#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0m n LEU 2 N 0.00 0.00 0.12 -0.89 7.94 -1.26 -4.23 117.00 118.68 3h0m n LEU 2 Ca 0.00 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.01 3h0m n LEU 2 Cb 0.00 0.00 0.48 0.00 0.53 0.00 0.00 43.42 44.43 3h0m n LEU 2 CO 0.00 0.00 0.84 -2.67 -1.11 0.00 0.00 177.39 174.45 3h0m n TRP 3 N 0.00 0.74 1.49 1.96 4.27 -1.26 -1.57 117.44 123.07 3h0m n TRP 3 Ca 0.00 0.29 0.15 0.00 -3.89 0.00 0.00 57.50 54.05 3h0m n TRP 3 Cb 0.00 -0.97 0.68 0.00 -1.36 0.00 0.00 31.31 29.66 3h0m n TRP 3 CO 0.00 0.00 0.00 1.17 -2.29 0.00 0.00 177.69 176.57 3h0m n LYS 4 N -2.17 0.72 -3.82 -2.67 4.81 -1.26 -4.90 118.16 108.87 3h0m n LYS 4 Ca 0.02 -0.19 -0.30 0.00 -0.87 0.00 0.00 58.31 56.97 3h0m n LYS 4 Cb 0.23 -1.50 -0.04 0.00 0.02 0.00 0.00 35.03 33.74 3h0m n LYS 4 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3h0m s LYS 5 N -2.41 3.50 0.88 1.64 1.02 -0.61 -4.84 119.74 118.92 3h0m s LYS 5 Ca 0.32 -0.35 -0.12 0.00 0.02 0.00 0.00 55.97 55.83 3h0m s LYS 5 Cb 0.20 -2.95 0.12 0.00 -0.52 0.00 0.00 37.83 34.69 3h0m s LYS 5 CO 0.45 0.53 1.16 -1.54 -0.92 0.00 0.00 175.35 175.03 3h0m s SER 6 N -2.66 3.80 0.51 2.83 1.04 -1.26 -4.80 113.70 113.15 3h0m s SER 6 Ca 0.37 0.86 0.29 0.00 0.48 0.00 0.00 55.95 57.95 3h0m s SER 6 Cb -0.12 -1.37 1.25 0.00 0.10 0.00 0.00 66.02 65.88 3h0m s SER 6 CO 0.27 -2.36 1.96 -0.07 0.98 0.00 0.00 173.24 174.02 3h0m h LEU 7 N -1.37 0.00 -0.05 2.42 3.38 -1.97 0.24 115.31 117.96 3h0m h LEU 7 Ca -0.48 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.42 3h0m h LEU 7 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 3h0m h LEU 7 CO 0.62 0.12 -0.23 0.28 0.09 0.00 0.00 178.44 179.32 3h0m h SER 8 N 0.00 0.29 -0.49 -0.43 0.02 -1.99 0.54 113.55 111.50 3h0m h SER 8 Ca -0.00 -0.64 -0.00 0.00 -0.84 0.00 0.00 61.79 60.30 3h0m h SER 8 Cb 0.55 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 3h0m h SER 8 CO 0.02 0.89 0.30 -0.33 -1.14 0.00 0.00 176.83 176.56 3h0m h GLU 9 N -0.29 0.66 -0.45 3.45 5.08 -1.86 -2.43 114.58 118.74 3h0m h GLU 9 Ca -0.01 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 3h0m h GLU 9 Cb 0.87 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 3h0m h GLU 9 CO 0.05 0.47 0.06 -0.07 -1.00 0.00 0.00 179.01 178.52 3h0m h LEU 10 N 0.65 0.72 -0.26 1.33 4.07 -0.55 -2.90 115.31 118.37 3h0m h LEU 10 Ca 0.18 -0.27 -0.01 0.00 0.08 0.00 0.00 57.88 57.85 3h0m h LEU 10 Cb -0.02 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.51 3h0m h LEU 10 CO -0.03 0.81 0.11 -0.09 -1.08 0.00 0.00 178.44 178.15 3h0m h ARG 11 N 0.61 0.38 -0.60 1.13 2.43 -0.80 -1.05 114.38 116.48 3h0m h ARG 11 Ca 0.13 -0.07 0.08 0.00 -0.81 0.00 0.00 59.98 59.31 3h0m h ARG 11 Cb 0.40 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.83 3h0m h ARG 11 CO 0.01 0.41 0.27 1.49 -1.51 0.00 0.00 179.97 180.64 3h0m h GLU 12 N 0.27 0.47 -0.28 0.20 4.81 -1.46 0.17 114.58 118.76 3h0m h GLU 12 Ca 0.09 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 3h0m h GLU 12 Cb 0.16 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 3h0m h GLU 12 CO -0.01 0.31 -0.10 -0.07 -0.73 0.00 0.00 179.01 178.41 3h0m h LEU 13 N 0.49 0.44 0.13 1.64 4.07 -1.29 -2.78 115.31 118.02 3h0m h LEU 13 Ca 0.29 -0.10 -0.30 0.00 0.08 0.00 0.00 57.88 57.84 3h0m h LEU 13 Cb 0.29 -0.12 0.03 0.00 1.08 0.00 0.00 40.66 41.94 3h0m h LEU 13 CO -0.25 0.58 -1.28 -0.07 -1.08 0.00 0.00 178.44 176.35 3h0m h LEU 14 N 0.43 0.85 -1.00 1.67 3.38 -0.28 -1.36 115.31 118.99 3h0m h LEU 14 Ca 0.08 -0.80 -0.08 0.00 0.09 0.00 0.00 57.88 57.17 3h0m h LEU 14 Cb 0.45 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3h0m h LEU 14 CO 0.02 1.61 -0.09 0.11 0.09 0.00 0.00 178.44 180.18 3h0m h LYS 15 N 0.25 0.62 -0.64 1.13 1.57 -0.70 -2.63 116.57 116.17 3h0m h LYS 15 Ca -0.20 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 3h0m h LYS 15 Cb 1.96 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 34.20 3h0m h LYS 15 CO 0.24 0.70 0.00 0.54 -0.57 0.00 0.00 179.45 180.37 3h0m n ARG 16 N -4.20 3.59 -0.58 3.15 1.74 -1.05 -4.95 116.66 114.36 3h0m n ARG 16 Ca 0.01 -2.54 0.00 0.00 -0.77 0.00 0.00 57.85 54.56 3h0m n ARG 16 Cb 0.32 -1.89 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 3h0m n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0m n GLY 17 N 0.94 0.36 0.43 -0.13 0.00 -0.99 -4.78 105.19 101.01 3h0m n GLY 17 Ca 0.23 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.50 3h0m n GLY 17 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h0m h GLU 18 N 0.85 0.00 -4.59 1.61 5.08 -1.55 -3.41 114.58 112.57 3h0m h GLU 18 Ca 0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 3h0m h GLU 18 Cb 0.00 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.09 3h0m h GLU 18 CO 0.00 0.00 -0.70 0.54 -1.00 0.00 0.00 179.01 177.85 3h0m s VAL 19 N -4.97 0.61 0.16 3.13 0.11 -0.83 -5.03 120.40 113.60 3h0m s VAL 19 Ca -0.05 -1.74 0.07 0.00 -2.93 0.00 0.00 61.98 57.34 3h0m s VAL 19 Cb 0.20 -1.43 -0.04 0.00 -1.53 0.00 0.00 36.38 33.58 3h0m s VAL 19 CO 0.74 -0.78 -0.03 -0.94 -3.33 0.00 0.00 175.10 170.77 3h0m s SER 20 N -2.71 4.66 0.37 3.54 1.04 -1.26 -4.43 113.70 114.91 3h0m s SER 20 Ca 0.07 -0.41 0.15 0.00 0.48 0.00 0.00 55.95 56.23 3h0m s SER 20 Cb 0.02 -0.96 1.01 0.00 0.10 0.00 0.00 66.02 66.20 3h0m s SER 20 CO -0.04 0.10 1.76 -0.65 0.98 0.00 0.00 173.24 175.39 3h0m h PRO 21 N 2.86 0.46 -0.73 4.02 0.11 -1.89 -0.93 132.00 135.90 3h0m h PRO 21 Ca -0.47 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 3h0m h PRO 21 Cb 1.20 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 3h0m h PRO 21 CO 0.57 0.30 0.22 -0.22 -0.21 0.00 0.00 178.00 178.67 3h0m h LYS 22 N 0.47 1.13 -0.16 1.05 3.64 -1.90 -1.92 116.57 118.88 3h0m h LYS 22 Ca 0.61 -0.24 -0.03 0.00 -1.27 0.00 0.00 60.65 59.72 3h0m h LYS 22 Cb 1.38 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 3h0m h LYS 22 CO -0.36 0.96 -0.00 0.93 -2.27 0.00 0.00 179.45 178.71 3h0m h GLU 23 N 1.08 0.29 -0.38 1.90 5.08 -1.59 0.54 114.58 121.50 3h0m h GLU 23 Ca 0.24 -0.09 0.08 0.00 -1.00 0.00 0.00 59.36 58.58 3h0m h GLU 23 Cb 0.31 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.44 3h0m h GLU 23 CO -0.01 0.51 -0.29 0.28 -1.00 0.00 0.00 179.01 178.51 3h0m h VAL 24 N 0.03 0.28 -0.45 3.13 2.07 -1.32 0.36 116.25 120.36 3h0m h VAL 24 Ca 0.05 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.57 3h0m h VAL 24 Cb 0.38 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 3h0m h VAL 24 CO 0.01 0.00 0.30 0.58 0.02 0.00 0.00 177.57 178.47 3h0m h VAL 25 N -0.23 1.11 -0.68 2.57 2.07 -1.19 -2.35 116.25 117.55 3h0m h VAL 25 Ca 0.17 -0.21 0.08 0.00 0.82 0.00 0.00 66.70 67.56 3h0m h VAL 25 Cb 0.51 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.67 3h0m h VAL 25 CO -0.51 0.11 0.35 -0.33 0.02 0.00 0.00 177.57 177.22 3h0m h GLU 26 N 0.60 0.61 0.23 1.57 5.08 -0.03 0.43 114.58 123.08 3h0m h GLU 26 Ca 0.17 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 3h0m h GLU 26 Cb -0.06 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.02 3h0m h GLU 26 CO -0.04 0.40 -0.34 1.03 -1.00 0.00 0.00 179.01 179.06 3h0m h SER 27 N 0.63 -0.96 -0.14 1.42 0.87 0.16 -0.94 113.55 114.60 3h0m h SER 27 Ca 0.32 0.10 -0.06 0.00 -1.23 0.00 0.00 61.79 60.92 3h0m h SER 27 Cb 0.28 0.35 -0.02 0.00 -0.44 0.00 0.00 62.40 62.57 3h0m h SER 27 CO -0.23 -0.46 -0.10 -0.26 -0.53 0.00 0.00 176.83 175.26 3h0m h PHE 28 N -0.64 0.50 -0.01 2.24 0.04 -1.26 -2.29 116.94 115.52 3h0m h PHE 28 Ca 0.00 -0.07 0.03 0.00 2.80 0.00 0.00 57.97 60.74 3h0m h PHE 28 Cb 0.62 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.60 3h0m h PHE 28 CO -0.25 0.56 -0.21 -0.92 -0.60 0.00 0.00 178.31 176.89 3h0m h TYR 29 N 0.44 -0.55 -0.44 -0.55 5.03 -0.62 0.15 116.97 120.42 3h0m h TYR 29 Ca 0.09 0.02 0.09 0.00 2.58 0.00 0.00 58.73 61.50 3h0m h TYR 29 Cb 0.45 0.25 -0.10 0.00 1.55 0.00 0.00 36.73 38.87 3h0m h TYR 29 CO 0.01 -0.29 -0.31 -0.44 -1.32 0.00 0.00 178.16 175.81 3h0m h ASP 30 N -0.33 -1.04 1.50 -2.11 5.19 -0.59 0.48 116.42 119.51 3h0m h ASP 30 Ca 0.06 0.19 -0.04 0.00 -0.62 0.00 0.00 57.03 56.63 3h0m h ASP 