v n GLN 1378Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 3h3v n GLN 1378CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3h3v n GLY 1379N -0.19 -1.88 0.00 1.08 0.00 -1.19 -5.13 105.19 97.87 3h3v n GLY 1379Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.61 3h3v n GLY 1379CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3v n GLY 1380N -1.40 2.31 3.57 -0.02 0.00 -1.26 -4.94 105.19 103.46 3h3v n GLY 1380Ca 0.00 -0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 3h3v n GLY 1380CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3v s LEU 1381N 0.00 3.69 -0.37 0.99 1.43 -1.26 -4.32 118.68 118.84 3h3v s LEU 1381Ca 0.00 -0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.07 3h3v s LEU 1381Cb 0.00 -1.95 0.09 0.00 0.03 0.00 0.00 46.19 44.36 3h3v s LEU 1381CO 0.00 0.11 0.12 -0.89 0.23 0.00 0.00 176.35 175.92 3h3v s THR 1382N 0.76 3.04 0.38 5.49 2.01 -1.10 -5.06 115.64 121.15 3h3v s THR 1382Ca 0.03 -1.93 -0.27 0.00 0.31 0.00 0.00 61.69 59.83 3h3v s THR 1382Cb -0.13 -3.02 -0.11 0.00 0.01 0.00 0.00 72.50 69.25 3h3v s THR 1382CO 0.02 -0.52 1.36 -1.54 -0.69 0.00 0.00 174.62 173.25 3h3v n SER 1383N 4.54 3.08 -3.32 3.53 3.41 -1.26 -4.64 113.62 118.95 3h3v n SER 1383Ca -0.04 1.19 -0.36 0.00 -0.26 0.00 0.00 58.87 59.40 3h3v n SER 1383Cb 0.42 -1.54 -0.03 0.00 -0.26 0.00 0.00 64.21 62.81 3h3v n SER 1383CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3h3v n VAL 1384N 0.21 3.82 -3.88 -3.33 0.31 -0.30 -2.41 118.33 112.74 3h3v n VAL 1384Ca 0.04 -2.36 -0.09 0.00 -0.01 0.00 0.00 64.34 61.91 3h3v n VAL 1384Cb 0.38 -2.51 -0.07 0.00 -0.91 0.00 0.00 33.84 30.73 3h3v n VAL 1384CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3h3v s THR 1385N 2.57 0.10 0.64 2.52 2.01 -1.26 -4.86 115.64 117.35 3h3v s THR 1385Ca 0.62 -1.22 0.24 0.00 0.31 0.00 0.00 61.69 61.64 3h3v s THR 1385Cb 0.16 -1.58 0.27 0.00 0.01 0.00 0.00 72.50 71.37 3h3v s THR 1385CO -0.05 -0.43 1.71 -0.09 -0.69 0.00 0.00 174.62 175.06 3h3v h ARG 1386N 2.60 0.00 0.08 4.92 2.43 -1.92 1.04 114.38 123.53 3h3v h ARG 1386Ca -0.33 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.59 3h3v h ARG 1386Cb 1.22 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 3h3v h ARG 1386CO 0.51 0.00 -1.15 0.45 -1.51 0.00 0.00 179.97 178.27 3h3v h HIS 1387N 0.00 0.31 0.00 2.20 3.86 -1.92 -3.41 115.15 116.20 3h3v h HIS 1387Ca 0.09 -0.23 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 3h3v h HIS 1387Cb 1.19 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.65 3h3v h HIS 1387CO 0.00 1.18 0.00 0.41 0.86 0.00 0.00 177.93 180.38 3h3v n GLY 1388N 1.46 0.45 0.24 2.45 0.00 0.36 -4.82 105.19 105.34 3h3v n GLY 1388Ca -0.05 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.00 3h3v n GLY 1388CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3h3v n PHE 1389N 0.00 0.19 0.50 1.61 1.16 -1.01 -1.77 117.46 118.14 3h3v n PHE 1389Ca 0.00 0.81 0.00 0.00 -1.87 0.00 0.00 57.45 56.39 3h3v n PHE 1389Cb 0.00 -0.86 0.00 0.00 -1.61 0.00 0.00 39.48 37.01 3h3v n PHE 1389CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18 3h3v n ASN 1390N -5.06 1.38 0.00 5.98 5.15 -1.25 -1.68 115.26 119.79 3h3v n ASN 1390Ca 0.10 -1.