30 Cb 0.41 0.50 -0.01 0.00 0.18 0.00 0.00 39.33 40.42 3h0m h ASP 30 CO -0.20 -0.31 -0.18 -0.09 -3.12 0.00 0.00 179.24 175.35 3h0m h ARG 31 N -0.22 0.00 0.12 3.56 2.43 -1.35 0.54 114.38 119.47 3h0m h ARG 31 Ca 0.19 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.38 3h0m h ARG 31 Cb 0.53 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 3h0m h ARG 31 CO -0.56 0.18 -0.22 -0.92 -1.51 0.00 0.00 179.97 176.94 3h0m h TYR 32 N 0.00 -0.58 -0.93 2.20 3.20 0.23 -1.91 116.97 119.19 3h0m h TYR 32 Ca -0.00 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.91 3h0m h TYR 32 Cb 0.98 0.24 -0.05 0.00 1.54 0.00 0.00 36.73 39.44 3h0m h TYR 32 CO 0.00 -0.31 0.61 -0.91 -1.64 0.00 0.00 178.16 175.91 3h0m h ASN 33 N -0.41 1.02 -0.84 -2.11 2.35 0.24 0.21 115.58 116.05 3h0m h ASN 33 Ca 0.03 -0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.77 3h0m h ASN 33 Cb 0.43 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.52 3h0m h ASN 33 CO -0.12 0.71 0.55 1.56 -1.65 0.00 0.00 177.43 178.48 3h0m h GLN 34 N 1.19 1.11 0.00 0.81 4.20 -0.03 -3.39 115.11 118.99 3h0m h GLN 34 Ca 0.36 -0.07 -0.23 0.00 0.06 0.00 0.00 58.65 58.77 3h0m h GLN 34 Cb -0.03 -0.25 -0.04 0.00 0.30 0.00 0.00 27.48 27.46 3h0m h GLN 34 CO -0.10 0.73 -1.87 -2.37 -0.67 0.00 0.00 178.83 174.55 3h0m n THR 35 N -4.50 0.87 -0.11 -0.54 5.66 -0.72 -4.69 114.28 110.26 3h0m n THR 35 Ca 0.09 -0.42 0.14 0.00 -3.05 0.00 0.00 64.05 60.81 3h0m n THR 35 Cb 0.02 -0.89 0.52 0.00 -1.55 0.00 0.00 70.33 68.42 3h0m n THR 35 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 3h0m h GLU 36 N 0.00 0.36 0.00 1.09 4.57 -0.79 -1.05 114.58 118.76 3h0m h GLU 36 Ca -0.34 -0.02 -0.07 0.00 -1.18 0.00 0.00 59.36 57.74 3h0m h GLU 36 Cb 1.63 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 30.13 3h0m h GLU 36 CO -0.02 0.24 -0.35 1.49 -1.18 0.00 0.00 179.01 179.18 3h0m h GLU 37 N 0.37 0.00 0.00 1.92 4.81 -1.84 0.35 114.58 120.20 3h0m h GLU 37 Ca 0.31 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.48 3h0m h GLU 37 Cb 0.70 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 3h0m h GLU 37 CO -0.09 0.35 -0.36 0.87 -0.73 0.00 0.00 179.01 179.06 3h0m h LYS 38 N 0.00 0.00 0.00 1.92 1.57 -1.55 -3.42 116.57 115.09 3h0m h LYS 38 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3h0m h LYS 38 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 3h0m h LYS 38 CO 0.05 0.94 -0.09 0.28 -0.57 0.00 0.00 179.45 180.06 3h0m h VAL 39 N -1.00 1.63 -4.63 0.50 2.07 -1.29 -3.42 116.25 110.11 3h0m h VAL 39 Ca -0.10 -2.26 -0.22 0.00 0.82 0.00 0.00 66.70 64.95 3h0m h VAL 39 Cb 1.04 3.12 0.13 0.00 -1.52 0.00 0.00 31.29 34.05 3h0m h VAL 39 CO -0.06 0.55 -0.57 0.29 0.02 0.00 0.00 177.57 177.81 3h0m n LYS 40 N -4.61 -3.75 0.07 1.57 5.02 0.11 -0.89 118.16 115.68 3h0m n LYS 40 Ca -0.11 0.61 -0.04 0.00 -2.02 0.00 0.00 58.31 56.75 3h0m n LYS 40 Cb 0.47 -4.79 0.17 0.00 -0.02 0.00 0.00 35.03 30.85 3h0m n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h0m h ALA 41 N 0.43 0.98 -3.20 7.82 0.00 -1.87 -3.38 119.26 120.03 3h0m h ALA 41 Ca -0.42 -0.46 -0.66 0.00 0.00 0.00 0.00 54.91 53.37 3h0m h ALA 41 Cb 1.23 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.82 3h0m h ALA 41 CO 0.34 0.64 -0.60 0.71 0.00 0.00 0.00 179.25 180.34 3h0m s TYR 42 N -4.04 3.21 -0.21 0.00 1.51 -1.26 0.71 117.35 117.27 3h0m s TYR 42 Ca -0.05 0.18 -0.17 0.00 -1.01 0.00 0.00 57.07 56.02 3h0m s TYR 42 Cb 0.13 -1.73 -0.19 0.00 -0.11 0.00 0.00 41.96 40.06 3h0m s TYR 42 CO 0.79 0.52 0.12 -0.89 -1.11 0.00 0.00 175.55 174.98 3h0m n ILE 43 N 1.42 1.57 -3.80 2.71 5.41 0.16 -4.70 119.36 122.14 3h0m n ILE 43 Ca -0.15 -0.22 -0.30 0.00 1.00 0.00 0.00 62.75 63.09 3h0m n ILE 43 Cb 0.53 -1.94 -0.15 0.00 -0.71 0.00 0.00 39.64 37.37 3h0m n ILE 43 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 3h0m s THR 44 N -2.43 1.05 0.24 1.39 2.01 -0.95 -4.98 115.64 111.97 3h0m s THR 44 Ca -0.30 -1.28 -0.30 0.00 0.31 0.00 0.00 61.69 60.12 3h0m s THR 44 Cb 0.08 -1.66 -0.09 0.00 0.01 0.00 0.00 72.50 70.84 3h0m s THR 44 CO 0.60 -0.47 1.25 -2.16 -0.69 0.00 0.00 174.62 173.15 3h0m s PRO 45 N 1.56 4.45 -0.07 4.92 0.04 -1.26 0.56 135.00 145.19 3h0m s PRO 45 Ca 0.05 2.00 0.13 0.00 0.04 0.00 0.00 61.00 63.22 3h0m s PRO 45 Cb -0.18 -3.18 0.25 0.00 0.04 0.00 0.00 34.50 31.44 3h0m s PRO 45 CO -0.17 -0.12 1.12 1.28 0.04 0.00 0.00 177.00 179.15 3h0m n LEU 46 N 1.95 1.36 -0.27 -3.56 4.77 0.61 -4.79 117.00 117.07 3h0m n LEU 46 Ca 0.03 -2.32 -0.05 0.00 -0.03 0.00 0.00 56.01 53.63 3h0m n LEU 46 Cb 0.43 -0.21 0.06 0.00 -2.33 0.00 0.00 43.42 41.37 3h0m n LEU 46 CO 0.57 0.64 1.11 1.88 -1.33 0.00 0.00 177.39 180.26 3h0m h TYR 47 N 0.40 1.03 -0.36 -1.77 -1.99 -1.81 0.13 116.97 112.60 3h0m h TYR 47 Ca -0.05 -0.03 0.07 0.00 2.00 0.00 0.00 58.73 60.72 3h0m h TYR 47 Cb 1.33 -0.33 -0.09 0.00 2.00 0.00 0.00 36.73 39.64 3h0m h TYR 47 CO 0.21 0.73 -0.34 0.78 -0.00 0.00 0.00 178.16 179.54 3h0m h GLY 48 N 1.03 -0.33 1.71 3.88 0.00 -1.91 0.26 103.07 107.71 3h0m h GLY 48 Ca 0.26 0.44 -0.12 0.00 0.00 0.00 0.00 47.33 47.90 3h0m h GLY 48 CO -0.04 -0.21 -0.47 1.70 0.00 0.00 0.00 176.54 177.53 3h0m h LYS 49 N -0.29 0.31 -0.37 4.80 3.64 -1.80 -2.89 116.57 119.98 3h0m h LYS 49 Ca 0.15 -0.17 -0.13 0.00 -1.27 0.00 0.00 60.65 59.24 3h0m h LYS 49 Cb 0.55 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 3h0m h LYS 49 CO -0.52 0.72 -0.28 0.00 -2.27 0.00 0.00 179.45 177.10 3h0m h ALA 50 N 1.25 0.81 -0.47 5.00 0.00 -0.23 -1.40 119.26 124.23 3h0m h ALA 50 Ca 0.02 -0.40 0.09 0.00 0.00 0.00 0.00 54.91 54.62 3h0m h ALA 50 Cb 0.92 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.50 3h0m h ALA 50 CO 0.08 0.64 0.02 -0.07 0.00 0.00 0.00 179.25 179.92 3h0m h LEU 51 N 0.66 -0.16 -0.42 0.00 4.07 -0.29 0.26 115.31 119.45 3h0m h LEU 51 Ca 0.08 0.11 -0.03 0.00 0.08 0.00 0.00 57.88 58.12 3h0m h LEU 51 Cb 0.81 0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.71 3h0m h LEU 51 CO 0.07 -0.05 0.16 0.11 -1.08 0.00 0.00 178.44 177.65 3h0m h LYS 52 N 0.14 0.64 0.00 1.13 1.57 -1.36 -2.94 116.57 115.75 3h0m h LYS 52 Ca 0.24 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3h0m h LYS 52 Cb 0.35 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 3h0m h LYS 52 CO -0.38 0.60 -0.21 1.96 -0.57 0.00 0.00 179.45 180.86 3h0m h GLN 53 N 0.54 0.00 -0.53 3.15 4.20 -0.89 -2.78 115.11 118.80 3h0m h GLN 53 Ca 0.14 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.78 3h0m h GLN 53 Cb 0.22 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 3h0m h GLN 53 CO -0.01 0.21 0.07 0.00 -0.67 0.00 0.00 178.83 178.42 3h0m h ALA 54 N 1.79 1.12 -0.94 3.87 0.00 -0.77 -3.01 119.26 121.33 3h0m h ALA 54 Ca -0.00 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 54.79 3h0m h ALA 54 Cb 0.46 -0.21 -0.09 0.00 0.00 0.00 0.00 17.79 17.95 3h0m h ALA 54 CO 0.03 0.57 0.56 0.93 0.00 0.00 0.00 179.25 181.34 3h0m h GLU 55 N 0.80 0.84 -0.02 0.00 5.08 -1.48 -1.78 114.58 118.01 3h0m h GLU 55 Ca 0.17 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3h0m h GLU 55 Cb 0.39 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3h0m h GLU 55 CO 0.01 0.55 0.00 -1.13 -1.00 0.00 0.00 179.01 177.44 3h0m n SER 56 N -4.71 1.54 -4.66 1.42 3.41 -1.14 -4.84 113.62 104.63 3h0m n SER 56 Ca 0.18 -1.52 -0.42 0.00 -0.26 0.00 0.00 58.87 56.85 3h0m n SER 56 Cb 0.38 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.29 3h0m n SER 56 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3h0m s LEU 57 N -1.98 4.14 0.05 1.04 0.20 -0.67 -4.89 118.68 116.56 3h0m s LEU 57 Ca 0.38 1.26 0.00 0.00 0.69 0.00 0.00 54.13 56.46 3h0m s LEU 57 Cb 0.21 -3.38 0.00 0.00 -0.43 0.00 0.00 46.19 42.59 3h0m s LEU 57 CO 0.33 -0.53 0.00 0.29 -0.29 0.00 0.00 176.35 176.15 3h0m n LYS 58 N 5.76 0.00 -1.98 1.98 4.76 -1.26 -4.95 118.16 122.47 3h0m n LYS 58 Ca 0.08 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.11 3h0m n LYS 58 Cb 0.47 -0.40 -0.03 0.00 -1.84 0.00 0.00 35.03 33.24 3h0m n LYS 58 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3h0m s GLU 59 N -2.00 2.94 0.37 1.97 -6.30 -1.26 -4.86 118.70 109.55 3h0m s GLU 59 Ca 0.00 1.09 0.19 0.00 -2.50 0.00 0.00 54.97 53.75 3h0m s GLU 59 Cb 0.00 -4.31 0.67 0.00 0.00 0.00 0.00 34.13 30.49 3h0m s GLU 59 CO 0.00 -2.34 1.73 0.00 0.02 0.00 0.00 175.26 174.67 3h0m h ARG 60 N 14.32 0.00 0.00 4.30 3.08 -1.95 -3.21 114.38 130.93 3h0m h ARG 60 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.75 3h0m h ARG 60 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.22 3h0m h ARG 60 CO 1.12 0.38 0.00 -1.91 -1.07 0.00 0.00 179.97 178.48 3h0m n GLU 61 N -3.53 0.82 -1.79 0.04 2.13 -1.26 -4.64 120.64 112.41 3h0m n GLU 61 Ca -0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 3h0m n GLU 61 Cb 0.51 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.69 3h0m n GLU 61 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3h0m s LEU 62 N -2.16 4.37 0.47 4.31 1.02 -1.22 -4.88 118.68 120.60 3h0m s LEU 62 Ca 0.42 2.82 0.28 0.00 0.02 0.00 0.00 54.13 57.66 3h0m s LEU 62 Cb 0.21 -3.60 1.34 0.00 0.02 0.00 0.00 46.19 44.16 3h0m s LEU 62 CO 0.39 -0.92 1.78 -0.65 0.02 0.00 0.00 176.35 176.96 3h0m h PRO 63 N 6.49 0.18 -0.13 1.29 0.11 -1.87 0.11 132.00 138.19 3h0m h PRO 63 Ca -0.44 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.57 3h0m h PRO 63 Cb 1.20 -0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.20 3h0m h PRO 63 CO 0.92 0.12 -0.56 1.28 -0.21 0.00 0.00 178.00 179.55 3h0m n LEU 64 N -4.42 3.05 -0.14 2.35 4.77 0.78 -4.99 117.00 118.41 3h0m n LEU 64 Ca 0.26 -4.02 -0.04 0.00 -0.03 0.00 0.00 56.01 52.19 3h0m n LEU 64 Cb 1.09 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.66 3h0m n LEU 64 CO 0.32 1.51 0.18 0.33 -1.33 0.00 0.00 177.39 178.41 3h0m n PHE 65 N -1.03 -0.14 -1.09 -1.77 7.35 0.39 -1.14 117.46 120.02 3h0m n PHE 65 Ca 0.23 0.41 0.09 0.00 -0.76 0.00 0.00 57.45 57.42 3h0m n PHE 65 Cb 0.74 -0.49 0.18 0.00 0.35 0.00 0.00 39.48 40.27 3h0m n PHE 65 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3h0m n GLY 66 N -1.08 4.68 3.64 7.13 0.00 -1.26 -4.40 105.19 113.91 3h0m n GLY 66 Ca 0.01 -1.13 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 3h0m n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h0m s ILE 67 N -2.90 4.82 0.48 -0.61 -1.09 -0.29 -4.76 121.20 116.84 3h0m s ILE 67 Ca 0.35 1.61 -0.23 0.00 -2.23 0.00 0.00 60.65 60.15 3h0m s ILE 67 Cb 0.31 -4.13 -0.07 0.00 -1.58 0.00 0.00 42.46 36.99 3h0m s ILE 67 CO 0.04 -0.08 1.26 -2.84 -1.23 0.00 0.00 174.94 172.09 3h0m s PRO 68 N 2.86 3.59 -0.09 2.79 0.02 -1.26 -0.30 135.00 142.61 3h0m s PRO 68 Ca 0.36 2.01 -0.04 0.00 0.02 0.00 0.00 61.00 63.34 3h0m s PRO 68 Cb -0.15 -2.43 0.05 0.00 0.02 0.00 0.00 34.50 31.99 3h0m s PRO 68 CO 0.07 -0.76 0.21 -1.50 -0.33 0.00 0.00 177.00 174.70 3h0m s ILE 69 N -1.41 -0.07 0.43 2.83 2.07 -0.47 -4.44 121.20 120.15 3h0m s ILE 69 Ca 0.65 0.17 -0.13 0.00 -1.41 0.00 0.00 60.65 59.93 3h0m s ILE 69 Cb -0.34 -0.34 -0.07 0.00 0.13 0.00 0.00 42.46 41.83 3h0m s ILE 69 CO 0.42 0.07 0.84 0.00 -1.91 0.00 0.00 174.94 174.36 3h0m s ALA 70 N 1.34 3.24 -0.02 1.50 0.00 -1.16 -1.65 121.76 125.02 3h0m s ALA 70 Ca -0.08 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 51.87 3h0m s ALA 70 Cb -0.11 -2.87 0.01 0.00 0.00 0.00 0.00 23.12 20.15 3h0m s ALA 70 CO -0.08 -0.04 -0.03 0.08 0.00 0.00 0.00 175.76 175.69 3h0m s VAL 71 N -2.40 0.33 0.44 0.00 1.01 -0.79 -1.63 120.40 117.35 3h0m s VAL 71 Ca 0.55 -0.11 -0.25 0.00 0.00 0.00 0.00 61.98 62.17 3h0m s VAL 71 Cb -0.10 -0.32 -0.08 0.00 0.00 0.00 0.00 36.38 35.88 3h0m s VAL 71 CO 0.29 0.13 1.31 -0.75 0.00 0.00 0.00 175.10 176.08 3h0m s LYS 72 N 0.32 3.80 -0.02 2.72 2.20 -0.96 0.41 119.74 128.22 3h0m s LYS 72 Ca -0.03 2.17 0.00 0.00 -0.36 0.00 0.00 55.97 57.75 3h0m s LYS 72 Cb -0.07 -2.64 0.03 0.00 -1.51 0.00 0.00 37.83 33.64 3h0m s LYS 72 CO -0.00 -0.64 0.96 -3.47 -0.36 0.00 0.00 175.35 171.84 3h0m n ASP 73 N -0.13 2.73 -0.21 1.43 2.03 -0.96 -1.57 116.55 119.87 3h0m n ASP 73 Ca 0.05 -2.06 0.02 0.00 0.52 0.00 0.00 54.79 53.32 3h0m n ASP 73 Cb 0.44 -0.51 0.04 0.00 -0.72 0.00 0.00 41.12 40.37 3h0m n ASP 73 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 3h0m n ASN 74 N 0.36 2.00 -4.51 1.67 6.94 -1.26 -0.39 115.26 120.07 3h0m n ASN 74 Ca 0.02 -1.72 -0.35 0.00 -0.02 0.00 0.00 54.58 52.51 3h0m n ASN 74 Cb 0.51 -0.06 -0.12 0.00 -2.36 0.00 0.00 39.78 37.75 3h0m n ASN 74 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3h0m s ILE 75 N -0.78 4.30 -0.06 1.53 1.01 -0.61 -0.96 121.20 125.64 3h0m s ILE 75 Ca 0.07 -0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.23 3h0m s ILE 75 Cb 0.04 -2.96 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 3h0m s ILE 75 CO 0.05 0.42 1.30 -0.76 0.00 0.00 0.00 174.94 175.95 3h0m s LEU 76 N 0.94 4.28 -0.20 2.97 1.02 -0.53 -4.90 118.68 122.27 3h0m s LEU 76 Ca 0.03 1.91 -0.00 0.00 0.02 0.00 0.00 54.13 56.09 3h0m s LEU 76 Cb -0.14 -3.55 0.02 0.00 0.02 0.00 0.00 46.19 42.53 3h0m s LEU 76 CO 0.02 -0.68 -0.15 -0.69 0.02 0.00 0.00 176.35 174.87 3h0m s VAL 77 N 2.59 2.38 0.28 -1.59 1.01 -1.26 -1.07 120.40 122.73 3h0m s VAL 77 Ca 0.59 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 61.37 3h0m s VAL 77 Cb -0.27 -2.06 -0.10 0.00 0.00 0.00 0.00 36.38 33.95 3h0m s VAL 77 CO 0.23 0.46 1.40 -0.70 0.00 0.00 0.00 175.10 176.48 3h0m s GLU 78 N 1.32 4.29 0.00 2.72 2.12 -1.23 -2.33 118.70 125.58 3h0m s GLU 78 Ca 0.04 2.29 0.00 0.00 0.36 0.00 0.00 54.97 57.66 3h0m s GLU 78 Cb -0.14 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 31.16 3h0m s GLU 78 CO -0.10 -0.36 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 3h0m n GLY 79 N 1.69 3.26 3.64 -1.50 0.00 -0.32 -4.97 105.19 107.00 3h0m n GLY 79 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 3h0m n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h0m s GLU 80 N -0.53 2.31 0.33 1.61 0.41 -0.99 -4.80 118.70 117.04 3h0m s GLU 80 Ca 0.00 -1.19 -0.29 0.00 -0.41 0.00 0.00 54.97 53.08 3h0m s GLU 80 Cb 0.00 -2.28 -0.12 0.00 -1.78 0.00 0.00 34.13 29.95 3h0m s GLU 80 CO 0.00 0.44 1.49 1.63 -0.49 0.00 0.00 175.26 178.33 3h0m n LYS 81 N -0.21 2.54 -3.92 1.61 5.02 -1.26 -1.91 118.16 120.03 3h0m n LYS 81 Ca -0.09 0.90 -0.30 0.00 -2.02 0.00 0.00 58.31 56.79 3h0m n LYS 81 Cb 0.56 -2.62 -0.15 0.00 -0.02 0.00 0.00 35.03 32.80 3h0m n LYS 81 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3h0m s THR 82 N -0.57 1.65 -0.13 -0.18 2.01 -0.69 -4.86 115.64 112.87 3h0m s THR 82 Ca 0.59 -1.71 0.22 0.00 0.31 0.00 0.00 61.69 61.10 3h0m s THR 82 Cb -0.51 -2.11 -0.25 0.00 0.01 0.00 0.00 72.50 69.63 3h0m s THR 82 CO 0.56 -0.45 0.64 0.35 -0.69 0.00 0.00 174.62 175.03 3h0m n THR 83 N 4.55 0.14 -2.22 -0.82 -2.24 -1.23 -4.63 114.28 107.84 3h0m n THR 83 Ca -0.03 -0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.18 3h0m n THR 83 Cb 0.43 -0.03 -0.01 0.00 -2.10 0.00 0.00 70.33 68.61 3h0m n THR 83 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h0m n ALA 85 N -1.85 -1.15 -2.46 0.00 0.00 -1.26 -1.16 120.51 112.63 3h0m n ALA 85 Ca -0.10 0.10 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 3h0m n ALA 85 Cb 0.52 -3.38 -0.12 0.00 0.00 0.00 0.00 19.45 16.47 3h0m n ALA 85 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h0m s SER 86 N -2.97 3.84 0.20 0.00 0.15 0.18 -1.61 113.70 113.49 3h0m s SER 86 Ca 0.54 -0.42 -0.10 0.00 0.70 0.00 0.00 55.95 56.67 3h0m s SER 86 Cb -0.28 -0.63 0.22 0.00 -1.71 0.00 0.00 66.02 63.62 3h0m s SER 86 CO 0.66 0.25 1.80 0.11 1.20 0.00 0.00 173.24 177.26 3h0m h LYS 87 N 4.50 0.61 0.00 5.44 1.79 -1.84 -1.86 116.57 125.21 3h0m h LYS 87 Ca -0.48 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 57.96 3h0m h LYS 87 Cb 1.16 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 3h0m h LYS 87 CO 0.48 0.40 0.00 1.51 -1.08 0.00 0.00 179.45 180.76 3h0m n ILE 88 N -4.82 0.08 -2.01 1.86 3.06 -0.63 -2.20 119.36 114.69 3h0m n ILE 88 Ca 0.08 0.02 -0.01 0.00 -2.50 0.00 0.00 62.75 60.34 3h0m n ILE 88 Cb 0.17 -1.00 -0.01 0.00 0.54 0.00 0.00 39.64 39.35 3h0m n ILE 88 CO 0.00 0.00 0.00 -0.11 -2.50 0.00 0.00 176.55 173.94 3h0m n LEU 89 N -1.02 -0.08 -4.77 9.51 7.94 -1.09 -1.99 117.00 125.50 3h0m n LEU 89 Ca 0.01 -1.11 -0.39 0.00 -1.11 