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.08 3h3v n ASN 1390Cb 0.32 -0.25 0.00 0.00 -0.53 0.00 0.00 39.78 39.32 3h3v n ASN 1390CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 3h3v n ARG 1391N 0.70 0.49 -1.63 1.20 -4.01 -0.73 -4.95 116.66 107.73 3h3v n ARG 1391Ca 0.00 -0.03 -0.30 0.00 -1.04 0.00 0.00 57.85 56.48 3h3v n ARG 1391Cb 0.24 -0.30 0.09 0.00 -3.04 0.00 0.00 32.46 29.45 3h3v n ARG 1391CO 0.00 0.00 0.00 -1.54 -3.04 0.00 0.00 177.63 173.05 3h3v s SER 1392N -0.08 4.44 0.00 2.89 1.04 -0.68 -4.88 113.70 116.44 3h3v s SER 1392Ca 0.00 1.16 0.00 0.00 0.48 0.00 0.00 55.95 57.59 3h3v s SER 1392Cb 0.00 -1.85 0.00 0.00 0.10 0.00 0.00 66.02 64.27 3h3v s SER 1392CO 0.00 -1.99 0.01 -0.46 0.98 0.00 0.00 173.24 171.79 3h3v n ASN 1393N -3.43 0.00 -3.19 7.02 6.94 -1.26 -4.76 115.26 116.58 3h3v n ASN 1393Ca 0.07 0.00 -0.22 0.00 -0.02 0.00 0.00 54.58 54.41 3h3v n ASN 1393Cb 0.57 0.00 0.22 0.00 -2.36 0.00 0.00 39.78 38.21 3h3v n ASN 1393CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 3h3v n THR 1394N -0.19 0.00 -0.60 5.53 -1.04 -1.26 -4.97 114.28 111.75 3h3v n THR 1394Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.80 3h3v n THR 1394Cb 0.00 -0.72 0.18 0.00 -1.82 0.00 0.00 70.33 67.97 3h3v n THR 1394CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h3v n GLY 1395N -4.12 -3.15 0.04 3.41 0.00 -1.26 -4.97 105.19 95.13 3h3v n GLY 1395Ca 0.10 -1.40 -0.03 0.00 0.00 0.00 0.00 46.02 44.69 3h3v n GLY 1395CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3v n ALA 1396N -4.54 0.28 -0.45 4.61 0.00 -1.26 -3.94 120.51 115.21 3h3v n ALA 1396Ca -0.14 -0.35 0.39 0.00 0.00 0.00 0.00 53.44 53.33 3h3v n ALA 1396Cb 0.41 0.01 0.66 0.00 0.00 0.00 0.00 19.45 20.53 3h3v n ALA 1396CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h3v n LEU 1397N -3.39 0.23 0.04 0.00 4.77 -1.26 -0.00 117.00 117.39 3h3v n LEU 1397Ca -0.05 1.42 -0.02 0.00 -0.03 0.00 0.00 56.01 57.34 3h3v n LEU 1397Cb 0.17 -0.70 -0.01 0.00 -2.33 0.00 0.00 43.42 40.55 3h3v n LEU 1397CO 0.07 -1.55 0.32 -0.03 -1.33 0.00 0.00 177.39 174.87 3h3v h MET 1398N 0.00 -0.11 -0.80 3.23 4.05 -1.95 -2.91 114.93 116.44 3h3v h MET 1398Ca 0.87 0.01 0.23 0.00 -0.28 0.00 0.00 59.70 60.53 3h3v h MET 1398Cb 2.73 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 33.52 3h3v h MET 1398CO -0.51 -0.07 0.75 0.00 0.23 0.00 0.00 176.91 177.31 3h3v h ARG 1399N -0.16 0.00 -0.49 0.39 3.08 -1.41 0.56 114.38 116.35 3h3v h ARG 1399Ca -0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 3h3v h ARG 1399Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 3h3v h ARG 1399CO 0.02 0.00 0.23 0.00 -1.07 0.00 0.00 179.97 179.15 3h3v n SER 1401N -4.38 6.69 0.00 0.00 3.41 0.19 -3.60 113.62 115.93 3h3v n SER 1401Ca 0.04 -2.89 0.00 0.00 -0.26 0.00 0.00 58.87 55.76 3h3v n SER 1401Cb 0.13 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 62.72 3h3v n SER 1401CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3h3v n PHE 1402N 1.87 0.00 0.00 7.33 7.35 -1.17 -4.93 117.46 127.91 3h3v n PHE 1402Ca 0.53 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.22 3h3v n PHE 1402Cb 0.57 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.40 3h3v n PHE 1402CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 3h3v n GLU 1403N 0.00 0.00 0.04 -4.13 1.02 -1.26 -4.48 120.64 111.83 3h3v n GLU 1403Ca 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.27 3h3v n GLU 1403Cb 0.00 0.00 0.47 0.00 -0.02 0.00 0.00 31.44 31.89 3h3v n GLU 1403CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3h3v n GLU 1404N 0.00 0.11 0.00 3.49 1.02 -1.26 -4.76 120.64 119.24 3h3v n GLU 1404Ca 0.00 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 3h3v n GLU 1404Cb 0.00 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 3h3v n GLU 1404CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 3h3v n THR 1405N -1.79 0.00 -0.20 2.62 -1.04 -1.24 -0.95 114.28 111.68 3h3v n THR 1405Ca 0.06 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.04 3h3v n THR 1405Cb 0.38 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.92 3h3v n THR 1405CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3h3v h VAL 1406N 0.00 0.26 -0.29 12.58 2.07 -1.88 0.47 116.25 129.47 3h3v h VAL 1406Ca 0.00 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 3h3v h VAL 1406Cb 0.00 0.26 -0.07 0.00 -1.52 0.00 0.00 31.29 29.96 3h3v h VAL 1406CO 0.00 0.00 -0.20 -0.33 0.02 0.00 0.00 177.57 177.06 3h3v h GLU 1407N -0.10 -0.17 -0.60 1.57 5.08 -1.44 0.36 114.58 119.28 3h3v h GLU 1407Ca 0.27 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.73 3h3v h GLU 1407Cb 0.52 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.73 3h3v h GLU 1407CO -0.66 -0.11 0.22 0.82 -1.00 0.00 0.00 179.01 178.27 3h3v h ILE 1408N -0.18 0.77 0.19 3.13 2.04 -1.14 -2.31 117.51 120.01 3h3v h ILE 1408Ca 0.15 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 3h3v h ILE 1408Cb 0.41 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3h3v h ILE 1408CO -0.39 0.07 -0.09 -0.07 0.00 0.00 0.00 178.15 177.67 3h3v h LEU 1409N 0.40 -0.22 -0.76 1.44 3.38 -0.08 -2.86 115.31 116.61 3h3v h LEU 1409Ca 0.30 -0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.31 3h3v h LEU 1409Cb 0.38 0.06 -0.13 0.00 0.09 0.00 0.00 40.66 41.06 3h3v h LEU 1409CO -0.31 -0.05 -0.40 -0.26 0.09 0.00 0.00 178.44 177.51 3h3v h PHE 1410N -0.37 -1.15 -0.08 1.13 0.05 0.22 1.00 116.94 117.74 3h3v h PHE 1410Ca -0.03 0.09 0.00 0.00 3.82 0.00 0.00 57.97 61.85 3h3v h PHE 1410Cb 0.29 0.61 0.00 0.00 2.00 0.00 0.00 35.95 38.85 3h3v h PHE 1410CO -0.03 -0.40 0.00 -1.91 -0.18 0.00 0.00 178.31 175.79 3h3v n GLU 1411N -5.43 1.49 -0.09 1.51 2.13 -1.01 -2.66 120.64 116.58 3h3v n GLU 1411Ca 0.05 -0.41 -0.18 0.00 0.66 0.00 0.00 57.16 57.29 3h3v n GLU 1411Cb 0.36 -1.54 -0.10 0.00 0.27 0.00 0.00 31.44 30.43 3h3v n GLU 1411CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h3v h ALA 1412N 2.37 0.17 0.00 4.31 0.00 0.13 -3.16 119.26 123.09 3h3v h ALA 1412Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 53.97 3h3v h ALA 1412Cb 0.63 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3h3v h ALA 1412CO 0.06 0.51 0.00 0.78 0.00 0.00 0.00 179.25 180.60 3h3v h GLY 1413N -1.00 0.00 1.85 0.00 0.00 -1.50 0.17 103.07 102.58 3h3v h GLY 1413Ca -0.23 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.95 3h3v h GLY 1413CO -0.14 0.00 -0.66 0.00 0.00 0.00 0.00 176.54 175.74 3h3v h ALA 1414N 2.33 0.83 -0.26 3.60 0.00 -1.64 -3.01 119.26 121.12 3h3v h ALA 1414Ca 0.00 -0.59 -0.09 0.00 0.00 0.00 0.00 54.91 54.24 3h3v h ALA 1414Cb 0.77 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 3h3v h ALA 1414CO 0.00 0.78 -0.06 0.43 0.00 0.00 0.00 179.25 180.40 3h3v n SER 1415N -3.81 2.91 -3.25 0.00 7.64 -1.11 -4.72 113.62 111.29 3h3v n SER 1415Ca -0.02 -3.43 -0.16 0.00 1.01 0.00 0.00 58.87 56.27 3h3v n SER 1415Cb 0.65 -0.57 -0.03 0.00 -1.01 0.00 0.00 64.21 63.25 3h3v n SER 1415CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h3v n ALA 1416N -0.95 -1.07 -0.85 -0.43 0.00 -0.80 -4.87 120.51 111.55 3h3v n ALA 1416Ca 0.26 -0.08 -0.34 0.00 0.00 0.00 0.00 53.44 53.28 3h3v n ALA 1416Cb 0.92 -1.25 0.10 0.00 0.00 0.00 0.00 19.45 19.22 3h3v n ALA 1416CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3h3v n GLU 1417N -3.06 -0.44 -4.14 0.00 1.02 0.51 -4.51 120.64 110.03 3h3v n GLU 1417Ca 0.04 -0.11 -0.18 0.00 -0.02 0.00 0.00 57.16 56.90 3h3v n GLU 1417Cb 0.48 -1.51 -0.16 0.00 -0.02 0.00 0.00 31.44 30.23 3h3v n GLU 1417CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3h3v s LEU 1418N 2.22 1.58 -0.14 -4.62 2.96 -1.26 -1.03 118.68 118.40 3h3v s LEU 1418Ca 0.50 -0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 54.30 3h3v s LEU 1418Cb -0.15 -0.34 -0.02 0.00 0.50 0.00 0.00 46.19 46.18 3h3v s LEU 1418CO 0.71 -0.01 -0.11 -0.62 -1.32 0.00 0.00 176.35 175.00 3h3v s ASP 1419N 0.49 4.16 0.38 3.68 -1.08 0.10 -4.77 116.67 119.63 3h3v s ASP 1419Ca -0.06 -0.30 0.14 0.00 -0.52 0.00 0.00 52.55 51.81 3h3v s ASP 1419Cb -0.09 -1.65 0.78 0.00 -1.46 0.00 0.00 42.92 40.49 3h3v s ASP 1419CO -0.00 0.15 1.84 0.44 0.52 0.00 0.00 175.17 178.12 3h3v h ASP 1420N 6.81 0.00 -3.04 -0.34 3.32 -1.89 -1.77 116.42 119.52 3h3v h ASP 1420Ca -0.28 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.48 3h3v h ASP 1420Cb 1.20 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.78 3h3v h ASP 1420CO 0.57 0.35 -0.43 0.00 -1.72 0.00 0.00 179.24 178.02 3h3v n ARG 1422N -2.94 0.63 -2.58 0.00 1.74 -1.26 -4.76 116.66 107.49 3h3v n ARG 1422Ca -0.11 0.05 -0.37 0.00 -0.77 0.00 0.00 57.85 56.65 3h3v n ARG 1422Cb 0.60 -1.72 -0.04 0.00 -1.02 