0.00 0.00 56.01 53.41 3h0m n LEU 89 Cb 0.01 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 3h0m n LEU 89 CO 0.01 0.95 0.59 -1.83 -1.11 0.00 0.00 177.39 176.00 3h0m s GLU 90 N 0.00 4.70 0.00 1.96 -1.05 -0.72 -3.55 118.70 120.05 3h0m s GLU 90 Ca 0.01 1.34 0.00 0.00 -0.15 0.00 0.00 54.97 56.16 3h0m s GLU 90 Cb 0.01 -3.17 0.00 0.00 -0.44 0.00 0.00 34.13 30.53 3h0m s GLU 90 CO -0.00 0.49 0.00 0.09 0.95 0.00 0.00 175.26 176.78 3h0m n ASN 91 N 1.32 0.00 -4.61 0.83 3.02 -1.26 -4.68 115.26 109.88 3h0m n ASN 91 Ca -0.02 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.10 3h0m n ASN 91 Cb 0.48 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.63 3h0m n ASN 91 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3h0m s PHE 92 N -3.48 2.41 -0.17 3.10 5.36 -1.23 -4.92 117.98 119.05 3h0m s PHE 92 Ca 0.00 0.71 -0.19 0.00 -0.96 0.00 0.00 56.93 56.50 3h0m s PHE 92 Cb 0.00 -4.14 -0.03 0.00 -0.34 0.00 0.00 43.02 38.50 3h0m s PHE 92 CO 0.00 -2.07 0.52 0.08 -1.46 0.00 0.00 175.22 172.29 3h0m s VAL 93 N 5.19 5.12 0.03 3.12 1.01 -1.26 -1.70 120.40 131.91 3h0m s VAL 93 Ca 0.62 0.99 -0.30 0.00 0.00 0.00 0.00 61.98 63.29 3h0m s VAL 93 Cb -0.16 -3.85 -0.07 0.00 0.00 0.00 0.00 36.38 32.29 3h0m s VAL 93 CO 0.29 0.21 1.64 0.00 0.00 0.00 0.00 175.10 177.25 3h0m s ALA 94 N 1.38 3.65 -1.74 5.51 0.00 -0.81 -4.88 121.76 124.87 3h0m s ALA 94 Ca 0.25 1.12 0.30 0.00 0.00 0.00 0.00 51.96 53.63 3h0m s ALA 94 Cb -0.15 -3.70 1.42 0.00 0.00 0.00 0.00 23.12 20.68 3h0m s ALA 94 CO 0.10 -1.17 1.97 -2.30 0.00 0.00 0.00 175.76 174.36 3h0m n PRO 95 N 6.02 0.77 -3.67 0.00 -0.02 -1.26 -1.17 135.00 135.67 3h0m n PRO 95 Ca 0.16 -0.19 -0.10 0.00 -2.02 0.00 0.00 63.50 61.35 3h0m n PRO 95 Cb 0.41 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.36 3h0m n PRO 95 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3h0m s TYR 96 N -2.36 -0.20 0.02 6.00 1.13 -1.26 -4.94 117.35 115.75 3h0m s TYR 96 Ca 0.33 -0.12 -0.24 0.00 -1.41 0.00 0.00 57.07 55.63 3h0m s TYR 96 Cb 0.21 0.40 -0.05 0.00 -1.10 0.00 0.00 41.96 41.41 3h0m s TYR 96 CO 0.44 -0.88 0.73 -0.51 -2.51 0.00 0.00 175.55 172.83 3h0m s ASP 97 N -2.84 7.15 0.60 -0.18 1.01 -1.26 -3.51 116.67 117.63 3h0m s ASP 97 Ca 0.07 1.37 -0.19 0.00 0.71 0.00 0.00 52.55 54.51 3h0m s ASP 97 Cb -0.01 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 3h0m s ASP 97 CO -0.06 0.01 1.13 0.00 0.21 0.00 0.00 175.17 176.46 3h0m n ALA 98 N 2.91 0.69 -0.17 5.23 0.00 -0.24 -4.82 120.51 124.12 3h0m n ALA 98 Ca -0.03 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.49 3h0m n ALA 98 Cb 0.50 -2.21 0.32 0.00 0.00 0.00 0.00 19.45 18.07 3h0m n ALA 98 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3h0m h THR 99 N 0.72 1.10 -0.71 0.00 2.02 -1.33 -1.86 112.91 112.85 3h0m h THR 99 Ca -0.49 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 66.35 3h0m h THR 99 Cb 1.35 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 3h0m h THR 99 CO 0.53 0.15 0.22 -0.37 0.37 0.00 0.00 175.52 176.42 3h0m h VAL 100 N 0.82 1.26 -0.37 3.16 -1.51 -1.87 -1.48 116.25 116.27 3h0m h VAL 100 Ca 0.27 -0.90 -0.11 0.00 -1.23 0.00 0.00 66.70 64.74 3h0m h VAL 100 Cb 0.07 0.50 -0.01 0.00 -2.13 0.00 0.00 31.29 29.71 3h0m h VAL 100 CO -0.08 0.35 -0.21 0.40 -1.23 0.00 0.00 177.57 176.80 3h0m h ILE 101 N 1.05 1.27 -0.70 7.19 1.08 -1.73 0.15 117.51 125.82 3h0m h ILE 101 Ca 0.23 -1.29 0.00 0.00 -0.39 0.00 0.00 64.86 63.41 3h0m h ILE 101 Cb 0.31 1.21 -0.03 0.00 -3.07 0.00 0.00 36.82 35.24 3h0m h ILE 101 CO -0.01 0.43 0.45 -0.08 -0.69 0.00 0.00 178.15 178.25 3h0m h GLU 102 N 0.62 0.93 -0.03 2.37 4.81 -1.08 -0.75 114.58 121.45 3h0m h GLU 102 Ca 0.09 -0.07 -0.17 0.00 -0.13 0.00 0.00 59.36 59.08 3h0m h GLU 102 Cb 0.70 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3h0m h GLU 102 CO 0.05 0.63 -0.76 0.00 -0.73 0.00 0.00 179.01 178.20 3h0m h ARG 103 N 0.95 0.21 -0.12 1.92 3.08 -0.65 -1.69 114.38 118.07 3h0m h ARG 103 Ca 0.25 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 3h0m h ARG 103 Cb -0.08 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 3h0m h ARG 103 CO -0.05 0.87 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.59 3h0m h LEU 104 N 0.13 0.26 -0.92 3.04 3.38 -0.60 -2.65 115.31 117.95 3h0m h LEU 104 Ca -0.03 -0.41 0.05 0.00 0.09 0.00 0.00 57.88 57.58 3h0m h LEU 104 Cb 1.33 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.95 3h0m h LEU 104 CO 0.12 0.61 0.59 0.11 0.09 0.00 0.00 178.44 179.96 3h0m h LYS 105 N -0.09 1.06 0.00 1.13 1.57 -1.09 0.74 116.57 119.89 3h0m h LYS 105 Ca 0.03 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3h0m h LYS 105 Cb 0.52 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3h0m h LYS 105 CO 0.02 0.70 0.00 -0.22 -0.57 0.00 0.00 179.45 179.38 3h0m h LYS 106 N 1.09 0.00 -0.06 3.15 3.64 -1.32 -2.51 116.57 120.56 3h0m h LYS 106 Ca 0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 3h0m h LYS 106 Cb 0.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3h0m h LYS 106 CO -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.03 3h0m n ALA 107 N -2.01 2.53 -0.18 5.00 0.00 0.18 -4.94 120.51 121.10 3h0m n ALA 107 Ca 0.01 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.90 3h0m n ALA 107 Cb 0.28 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3h0m n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0m n GLY 108 N 1.23 0.86 3.63 0.00 0.00 -0.94 -0.16 105.19 109.82 3h0m n GLY 108 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3h0m n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0m s ALA 109 N -2.53 1.01 -0.19 4.61 0.00 -0.76 -4.24 121.76 119.66 3h0m s ALA 109 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.31 3h0m s ALA 109 Cb 0.00 -3.37 0.05 0.00 0.00 0.00 0.00 23.12 19.79 3h0m s ALA 109 CO 0.00 -2.97 -0.07 -0.51 0.00 0.00 0.00 175.76 172.22 3h0m s LEU 110 N -6.71 1.99 -0.24 0.00 1.43 0.59 -4.62 118.68 111.12 3h0m s LEU 110 Ca 0.67 -0.83 -0.29 0.00 -1.03 0.00 0.00 54.13 52.65 3h0m s LEU 110 Cb -0.23 -1.06 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 3h0m s LEU 110 CO 0.60 -0.18 1.54 -0.63 0.23 0.00 0.00 176.35 177.91 3h0m s ILE 111 N 1.52 3.80 -2.58 -0.59 1.09 -1.26 -1.36 121.20 121.81 3h0m s ILE 111 Ca -0.01 0.90 0.23 0.00 -1.10 0.00 0.00 60.65 60.67 3h0m s ILE 111 Cb -0.16 -3.82 0.10 0.00 -1.06 0.00 0.00 42.46 37.52 3h0m s ILE 111 CO -0.08 -0.34 1.18 1.33 -0.10 0.00 0.00 174.94 176.93 3h0m n VAL 112 N 6.39 0.00 0.00 2.92 0.24 -0.66 -4.57 118.33 122.65 3h0m n VAL 112 Ca 0.18 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 3h0m n VAL 112 Cb 0.46 1.40 0.00 0.00 -1.47 0.00 0.00 33.84 34.22 3h0m n VAL 112 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h0m n GLY 113 N 1.38 1.68 3.32 7.63 0.00 -1.26 -0.29 105.19 117.65 3h0m n GLY 113 Ca 0.12 -1.04 -0.35 0.00 0.00 0.00 0.00 46.02 44.75 3h0m n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h0m s LYS 114 N -2.00 3.40 0.12 1.61 -0.14 0.19 -1.89 119.74 121.03 3h0m s LYS 114 Ca 0.00 -0.62 -0.09 0.00 -1.36 0.00 0.00 55.97 53.90 3h0m s LYS 114 Cb 0.00 -3.03 -0.06 0.00 -1.68 0.00 0.00 37.83 33.06 3h0m s LYS 114 CO 0.00 -0.19 0.43 0.99 -0.76 0.00 0.00 175.35 175.82 3h0m s THR 115 N 1.48 5.06 0.63 2.17 2.01 0.17 0.39 115.64 127.55 3h0m s THR 115 Ca 0.06 0.40 -0.17 0.00 0.31 0.00 0.00 61.69 62.29 3h0m s THR 115 Cb -0.14 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.71 3h0m s THR 115 CO -0.03 0.17 1.20 0.21 -0.69 0.00 0.00 174.62 175.48 3h0m s ASN 116 N -2.00 4.94 0.23 3.53 2.47 0.22 -2.26 114.94 122.07 3h0m s ASN 116 Ca 0.37 2.34 -0.19 0.00 0.42 0.00 0.00 52.86 55.81 3h0m s ASN 116 Cb -0.13 -2.59 0.02 0.00 -1.45 0.00 0.00 41.25 37.10 3h0m s ASN 116 CO 0.20 -1.76 0.59 -1.48 -3.72 0.00 0.00 177.10 170.94 3h0m s LEU 117 N -4.42 -0.07 0.50 3.21 2.34 -1.26 -2.19 118.68 116.79 3h0m s LEU 117 Ca 0.75 -0.55 -0.22 0.00 0.06 0.00 0.00 54.13 54.17 3h0m s LEU 117 Cb -0.29 2.34 -0.06 0.00 -0.56 0.00 0.00 46.19 47.62 3h0m s LEU 117 CO 0.37 -1.17 1.29 -1.81 -1.06 0.00 0.00 176.35 173.97 3h0m s ASP 118 N -2.90 5.67 -0.00 1.48 1.01 -1.15 -3.08 116.67 117.70 3h0m s ASP 118 Ca 0.11 2.59 -0.34 0.00 0.71 0.00 0.00 52.55 55.62 3h0m s ASP 118 Cb -0.03 -2.62 -0.13 0.00 1.01 0.00 0.00 42.92 41.15 3h0m s ASP 118 CO 0.02 -1.28 1.76 1.21 0.21 0.00 0.00 175.17 177.09 3h0m n GLU 119 N -0.75 2.13 -2.23 8.23 2.13 -0.69 -0.76 120.64 128.71 3h0m n GLU 119 Ca 0.09 0.78 -0.16 0.00 0.66 0.00 0.00 57.16 58.53 3h0m n GLU 119 Cb 0.46 -2.59 -0.02 0.00 0.27 0.00 0.00 31.44 29.56 3h0m n GLU 119 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 3h0m n PHE 120 N 5.43 -1.05 -1.70 4.31 3.72 -0.31 -2.37 117.46 125.48 3h0m n PHE 120 Ca 0.21 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.49 3h0m n PHE 120 Cb 0.29 -3.16 -0.03 0.00 -0.94 0.00 0.00 39.48 35.64 3h0m n PHE 120 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h0m n ALA 121 N -1.55 -0.24 -3.56 4.37 0.00 0.06 -4.82 120.51 114.77 3h0m n ALA 121 Ca -0.18 0.15 -0.39 0.00 0.00 0.00 0.00 53.44 53.02 3h0m n ALA 121 Cb 0.62 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.58 3h0m n ALA 121 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3h0m s MET 122 N -3.64 2.36 0.00 0.00 -1.94 -1.00 -4.65 119.30 110.43 3h0m s MET 122 Ca 0.00 -1.70 0.00 0.00 -1.71 0.00 0.00 55.69 52.28 3h0m s MET 122 Cb 0.00 -3.76 0.00 0.00 2.01 0.00 0.00 34.83 33.08 3h0m s MET 122 CO 0.00 -1.08 0.00 0.41 -0.01 0.00 0.00 175.02 174.34 3h0m n GLY 123 N 4.81 2.48 0.30 -0.03 0.00 -1.26 -4.53 105.19 106.95 3h0m n GLY 123 Ca -0.07 -1.50 0.08 0.00 0.00 0.00 0.00 46.02 44.52 3h0m n GLY 123 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0m n SER 124 N 0.00 1.88 0.00 1.61 7.64 -1.26 -2.32 113.62 121.17 3h0m n SER 124 Ca 0.00 -3.10 0.00 0.00 1.01 0.00 0.00 58.87 56.78 3h0m n SER 124 Cb 0.00 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 3h0m n SER 124 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3h0m n SER 125 N -1.12 0.00 0.00 6.43 3.41 -1.23 -1.16 113.62 119.95 3h0m n SER 125 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 3h0m n SER 125 Cb 0.68 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.63 3h0m n SER 125 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3h0m n THR 126 N 0.00 0.00 0.23 6.66 -1.04 -1.10 -4.16 114.28 114.87 3h0m n THR 126 Ca 0.00 0.00 0.18 0.00 -2.04 0.00 0.00 64.05 62.19 3h0m n THR 126 Cb 0.00 -0.03 0.86 0.00 -1.82 0.00 0.00 70.33 69.34 3h0m n THR 126 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3h0m h GLU 127 N 1.48 0.00 -0.21 -2.82 5.08 -1.90 -1.54 114.58 114.67 3h0m h GLU 127 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h0m h GLU 127 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3h0m h GLU 127 CO 0.00 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.67 3h0m n TYR 128 N -3.53 0.27 -1.67 4.33 4.01 -1.26 -4.77 117.16 114.55 3h0m n TYR 128 Ca 0.01 -0.13 -0.47 0.00 -0.16 0.00 0.00 57.90 57.15 3h0m n TYR 128 Cb 0.35 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.34 3h0m n TYR 128 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3h0m n SER 129 N 0.23 3.08 0.02 7.72 2.88 -0.58 -1.70 113.62 125.27 3h0m n SER 129 Ca 0.13 1.06 0.06 0.00 -1.33 0.00 0.00 58.87 58.79 3h0m n SER 129 Cb 0.27 -1.40 0.27 0.00 -0.75 0.00 0.00 64.21 62.60 3h0m n SER 129 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h0m n ALA 130 N 4.13 1.46 -0.10 -1.46 0.00 -0.63 -3.93 120.51 119.98 3h0m n ALA 130 Ca 0.18 -0.01 -0.20 0.00 0.00 0.00 0.00 53.44 53.42 3h0m n ALA 130 Cb 0.28 -1.20 -0.07 0.00 0.00 0.00 0.00 19.45 18.47 3h0m n ALA 130 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3h0m n PHE 131 N -1.63 0.00 -3.61 0.00 3.72 -1.26 -4.92 117.46 109.77 3h0m n PHE 131 Ca 0.02 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.36 3h0m n PHE 131 Cb 0.13 -0.70 -0.04 0.00 -0.94 0.00 0.00 39.48 37.92 3h0m n PHE 131 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 3h0m s PHE 132 N -2.52 -0.19 0.28 1.38 -0.71 -1.25 -5.15 117.98 109.82 3h0m s PHE 132 Ca -0.30 0.31 -0.29 0.00 -1.04 0.00 0.00 56.93 55.61 3h0m s PHE 132 Cb 0.10 0.48 -0.10 0.00 -1.21 0.00 0.00 43.02 42.29 3h0m s PHE 132 CO 0.39 -0.19 1.24 -1.25 -1.34 0.00 0.00 175.22 174.07 3h0m s PRO 133 N -1.23 4.46 0.29 1.99 0.04 -1.26 -4.70 135.00 134.59 3h0m s PRO 133 Ca 0.04 2.04 -0.18 0.00 0.04 0.00 0.00 61.00 62.94 3h0m s PRO 133 Cb -0.01 -3.14 -0.09 0.00 0.04 0.00 0.00 34.50 31.30 3h0m s PRO 133 CO -0.04 -0.07 0.77 0.99 0.04 0.00 0.00 177.00 178.69 3h0m s THR 134 N -0.83 4.57 -0.00 1.26 2.01 -1.26 -4.83 115.64 116.56 3h0m s THR 134 Ca 0.49 1.20 0.05 0.00 0.31 0.00 0.00 61.69 63.74 3h0m s THR 134 Cb -0.36 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 3h0m s THR 134 CO 0.45 -0.01 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.70 3h0m s LYS 135 N -2.52 2.38 -0.08 4.92 1.02 -0.07 -4.36 119.74 121.02 3h0m s LYS 135 Ca 0.50 -0.79 -0.29 0.00 0.02 0.00 0.00 55.97 55.40 3h0m s LYS 135 Cb -0.13 -2.36 -0.06 0.00 -0.52 0.00 0.00 37.83 34.76 3h0m s LYS 135 CO 0.19 0.59 1.89 1.21 -0.92 0.00 0.00 175.35 178.31 3h0m s ASN 136 N -1.17 6.29 0.04 2.83 3.84 0.22 -4.72 114.94 122.27 3h0m s ASN 136 Ca 0.14 2.23 0.09 0.00 0.21 0.00 0.00 52.86 55.54 3h0m s ASN 136 Cb -0.11 -2.53 0.41 0.00 -0.55 0.00 0.00 41.25 38.47 3h0m s ASN 136 CO 0.04 -1.24 1.29 -0.81 -2.79 0.00 0.00 177.10 173.59 3h0m n PRO 137 N 7.72 0.02 0.00 0.43 -0.04 -1.26 -1.22 135.00 140.65 3h0m n PRO 137 Ca 0.21 0.40 0.11 0.00 -0.04 0.00 0.00 63.50 64.18 3h0m n PRO 137 Cb 0.43 -1.56 0.11 0.00 -0.04 0.00 0.00 33.50 32.44 3h0m n PRO 137 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 3h0m n TRP 138 N -1.60 0.00 -3.15 0.54 7.02 -1.26 -4.13 117.44 114.86 3h0m n TRP 138 Ca 0.01 0.00 0.06 0.00 -1.02 0.00 0.00 57.50 56.55 3h0m n TRP 138 Cb 0.09 -0.14 -0.00 0.00 -2.42 0.00 0.00 31.31 28.83 3h0m n TRP 138 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3h0m s ASP 139 N -2.96 -0.37 0.00 -0.99 -1.08 -0.35 -4.91 116.67 106.01 3h0m s ASP 139 Ca 0.11 0.07 0.14 0.00 -0.52 0.00 0.00 52.55 52.35 3h0m s ASP 139 Cb 0.17 1.25 0.82 0.00 -1.46 0.00 0.00 42.92 43.70 3h0m s ASP 139 CO 0.75 -0.07 1.32 0.18 0.52 0.00 0.00 175.17 177.87 3h0m n LEU 140 N 5.17 0.00 -0.06 -1.34 4.77 -0.82 0.44 117.00 125.16 3h0m n LEU 140 Ca 0.06 0.09 0.15 0.00 -0.03 0.00 0.00 56.01 56.28 3h0m n LEU 140 Cb 0.57 -0.09 0.72 0.00 -2.33 0.00 0.00 43.42 42.29 3h0m n LEU 140 CO -0.16 -0.05 0.97 -0.62 -1.33 0.00 0.00 177.39 176.20 3h0m n GLU 141 N -1.09 0.64 -4.41 3.23 1.02 -1.26 -4.70 120.64 114.06 3h0m n GLU 141 Ca 0.10 -0.11 -0.25 0.00 -0.02 0.00 0.00 57.16 56.87 3h0m n GLU 141 Cb 0.07 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 29.89 3h0m n GLU 141 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3h0m s ARG 142 N -2.44 1.75 0.31 3.49 0.52 0.17 -3.31 118.95 119.45 3h0m s ARG 142 Ca 0.32 -1.58 -0.27 0.00 -0.52 0.00 0.00 55.73 53.67 3h0m s ARG 142 Cb 0.20 -1.89 -0.09 0.00 0.52 0.00 0.00 34.95 33.69 3h0m s ARG 142 CO 0.45 0.37 1.01 0.08 0.02 0.00 0.00 175.30 177.23 3h0m s VAL 143 N -2.11 3.87 -2.16 3.52 1.01 -0.68 -0.61 120.40 123.24 3h0m s VAL 143 Ca 0.26 1.67 0.17 0.00 0.00 0.00 0.00 61.98 64.09 3h0m s VAL 143 Cb -0.07 -3.98 0.40 0.00 0.00 0.00 0.00 36.38 32.74 3h0m s VAL 143 CO 0.14 0.24 1.45 -0.81 0.00 0.00 0.00 175.10 176.12 3h0m n PRO 144 N 0.76 1.70 0.00 2.72 -0.04 -1.26 -4.45 135.00 134.43 3h0m n PRO 144 Ca 0.01 -1.07 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 3h0m n PRO 144 Cb 0.48 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 3h0m n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h0m n GLY 145 N 1.07 -0.10 3.49 0.55 0.00 -1.26 -4.39 105.19 104.56 3h0m n GLY 145 Ca 0.14 -1.90 -0.11 0.00 0.00 0.00 0.00 46.02 44.15 3h0m n GLY 145 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h0m s GLY 146 N -0.93 -0.52 0.11 -0.02 0.00 -0.31 -2.69 107.32 102.97 3h0m s GLY 146 Ca 0.00 0.34 0.19 0.00 0.00 0.00 0.00 44.72 45.26 3h0m s GLY 146 CO 0.00 0.11 0.89 -1.14 0.00 0.00 0.00 173.10 172.96 3h0m n SER 147 N -0.39 0.83 -2.02 1.64 3.41 -0.98 -4.22 113.62 111.90 3h0m n SER 147 Ca -0.15 0.35 -0.01 0.00 -0.26 0.00 0.00 58.87 58.80 3h0m n SER 147 