0.00 0.00 32.46 30.28 3h3v n ARG 1422CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3h3v s GLY 1423N -4.59 2.76 0.04 -0.13 0.00 -1.26 -4.81 107.32 99.34 3h3v s GLY 1423Ca -0.04 0.68 -0.12 0.00 0.00 0.00 0.00 44.72 45.24 3h3v s GLY 1423CO 0.83 1.12 1.20 -2.08 0.00 0.00 0.00 173.10 174.18 3h3v h VAL 1424N 2.32 0.00 -0.80 1.40 2.07 -1.93 -1.62 116.25 117.69 3h3v h VAL 1424Ca -0.48 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.23 3h3v h VAL 1424Cb 1.21 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.84 3h3v h VAL 1424CO 0.63 0.00 -0.01 0.28 0.02 0.00 0.00 177.57 178.49 3h3v h SER 1425N -0.21 -0.41 -0.55 0.57 0.02 -1.97 -2.85 113.55 108.15 3h3v h SER 1425Ca 0.01 0.21 0.05 0.00 -0.84 0.00 0.00 61.79 61.23 3h3v h SER 1425Cb 0.25 0.38 -0.07 0.00 0.14 0.00 0.00 62.40 63.11 3h3v h SER 1425CO -0.17 -0.21 -0.33 -0.62 -1.14 0.00 0.00 176.83 174.36 3h3v n GLU 1426N -5.39 -0.24 -0.17 3.45 -0.58 -0.62 -1.01 120.64 116.09 3h3v n GLU 1426Ca 0.15 1.19 -0.10 0.00 -0.42 0.00 0.00 57.16 57.98 3h3v n GLU 1426Cb 0.51 -1.76 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 3h3v n GLU 1426CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 3h3v h ASN 1427N 0.00 0.82 -0.87 1.62 2.35 -1.42 -2.26 115.58 115.82 3h3v h ASN 1427Ca 0.09 -0.29 0.20 0.00 -0.55 0.00 0.00 56.30 55.75 3h3v h ASN 1427Cb 0.23 -0.22 -0.12 0.00 0.05 0.00 0.00 38.32 38.26 3h3v h ASN 1427CO -0.52 0.91 0.38 0.58 -1.65 0.00 0.00 177.43 177.13 3h3v h VAL 1428N 0.70 0.51 -0.04 2.81 2.07 -1.05 2.49 116.25 123.75 3h3v h VAL 1428Ca 0.14 -0.14 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 3h3v h VAL 1428Cb 0.47 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 3h3v h VAL 1428CO 0.02 0.08 -0.58 0.40 0.02 0.00 0.00 177.57 177.51 3h3v h ILE 1429N 0.41 1.40 0.00 4.57 2.04 -0.78 -3.14 117.51 122.01 3h3v h ILE 1429Ca 0.53 -1.96 -0.00 0.00 1.00 0.00 0.00 64.86 64.43 3h3v h ILE 1429Cb 0.97 2.02 -0.00 0.00 -0.74 0.00 0.00 36.82 39.07 3h3v h ILE 1429CO -0.51 0.57 -0.74 -0.07 0.00 0.00 0.00 178.15 177.40 3h3v h LEU 1430N 0.09 0.00 0.00 1.44 3.38 0.12 -3.49 115.31 116.85 3h3v h LEU 1430Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h3v h LEU 1430Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3h3v h LEU 1430CO 0.08 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.23 3h3v n GLY 1431N 1.16 0.76 3.71 0.83 0.00 0.77 -5.04 105.19 107.37 3h3v n GLY 1431Ca 0.01 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 3h3v n GLY 1431CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h3v s GLN 1432N -2.26 2.52 -0.16 1.61 -0.21 -0.95 -5.02 119.66 115.19 3h3v s GLN 1432Ca 0.00 -1.25 -0.29 0.00 0.02 0.00 0.00 55.36 53.84 3h3v s GLN 1432Cb 0.00 -2.33 -0.03 0.00 1.00 0.00 0.00 33.01 31.65 3h3v s GLN 1432CO 0.00 0.39 1.57 1.41 -2.12 0.00 0.00 175.29 176.54 3h3v s MET 1433N -3.61 3.97 0.21 2.91 -2.45 -1.26 -4.36 119.30 114.71 3h3v s MET 1433Ca 0.31 1.81 -0.30 0.00 -1.25 