Cb 0.64 0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 64.88 3h0m n SER 147 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3h0m n SER 148 N -2.79 1.66 0.03 4.04 7.64 -0.95 -2.91 113.62 120.33 3h0m n SER 148 Ca -0.06 -1.57 -0.13 0.00 1.01 0.00 0.00 58.87 58.12 3h0m n SER 148 Cb 0.73 -0.39 -0.06 0.00 -1.01 0.00 0.00 64.21 63.48 3h0m n SER 148 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3h0m h GLY 149 N 4.38 -0.75 1.92 0.23 0.00 -1.68 -2.56 103.07 104.62 3h0m h GLY 149 Ca 0.02 0.52 -0.04 0.00 0.00 0.00 0.00 47.33 47.83 3h0m h GLY 149 CO 0.14 -0.23 -0.16 -1.33 0.00 0.00 0.00 176.54 174.96 3h0m h GLY 150 N -0.53 0.11 1.93 4.60 0.00 -1.64 -1.10 103.07 106.44 3h0m h GLY 150 Ca 0.06 -0.07 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 3h0m h GLY 150 CO -0.36 0.06 -0.72 1.76 0.00 0.00 0.00 176.54 177.28 3h0m h SER 151 N 0.10 0.08 0.16 0.19 0.02 -1.69 -1.30 113.55 111.10 3h0m h SER 151 Ca 0.02 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 3h0m h SER 151 Cb 0.35 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.86 3h0m h SER 151 CO 0.02 0.77 -0.08 0.00 -1.14 0.00 0.00 176.83 176.41 3h0m h ALA 152 N 1.23 -0.21 -0.43 3.77 0.00 -1.24 -3.22 119.26 119.15 3h0m h ALA 152 Ca -0.01 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.77 3h0m h ALA 152 Cb 1.27 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.05 3h0m h ALA 152 CO 0.10 -0.26 -0.13 0.00 0.00 0.00 0.00 179.25 178.96 3h0m h ALA 153 N -0.46 0.25 -0.00 0.00 0.00 -1.21 -0.18 119.26 117.65 3h0m h ALA 153 Ca -0.02 0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 3h0m h ALA 153 Cb 0.49 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3h0m h ALA 153 CO 0.04 -0.47 -0.31 0.66 0.00 0.00 0.00 179.25 179.16 3h0m h SER 154 N -0.03 0.01 0.82 0.00 4.64 -1.38 -0.79 113.55 116.81 3h0m h SER 154 Ca 0.21 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.37 3h0m h SER 154 Cb 0.35 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 3h0m h SER 154 CO -0.46 0.32 -0.75 0.58 -0.87 0.00 0.00 176.83 175.65 3h0m h VAL 155 N 0.01 1.49 -0.02 0.95 2.07 -1.30 -1.25 116.25 118.20 3h0m h VAL 155 Ca -0.00 -2.60 -0.01 0.00 0.82 0.00 0.00 66.70 64.91 3h0m h VAL 155 Cb 0.56 2.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.75 3h0m h VAL 155 CO 0.04 0.73 -0.01 0.00 0.02 0.00 0.00 177.57 178.35 3h0m h ALA 156 N 1.25 0.03 0.00 1.67 0.00 0.01 -2.92 119.26 119.29 3h0m h ALA 156 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3h0m h ALA 156 Cb 1.36 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3h0m h ALA 156 CO 0.10 -0.23 0.00 1.33 0.00 0.00 0.00 179.25 180.45 3h0m n VAL 157 N -4.84 0.09 -2.38 0.00 0.24 -0.41 -4.37 118.33 106.66 3h0m n VAL 157 Ca -0.08 0.02 -0.16 0.00 -2.04 0.00 0.00 64.34 62.08 3h0m n VAL 157 Cb 0.25 -0.55 -0.00 0.00 -1.47 0.00 0.00 33.84 32.06 3h0m n VAL 157 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3h0m n LEU 158 N -1.43 -1.82 0.04 1.34 4.77 -0.57 -4.89 117.00 114.44 3h0m n LEU 158 Ca 0.09 -0.05 0.07 0.00 -0.03 0.00 0.00 56.01 56.10 3h0m n LEU 158 Cb 0.29 -2.34 0.33 0.00 -2.33 0.00 0.00 43.42 39.37 3h0m n LEU 158 CO 0.24 -0.11 0.73 -1.54 -1.33 0.00 0.00 177.39 175.38 3h0m n SER 159 N -1.07 0.21 -3.75 -1.43 3.41 -0.64 -4.63 113.62 105.73 3h0m n SER 159 Ca -0.17 0.56 -0.13 0.00 -0.26 0.00 0.00 58.87 58.87 3h0m n SER 159 Cb 0.63 -0.60 -0.10 0.00 -0.26 0.00 0.00 64.21 63.88 3h0m n SER 159 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h0m s ALA 160 N -3.12 -0.86 0.20 7.33 0.00 -1.02 -4.71 121.76 119.58 3h0m s ALA 160 Ca 0.04 0.76 0.04 0.00 0.00 0.00 0.00 51.96 52.81 3h0m s ALA 160 Cb 0.08 -0.34 0.11 0.00 0.00 0.00 0.00 23.12 22.97 3h0m s ALA 160 CO 0.25 -0.20 1.46 -1.00 0.00 0.00 0.00 175.76 176.26 3h0m h PRO 161 N 4.92 0.18 -3.63 0.00 0.13 -1.82 -3.32 132.00 128.46 3h0m h PRO 161 Ca -0.28 -0.17 -0.11 0.00 -0.87 0.00 0.00 66.00 64.58 3h0m h PRO 161 Cb 1.18 0.04 -0.17 0.00 0.13 0.00 0.00 31.00 32.19 3h0m h PRO 161 CO 0.33 0.86 -0.40 0.54 -0.23 0.00 0.00 178.00 179.10 3h0m s VAL 162 N -3.41 0.12 -0.05 1.56 0.11 -1.26 -4.30 120.40 113.16 3h0m s VAL 162 Ca -0.03 -0.97 -0.20 0.00 -2.93 0.00 0.00 61.98 57.85 3h0m s VAL 162 Cb 0.11 -0.99 0.04 0.00 -1.53 0.00 0.00 36.38 34.01 3h0m s VAL 162 CO 0.81 -0.53 0.46 -0.55 -3.33 0.00 0.00 175.10 171.96 3h0m s SER 163 N -2.23 -0.39 -0.15 3.54 0.15 -0.34 -3.00 113.70 111.28 3h0m s SER 163 Ca -0.03 0.43 -0.06 0.00 0.70 0.00 0.00 55.95 56.99 3h0m s SER 163 Cb 0.00 0.49 -0.04 0.00 -1.71 0.00 0.00 66.02 64.76 3h0m s SER 163 CO -0.05 -0.46 0.05 -0.76 1.20 0.00 0.00 173.24 173.22 3h0m s LEU 164 N -1.05 3.79 0.00 3.45 1.02 -0.64 -0.48 118.68 124.77 3h0m s LEU 164 Ca -0.11 0.13 0.01 0.00 0.02 0.00 0.00 54.13 54.18 3h0m s LEU 164 Cb -0.03 -1.93 -0.00 0.00 0.02 0.00 0.00 46.19 44.25 3h0m s LEU 164 CO 0.06 0.26 0.02 0.61 0.02 0.00 0.00 176.35 177.31 3h0m n GLY 165 N 2.98 3.98 3.13 -3.19 0.00 -0.46 -2.26 105.19 109.37 3h0m n GLY 165 Ca -0.18 -1.89 -0.15 0.00 0.00 0.00 0.00 46.02 43.80 3h0m n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0m s SER 166 N -1.31 1.25 -0.23 1.61 1.04 -1.26 -0.85 113.70 113.96 3h0m s SER 166 Ca 0.03 -0.65 -0.00 0.00 0.48 0.00 0.00 55.95 55.81 3h0m s SER 166 Cb 0.00 0.01 0.06 0.00 0.10 0.00 0.00 66.02 66.19 3h0m s SER 166 CO 0.02 -0.19 -0.01 -0.62 0.98 0.00 0.00 173.24 173.42 3h0m s ASP 167 N -1.89 3.56 -0.22 7.02 -1.08 0.11 -3.35 116.67 120.81 3h0m s ASP 167 Ca -0.03 -1.09 0.11 0.00 -0.52 0.00 0.00 52.55 51.02 3h0m s ASP 167 Cb -0.08 -0.97 -0.22 0.00 -1.46 0.00 0.00 42.92 40.19 3h0m s ASP 167 CO 0.01 -0.27 -0.04 0.41 0.52 0.00 0.00 175.17 175.80 3h0m n THR 168 N 4.80 1.44 -2.46 1.71 -1.04 -1.26 -2.14 114.28 115.32 3h0m n THR 168 Ca -0.10 -0.74 -0.02 0.00 -2.04 0.00 0.00 64.05 61.15 3h0m n THR 168 Cb 0.45 -0.86 0.03 0.00 -1.82 0.00 0.00 70.33 68.13 3h0m n THR 168 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h0m n GLY 169 N 1.95 1.30 0.00 3.41 0.00 -1.26 -4.69 105.19 105.90 3h0m n GLY 169 Ca -0.38 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.20 3h0m n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h0m n GLY 170 N -0.46 1.50 0.01 -0.02 0.00 -1.26 -3.68 105.19 101.28 3h0m n GLY 170 Ca -0.11 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.05 3h0m n GLY 170 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0m n SER 171 N 0.00 0.04 -0.10 1.61 7.64 -1.26 -1.36 113.62 120.19 3h0m n SER 171 Ca 0.00 0.15 -0.24 0.00 1.01 0.00 0.00 58.87 59.80 3h0m n SER 171 Cb 0.00 -0.36 -0.12 0.00 -1.01 0.00 0.00 64.21 62.72 3h0m n SER 171 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3h0m n ILE 172 N -1.38 1.57 -0.02 0.44 5.41 -1.21 -2.24 119.36 121.92 3h0m n ILE 172 Ca 0.10 -0.39 -0.14 0.00 1.00 0.00 0.00 62.75 63.33 3h0m n ILE 172 Cb 0.30 -1.79 -0.02 0.00 -0.71 0.00 0.00 39.64 37.42 3h0m n ILE 172 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 3h0m h ARG 173 N -0.59 0.70 -0.17 0.38 3.08 -1.72 -1.81 114.38 114.25 3h0m h ARG 173 Ca -0.54 -0.51 -0.16 0.00 0.07 0.00 0.00 59.98 58.84 3h0m h ARG 173 Cb 1.68 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.82 3h0m h ARG 173 CO -0.21 1.13 -0.52 -0.56 -1.07 0.00 0.00 179.97 178.73 3h0m h GLN 174 N 0.51 0.65 -0.18 0.04 -0.00 -1.51 -1.22 115.11 113.40 3h0m h GLN 174 Ca -0.02 -0.48 -0.07 0.00 -0.00 0.00 0.00 58.65 58.08 3h0m h GLN 174 Cb 1.26 0.08 -0.01 0.00 -0.00 0.00 0.00 27.48 28.80 3h0m h GLN 174 CO 0.13 1.10 -0.21 -1.35 -0.00 0.00 0.00 178.83 178.50 3h0m h PRO 175 N 0.33 0.30 -0.91 0.06 0.11 -1.75 -1.12 132.00 129.03 3h0m h PRO 175 Ca -0.02 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3h0m h PRO 175 Cb 1.15 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 3h0m h PRO 175 CO 0.11 0.51 0.58 0.00 -0.21 0.00 0.00 178.00 178.99 3h0m h ALA 176 N 1.51 1.16 0.75 -0.75 0.00 -1.15 -0.78 119.26 120.00 3h0m h ALA 176 Ca 0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3h0m h ALA 176 Cb 0.53 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.96 3h0m h ALA 176 CO 0.04 0.59 -0.36 1.03 0.00 0.00 0.00 179.25 180.54 3h0m h SER 177 N 1.25 -0.85 -0.52 0.00 0.87 -0.75 -0.55 113.55 112.99 3h0m h SER 177 Ca 0.33 0.01 0.10 0.00 -1.23 0.00 0.00 61.79 61.00 3h0m h SER 177 Cb -0.10 0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 3h0m h SER 177 CO -0.07 -0.52 0.36 -0.26 -0.53 0.00 0.00 176.83 175.81 3h0m h PHE 178 N -1.17 0.30 -0.25 2.24 -1.00 -1.16 -2.46 116.94 113.45 3h0m h PHE 178 Ca -0.10 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.69 3h0m h PHE 178 Cb 0.79 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.25 3h0m h PHE 178 CO -0.00 0.14 0.00 0.00 -1.61 0.00 0.00 178.31 176.84 3h0m n GLY 180 N 1.37 0.02 3.11 0.00 0.00 -0.50 -4.77 105.19 104.42 3h0m n GLY 180 Ca 0.17 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 3h0m n GLY 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0m s VAL 181 N -3.20 0.45 0.07 1.61 1.01 -0.33 -4.90 120.40 115.11 3h0m s VAL 181 Ca 0.08 -1.66 -0.30 0.00 0.00 0.00 0.00 61.98 60.10 3h0m s VAL 181 Cb -0.03 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.98 3h0m s VAL 181 CO 0.41 -0.81 0.97 -0.63 0.00 0.00 0.00 175.10 175.04 3h0m s ILE 182 N -3.17 4.64 -0.02 2.22 1.01 0.19 -4.30 121.20 121.78 3h0m s ILE 182 Ca 0.04 2.07 0.00 0.00 0.00 0.00 0.00 60.65 62.76 3h0m s ILE 182 Cb 0.02 -4.32 0.02 0.00 0.01 0.00 0.00 42.46 38.19 3h0m s ILE 182 CO -0.05 0.26 0.02 -0.83 0.00 0.00 0.00 174.94 174.33 3h0m s GLY 183 N 0.38 0.11 -0.06 6.18 0.00 -0.80 -0.90 107.32 112.23 3h0m s GLY 183 Ca 0.49 0.20 0.06 0.00 0.00 0.00 0.00 44.72 45.46 3h0m s GLY 183 CO 0.29 0.49 -0.24 -1.50 0.00 0.00 0.00 173.10 172.14 3h0m s ILE 184 N 0.78 1.99 -0.29 0.90 2.07 -0.17 -1.01 121.20 125.47 3h0m s ILE 184 Ca -0.07 -1.03 -0.07 0.00 -1.41 0.00 0.00 60.65 58.08 3h0m s ILE 184 Cb -0.10 -1.69 0.01 0.00 0.13 0.00 0.00 42.46 40.81 3h0m s ILE 184 CO -0.02 0.55 0.08 -0.75 -1.91 0.00 0.00 174.94 172.89 3h0m s LYS 185 N -0.08 3.10 1.13 3.50 2.20 -0.58 -2.22 119.74 126.78 3h0m s LYS 185 Ca -0.06 -0.85 -0.18 0.00 -0.36 0.00 0.00 55.97 54.52 3h0m s LYS 185 Cb -0.14 -3.37 0.26 0.00 -1.51 0.00 0.00 37.83 33.07 3h0m s LYS 185 CO 0.04 -0.44 1.19 -1.25 -0.36 0.00 0.00 175.35 174.53 3h0m s PRO 186 N 1.50 -0.66 0.30 4.03 0.04 -1.26 -0.91 135.00 138.03 3h0m s PRO 186 Ca 0.03 -0.23 -0.29 0.00 0.04 0.00 0.00 61.00 60.54 3h0m s PRO 186 Cb -0.17 -1.68 -0.13 0.00 0.04 0.00 0.00 34.50 32.57 3h0m s PRO 186 CO 0.02 -3.31 1.39 2.41 0.04 0.00 0.00 177.00 177.56 3h0m n THR 187 N -4.44 1.46 -1.71 1.26 -1.04 -1.26 -4.28 114.28 104.26 3h0m n THR 187 Ca 0.14 -0.36 -0.42 0.00 -2.04 0.00 0.00 64.05 61.37 3h0m n THR 187 Cb 0.60 -1.62 -0.03 0.00 -1.82 0.00 0.00 70.33 67.45 3h0m n THR 187 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 3h0m s TYR 188 N -0.54 1.57 0.00 -1.42 5.04 -0.90 -0.66 117.35 120.45 3h0m s TYR 188 Ca 0.61 -0.29 0.00 0.00 -2.44 0.00 0.00 57.07 54.95 3h0m s TYR 188 Cb -0.58 -4.20 0.00 0.00 0.35 0.00 0.00 41.96 37.53 3h0m s TYR 188 CO 0.55 -5.25 0.00 0.41 -1.34 0.00 0.00 175.55 169.93 3h0m n GLY 189 N 4.43 1.67 0.12 8.97 0.00 -1.26 -4.93 105.19 114.18 3h0m n GLY 189 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 3h0m n GLY 189 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3h0m h ARG 190 N 1.50 0.01 -5.13 1.61 2.43 -1.22 -0.85 114.38 112.73 3h0m h ARG 190 Ca 0.00 -0.01 -0.58 0.00 -0.81 0.00 0.00 59.98 58.58 3h0m h ARG 190 Cb 0.00 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.23 3h0m h ARG 190 CO 0.00 0.71 -0.84 0.08 -1.51 0.00 0.00 179.97 178.41 3h0m s VAL 191 N -3.41 1.51 0.50 0.20 1.01 -1.26 -0.55 120.40 118.40 3h0m s VAL 191 Ca -0.01 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 61.01 3h0m s VAL 191 Cb 0.12 -1.32 -0.06 0.00 0.00 0.00 0.00 36.38 35.12 3h0m s VAL 191 CO 0.78 0.43 1.39 -0.24 0.00 0.00 0.00 175.10 177.46 3h0m n SER 192 N 3.41 2.96 -1.12 3.32 2.88 -1.26 -4.73 113.62 119.07 3h0m n SER 192 Ca -0.20 1.04 0.08 0.00 -1.33 0.00 0.00 58.87 58.46 3h0m n SER 192 Cb 0.53 -1.59 0.27 0.00 -0.75 0.00 0.00 64.21 62.67 3h0m n SER 192 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3h0m n ARG 193 N -0.64 3.29 -2.24 -1.46 1.74 -1.26 -4.75 116.66 111.33 3h0m n ARG 193 Ca 0.08 -2.64 -0.43 0.00 -0.77 0.00 0.00 57.85 54.09 3h0m n ARG 193 Cb 0.43 -1.71 -0.02 0.00 -1.02 0.00 0.00 32.46 30.14 3h0m n ARG 193 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3h0m s TYR 194 N -1.91 2.23 0.00 -1.55 5.04 -1.26 -2.17 117.35 117.73 3h0m s TYR 194 Ca 0.41 0.66 0.00 0.00 -2.44 0.00 0.00 57.07 55.69 3h0m s TYR 194 Cb 0.28 -4.24 0.00 0.00 0.35 0.00 0.00 41.96 38.35 3h0m s TYR 194 CO 0.17 -2.29 0.00 0.41 -1.34 0.00 0.00 175.55 172.51 3h0m n GLY 195 N 5.14 0.75 3.52 8.97 0.00 -1.26 -0.82 105.19 121.49 3h0m n GLY 195 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3h0m n GLY 195 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h0m s LEU 196 N 0.00 4.63 -0.19 0.99 2.96 -0.92 -1.45 118.68 124.69 3h0m s LEU 196 Ca 0.00 -0.42 -0.32 0.00 -0.22 0.00 0.00 54.13 53.17 3h0m s LEU 196 Cb 0.00 -2.39 -0.09 0.00 0.50 0.00 0.00 46.19 44.21 3h0m s LEU 196 CO 0.00 -0.47 2.09 0.52 -1.32 0.00 0.00 176.35 177.17 3h0m n VAL 197 N 5.36 0.41 -2.15 1.68 0.31 -0.13 -4.84 118.33 118.96 3h0m n VAL 197 Ca -0.08 -0.27 -0.41 0.00 -0.01 0.00 0.00 64.34 63.57 3h0m n VAL 197 Cb 0.48 -2.09 -0.03 0.00 -0.91 0.00 0.00 33.84 31.30 3h0m n VAL 197 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h0m s ALA 198 N 6.45 3.56 0.00 3.52 0.00 -1.26 -4.95 121.76 129.08 3h0m s ALA 198 Ca 1.00 1.17 0.00 0.00 0.00 0.00 0.00 51.96 54.13 3h0m s ALA 198 Cb -0.59 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.02 3h0m s ALA 198 CO 0.45 -0.60 0.00 0.34 0.00 0.00 0.00 175.76 175.95 3h0m n PHE 199 N 2.66 0.00 -3.88 0.00 7.35 -1.26 -4.78 117.46 117.55 3h0m n PHE 199 Ca 0.07 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.46 3h0m n PHE 199 Cb 0.42 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 40.10 3h0m n PHE 199 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3h0m s ALA 200 N -2.70 2.02 0.42 3.13 0.00 -1.26 -2.51 121.76 120.86 3h0m s ALA 200 Ca 0.00 -1.78 0.11 0.00 0.00 0.00 0.00 51.96 50.29 3h0m s ALA 200 Cb 0.00 -1.64 0.95 0.00 0.00 0.00 0.00 23.12 22.42 3h0m s ALA 200 CO 0.00 -1.51 2.00 0.77 0.00 0.00 0.00 175.76 177.02 3h0m h SER 201 N 7.92 0.43 0.46 0.00 0.02 -1.93 0.15 113.55 120.59 3h0m h SER 201 Ca -0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3h0m h SER 201 Cb 1.04 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.49 3h0m h SER 201 CO 0.46 0.28 -0.07 -1.54 -1.14 0.00 0.00 176.83 174.82 3h0m n SER 202 N -4.47 0.24 0.00 3.07 3.41 -1.26 -4.14 113.62 110.47 3h0m n SER 202 Ca 0.08 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 3h0m n SER 202 Cb 0.26 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 3h0m n SER 202 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h0m n LEU 203 N -1.13 0.00 -4.66 1.04 4.77 -0.30 -4.96 117.00 111.76 3h0m n LEU 203 Ca 0.14 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.68 3h0m n LEU 203 Cb 0.26 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.33 3h0m n LEU 203 CO 0.24 0.00 0.94 0.47 -1.33 0.00 0.00 177.39 177.71 3h0m n ASP 204 N -1.69 2.54 -3.76 -1.43 8.00 0.36 -4.46 116.55 116.10 3h0m n ASP 204 Ca 0.00 1.16 -0.13 0.00 0.71 0.00 0.00 54.79 56.53 3h0m n ASP 204 Cb 0.37 -1.41 -0.12 0.00 -0.02 0.00 0.00 41.12 39.94 3h0m n ASP 204 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3h0m s GLN 205 N -0.75 0.31 0.45 -1.24 -1.52 -0.91 -4.88 119.66 111.13 3h0m s GLN 205 Ca 0.66 0.44 -0.24 0.00 -1.95 0.00 0.00 55.36 54.26 3h0m s GLN 205 Cb -0.65 0.11 -0.07 0.00 -0.22 0.00 0.00 33.01 32.17 3h0m s GLN 205 CO 0.53 -0.07 1.22 0.42 -0.25 0.00 0.00 175.29 177.14 3h0m s ILE 206 N 0.39 2.88 0.05 1.08 1.01 -1.26 0.04 121.20 125.38 3h0m s ILE 206 Ca -0.02 0.69 0.00 0.00 0.00 0.00 0.00 60.65 61.32 3h0m s ILE 206 Cb -0.04 -3.37 -0.00 0.00 0.01 0.00 0.00 42.46 39.07 3h0m s ILE 206 CO -0.02 0.02 0.06 0.61 0.00 0.00 0.00 174.94 175.62 3h0m n GLY 207 N 0.56 3.32 3.16 6.18 0.00 -0.03 -4.50 105.19 113.87 3h0m n GLY 207 Ca 