0.00 0.00 55.69 56.27 3h3v s MET 1433Cb -0.07 -3.98 -0.08 0.00 1.25 0.00 0.00 34.83 31.94 3h3v s MET 1433CO 0.21 -1.08 1.12 0.00 1.05 0.00 0.00 175.02 176.33 3h3v s ALA 1434N 4.60 3.40 -1.04 4.11 0.00 -1.26 -4.87 121.76 126.70 3h3v s ALA 1434Ca 0.69 0.87 -0.26 0.00 0.00 0.00 0.00 51.96 53.26 3h3v s ALA 1434Cb -0.27 -3.36 -0.22 0.00 0.00 0.00 0.00 23.12 19.27 3h3v s ALA 1434CO 0.27 -0.23 2.05 -2.30 0.00 0.00 0.00 175.76 175.55 3h3v n PRO 1435N 2.05 0.37 -3.72 0.00 -0.02 -1.26 -4.28 135.00 128.15 3h3v n PRO 1435Ca 0.02 -1.80 -0.12 0.00 -2.02 0.00 0.00 63.50 59.58 3h3v n PRO 1435Cb 0.45 -3.81 -0.12 0.00 -0.02 0.00 0.00 33.50 30.00 3h3v n PRO 1435CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h3v s ILE 1436N 15.59 -0.02 0.00 4.25 1.01 -1.25 -4.71 121.20 136.07 3h3v s ILE 1436Ca 0.78 0.09 0.00 0.00 0.00 0.00 0.00 60.65 61.52 3h3v s ILE 1436Cb -0.03 -0.50 0.00 0.00 0.01 0.00 0.00 42.46 41.94 3h3v s ILE 1436CO 0.19 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.78 3h3v n GLY 1437N 3.93 1.67 0.04 6.18 0.00 -0.91 -0.14 105.19 115.95 3h3v n GLY 1437Ca -0.22 0.14 0.03 0.00 0.00 0.00 0.00 46.02 45.97 3h3v n GLY 1437CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3h3v n THR 1438N 0.00 -0.05 -1.22 2.61 -1.04 -1.26 0.14 114.28 113.45 3h3v n THR 1438Ca 0.00 0.24 -0.06 0.00 -2.04 0.00 0.00 64.05 62.18 3h3v n THR 1438Cb 0.00 -0.37 0.23 0.00 -1.82 0.00 0.00 70.33 68.38 3h3v n THR 1438CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h3v n GLY 1439N -1.04 4.36 1.60 3.41 0.00 0.80 -4.54 105.19 109.78 3h3v n GLY 1439Ca 0.03 -1.11 -0.02 0.00 0.00 0.00 0.00 46.02 44.93 3h3v n GLY 1439CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3v n ALA 1440N -0.78 3.86 -3.76 4.61 0.00 0.36 -3.74 120.51 121.06 3h3v n ALA 1440Ca 0.39 -1.56 -0.01 0.00 0.00 0.00 0.00 53.44 52.25 3h3v n ALA 1440Cb 1.23 -1.16 -0.00 0.00 0.00 0.00 0.00 19.45 19.52 3h3v n ALA 1440CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3h3v s PHE 1441N -2.26 -0.05 0.33 0.00 -0.12 -1.26 -4.97 117.98 109.65 3h3v s PHE 1441Ca 0.39 -0.20 0.09 0.00 -0.05 0.00 0.00 56.93 57.16 3h3v s PHE 1441Cb 0.31 0.62 -0.05 0.00 -0.63 0.00 0.00 43.02 43.26 3h3v s PHE 1441CO 0.10 -0.65 -0.01 -0.51 -0.05 0.00 0.00 175.22 174.10 3h3v s ASP 1442N -3.11 4.13 -0.04 1.98 1.01 -1.26 -5.10 116.67 114.29 3h3v s ASP 1442Ca 0.16 -0.98 0.06 0.00 0.71 0.00 0.00 52.55 52.49 3h3v s ASP 1442Cb 0.00 -0.53 -0.01 0.00 1.01 0.00 0.00 42.92 43.40 3h3v s ASP 1442CO 0.01 -0.20 -0.21 0.68 0.21 0.00 0.00 175.17 175.66 3h3v s VAL 1443N -2.51 1.73 -0.06 -1.27 -7.23 -1.26 -5.14 120.40 104.66 3h3v s VAL 1443Ca 0.34 -0.91 -0.04 0.00 -1.81 0.00 0.00 61.98 59.56 3h3v s VAL 1443Cb -0.01 -1.46 0.03 0.00 0.56 0.00 0.00 36.38 35.50 3h3v s VAL 1443CO 0.19 0.49 0.15 -0.04 -0.31 0.00 0.00 175.10 175.58 3h3v s MET 1444N -0.24 0.14 -0.30 4.82 -1.94 -1.26 -5.10 119.30 115.43 3h3v s MET 1444Ca 0.01 0.29 -0.29 0.00 -1.71 0.00 0.00 55.69 53.99 3h3v s MET 1444Cb -0.11 -0.03 -0.00 0.00 2.01 0.00 0.00 34.83 36.70 3h3v s MET 1444CO 0.01 -0.08 1.39 0.42 -0.01 0.00 0.00 175.02 176.75 3h3v s ILE 1445N 0.57 4.01 -0.76 2.53 1.09 -1.26 -4.94 121.20 122.44 3h3v s ILE 1445Ca -0.04 1.12 -0.20 0.00 -1.10 0.00 0.00 60.65 60.43 3h3v s ILE 1445Cb -0.06 -4.07 0.10 0.00 -1.06 0.00 0.00 42.46 37.38 3h3v s ILE 1445CO -0.03 -0.48 0.97 -0.62 -0.10 0.00 0.00 174.94 174.68 3h3v s ASP 1446N 3.30 6.37 0.11 3.58 3.68 -1.26 -4.92 116.67 127.54 3h3v s ASP 1446Ca 0.60 -1.54 -0.11 0.00 2.13 0.00 0.00 52.55 53.63 3h3v s ASP 1446Cb -0.18 -2.38 0.08 0.00 -1.45 0.00 0.00 42.92 38.99 3h3v s ASP 1446CO 0.26 -1.21 0.82 1.21 0.13 0.00 0.00 175.17 176.38 3h3v n GLU 1447N 6.89 -0.15 0.00 4.34 0.00 -1.26 -1.80 120.64 128.65 3h3v n GLU 1447Ca 0.06 0.81 0.00 0.00 0.00 0.00 0.00 57.16 58.04 3h3v n GLU 1447Cb 0.46 -1.20 0.00 0.00 0.00 0.00 0.00 31.44 30.70 3h3v n GLU 1447CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3h3v n GLU 1448N -4.75 0.00 -0.21 5.31 1.02 -1.26 -0.57 120.64 120.17 3h3v n GLU 1448Ca 0.04 0.56 0.31 0.00 -0.02 0.00 0.00 57.16 58.05 3h3v n GLU 1448Cb 0.19 -1.16 0.64 0.00 -0.02 0.00 0.00 31.44 31.09 3h3v n GLU 1448CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3h3v h SER 1449N 0.00 0.00 0.00 1.62 4.64 -1.79 0.50 113.55 118.52 3h3v h SER 1449Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h3v h SER 1449Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3h3v h SER 1449CO 0.00 0.00 0.00 -0.11 -0.87 0.00 0.00 176.83 175.85 3h3v n LEU 1450N -3.65 0.05 0.00 5.97 7.94 0.26 -2.42 117.00 125.14 3h3v n LEU 1450Ca 0.22 -0.02 0.00 0.00 -1.11 0.00 0.00 56.01 55.10 3h3v n LEU 1450Cb 1.28 -0.02 0.00 0.00 0.53 0.00 0.00 43.42 45.20 3h3v n LEU 1450CO 0.31 0.01 -0.28 0.52 -1.11 0.00 0.00 177.39 176.84 3h3v n VAL 1451N -0.46 0.00 0.30 1.96 0.31 0.17 -4.62 118.33 116.00 3h3v n VAL 1451Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.44 3h3v n VAL 1451Cb 0.01 -0.51 0.50 0.00 -0.91 0.00 0.00 33.84 32.93 3h3v n VAL 1451CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3h3v n LYS 1452N -1.45 0.16 -3.44 5.55 4.81 -1.09 -3.95 118.16 118.74 3h3v n LYS 1452Ca 0.00 0.49 -0.43 0.00 -0.87 0.00 0.00 58.31 57.50 3h3v n LYS 1452Cb 0.28 -1.87 -0.03 0.00 0.02 0.00 0.00 35.03 33.43 3h3v n LYS 1452CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 3h3v s TYR 1453N -3.37 3.87 0.00 5.64 4.12 -1.01 -4.93 117.35 121.67 3h3v s TYR 1453Ca 0.02 -2.46 0.00 0.00 0.02 0.00 0.00 57.07 54.64 3h3v s TYR 1453Cb 0.08 -3.64 0.00 0.00 -1.52 0.00 0.00 41.96 36.88 3h3v s TYR 1453CO 0.30 -0.92 0.00 0.00 0.02 0.00 0.00 175.55 174.96 3h3v n MET 1454N 3.28 0.00 0.00 -0.62 0.00 -1.25 -4.97 117.12 113.55 3h3v n MET 1454Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 57.70 58.02 3h3v n MET 1454Cb 0.42 0.00 0.77 0.00 0.00 0.00 0.00 33.22 34.40 3h3v n MET 1454CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62