0.07 -1.51 -0.25 0.00 0.00 0.00 0.00 46.02 44.32 3h0m n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0m s VAL 208 N -2.38 1.37 -0.06 1.61 1.01 -0.94 -1.36 120.40 119.66 3h0m s VAL 208 Ca 0.05 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 3h0m s VAL 208 Cb 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 3h0m s VAL 208 CO 0.03 0.39 -0.00 -0.36 0.00 0.00 0.00 175.10 175.16 3h0m s PHE 209 N -0.38 3.12 0.38 5.22 0.08 0.37 -1.00 117.98 125.77 3h0m s PHE 209 Ca 0.06 0.15 -0.16 0.00 0.12 0.00 0.00 56.93 57.10 3h0m s PHE 209 Cb -0.07 -1.75 0.06 0.00 -0.57 0.00 0.00 43.02 40.69 3h0m s PHE 209 CO -0.01 0.46 0.81 0.20 -0.10 0.00 0.00 175.22 176.59 3h0m s GLY 210 N -1.10 0.39 -0.05 4.36 0.00 -0.08 -1.20 107.32 109.64 3h0m s GLY 210 Ca 0.15 -0.76 0.08 0.00 0.00 0.00 0.00 44.72 44.19 3h0m s GLY 210 CO 0.05 -0.13 0.09 0.54 0.00 0.00 0.00 173.10 173.65 3h0m n ARG 211 N -0.55 1.75 -5.12 2.90 1.74 -1.26 -0.63 116.66 115.49 3h0m n ARG 211 Ca -0.08 -0.03 -0.31 0.00 -0.77 0.00 0.00 57.85 56.66 3h0m n ARG 211 Cb 0.60 -1.20 -0.15 0.00 -1.02 0.00 0.00 32.46 30.68 3h0m n ARG 211 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3h0m s ARG 212 N -2.35 2.03 0.49 5.56 0.52 -1.26 -4.44 118.95 119.51 3h0m s ARG 212 Ca -0.04 -0.98 0.16 0.00 -0.52 0.00 0.00 55.73 54.36 3h0m s ARG 212 Cb 0.04 -2.05 1.17 0.00 0.52 0.00 0.00 34.95 34.63 3h0m s ARG 212 CO 0.34 0.55 2.09 1.15 0.02 0.00 0.00 175.30 179.44 3h0m h THR 213 N 4.37 1.04 -0.35 0.02 2.02 -1.93 -1.61 112.91 116.48 3h0m h THR 213 Ca -0.45 -0.26 -0.13 0.00 0.77 0.00 0.00 66.41 66.35 3h0m h THR 213 Cb 1.13 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 3h0m h THR 213 CO 0.46 0.07 -0.29 -0.33 0.37 0.00 0.00 175.52 175.80 3h0m h GLU 214 N 0.00 0.73 -0.20 6.66 5.08 -1.95 -0.43 114.58 124.47 3h0m h GLU 214 Ca -0.00 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 3h0m h GLU 214 Cb 0.13 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3h0m h GLU 214 CO 0.01 0.94 0.13 -0.44 -1.00 0.00 0.00 179.01 178.64 3h0m h ASP 215 N 0.63 0.23 -0.38 1.42 3.32 -1.73 -1.83 116.42 118.09 3h0m h ASP 215 Ca 0.07 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 3h0m h ASP 215 Cb 0.81 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 3h0m h ASP 215 CO 0.07 0.19 0.08 0.58 -1.72 0.00 0.00 179.24 178.44 3h0m h VAL 216 N 0.26 1.23 -0.66 -1.35 2.07 -1.34 -2.40 116.25 114.06 3h0m h VAL 216 Ca 0.07 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.79 3h0m h VAL 216 Cb -0.01 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 3h0m h VAL 216 CO -0.01 0.28 0.42 0.00 0.02 0.00 0.00 177.57 178.27 3h0m h ALA 217 N 0.93 1.50 -0.01 1.67 0.00 -0.97 -2.24 119.26 120.14 3h0m h ALA 217 Ca 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3h0m h ALA 217 Cb 0.33 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3h0m h ALA 217 CO 0.00 0.45 -0.05 1.25 0.00 0.00 0.00 179.25 180.90 3h0m h LEU 218 N 0.90 0.07 -0.89 0.00 5.85 -1.09 -1.86 115.31 118.30 3h0m h LEU 218 Ca 0.24 -0.65 -0.02 0.00 0.84 0.00 0.00 57.88 58.29 3h0m h LEU 218 Cb -0.08 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 3h0m h LEU 218 CO -0.05 0.71 0.48 0.58 -0.34 0.00 0.00 178.44 179.82 3h0m h VAL 219 N -0.57 1.26 -0.36 1.05 2.07 -1.38 -1.70 116.25 116.62 3h0m h VAL 219 Ca -0.00 -0.65 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 3h0m h VAL 219 Cb 0.71 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3h0m h VAL 219 CO 0.01 0.29 0.22 0.25 0.02 0.00 0.00 177.57 178.36 3h0m h LEU 220 N 1.25 0.44 -0.82 2.57 5.85 -1.45 -2.22 115.31 120.92 3h0m h LEU 220 Ca 0.31 -0.06 0.08 0.00 0.84 0.00 0.00 57.88 59.06 3h0m h LEU 220 Cb 0.04 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 40.89 3h0m h LEU 220 CO -0.05 0.37 0.48 -0.08 -0.34 0.00 0.00 178.44 178.82 3h0m h GLU 221 N 0.47 0.80 -0.15 1.25 4.81 -0.78 -1.58 114.58 119.41 3h0m h GLU 221 Ca 0.13 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 3h0m h GLU 221 Cb 0.01 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 3h0m h GLU 221 CO -0.02 0.53 -0.01 0.28 -0.73 0.00 0.00 179.01 179.06 3h0m h VAL 222 N 0.83 1.26 0.00 0.32 2.07 -0.99 -3.19 116.25 116.56 3h0m h VAL 222 Ca 0.39 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 67.02 3h0m h VAL 222 Cb 0.31 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3h0m h VAL 222 CO -0.22 0.26 -0.09 2.30 0.02 0.00 0.00 177.57 179.84 3h0m n ILE 223 N -4.73 0.34 -2.07 4.57 -5.35 -0.87 -4.84 119.36 106.40 3h0m n ILE 223 Ca -0.05 -0.17 -0.28 0.00 -0.27 0.00 0.00 62.75 61.98 3h0m n ILE 223 Cb 0.23 -0.47 0.06 0.00 -1.74 0.00 0.00 39.64 37.72 3h0m n ILE 223 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 3h0m s SER 224 N -3.89 5.11 0.00 7.28 0.01 -0.61 -4.52 113.70 117.08 3h0m s SER 224 Ca 0.11 0.80 0.00 0.00 1.31 0.00 0.00 55.95 58.18 3h0m s SER 224 Cb 0.15 -1.54 0.00 0.00 0.21 0.00 0.00 66.02 64.84 3h0m s SER 224 CO 0.59 -1.47 0.00 0.61 0.41 0.00 0.00 173.24 173.38 3h0m n GLY 225 N -2.97 2.51 3.60 3.44 0.00 0.29 -4.99 105.19 107.08 3h0m n GLY 225 Ca 0.07 -1.98 -0.49 0.00 0.00 0.00 0.00 46.02 43.62 3h0m n GLY 225 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3h0m n TRP 226 N 0.46 1.59 -4.16 1.61 -0.00 -1.24 -4.45 117.44 111.24 3h0m n TRP 226 Ca 0.00 0.59 -0.28 0.00 -0.00 0.00 0.00 57.50 57.81 3h0m n TRP 226 Cb 0.00 -2.35 -0.17 0.00 -0.00 0.00 0.00 31.31 28.79 3h0m n TRP 226 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 3h0m s ASP 227 N 0.29 2.36 0.59 5.87 2.15 -1.26 -5.01 116.67 121.65 3h0m s ASP 227 Ca 0.77 -0.39 0.36 0.00 0.43 0.00 0.00 52.55 53.72 3h0m s ASP 227 Cb -0.84 -1.01 1.81 0.00 -0.30 0.00 0.00 42.92 42.58 3h0m s ASP 227 CO 0.49 -0.05 2.16 1.05 -0.17 0.00 0.00 175.17 178.65 3h0m h GLU 228 N 7.80 0.00 -0.02 4.34 4.11 -1.96 -1.33 114.58 127.52 3h0m h GLU 228 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.10 3h0m h GLU 228 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3h0m h GLU 228 CO 0.47 0.03 0.00 1.63 0.07 0.00 0.00 179.01 181.22 3h0m n LYS 229 N -3.24 1.33 -3.89 1.06 5.02 -1.26 -4.72 118.16 112.46 3h0m n LYS 229 Ca -0.01 -0.48 -0.28 0.00 -2.02 0.00 0.00 58.31 55.51 3h0m n LYS 229 Cb 0.19 -1.47 -0.16 0.00 -0.02 0.00 0.00 35.03 33.57 3h0m n LYS 229 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3h0m s ASP 230 N -1.95 2.82 0.39 4.39 -1.08 -0.50 -4.81 116.67 115.93 3h0m s ASP 230 Ca 0.42 -0.65 0.15 0.00 -0.52 0.00 0.00 52.55 51.95 3h0m s ASP 230 Cb 0.21 -0.92 0.82 0.00 -1.46 0.00 0.00 42.92 41.57 3h0m s ASP 230 CO 0.34 -0.18 1.85 0.28 0.52 0.00 0.00 175.17 177.98 3h0m h SER 231 N 8.12 0.00 0.28 -0.34 0.02 -1.84 -2.99 113.55 116.80 3h0m h SER 231 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 3h0m h SER 231 Cb 1.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.65 3h0m h SER 231 CO 0.40 0.33 -0.51 0.35 -1.14 0.00 0.00 176.83 176.27 3h0m n THR 232 N -3.97 0.00 -2.48 -2.27 -2.24 -1.26 -4.87 114.28 97.19 3h0m n THR 232 Ca -0.02 -0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.29 3h0m n THR 232 Cb 0.39 0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 69.11 3h0m n THR 232 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3h0m s SER 233 N -2.80 7.23 0.13 3.42 1.04 -1.13 -4.46 113.70 117.13 3h0m s SER 233 Ca 0.15 2.16 -0.21 0.00 0.48 0.00 0.00 55.95 58.53 3h0m s SER 233 Cb 0.18 -2.61 -0.07 0.00 0.10 0.00 0.00 66.02 63.62 3h0m s SER 233 CO 0.66 -0.23 0.66 0.00 0.98 0.00 0.00 173.24 175.31 3h0m s ALA 234 N -0.41 3.52 -1.45 5.32 0.00 -0.33 -4.77 121.76 123.65 3h0m s ALA 234 Ca 0.49 0.17 -0.10 0.00 0.00 0.00 0.00 51.96 52.51 3h0m s ALA 234 Cb -0.31 -2.77 0.04 0.00 0.00 0.00 0.00 23.12 20.08 3h0m s ALA 234 CO 0.37 0.35 2.43 1.63 0.00 0.00 0.00 175.76 180.54 3h0m n LYS 235 N 1.52 3.63 -4.72 0.00 5.02 -1.26 -3.73 118.16 118.61 3h0m n LYS 235 Ca -0.07 -2.83 -0.26 0.00 -2.02 0.00 0.00 58.31 53.13 3h0m n LYS 235 Cb 0.50 -2.93 -0.16 0.00 -0.02 0.00 0.00 35.03 32.42 3h0m n LYS 235 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h0m s VAL 236 N 1.44 1.31 0.45 -0.18 1.01 -1.26 -5.07 120.40 118.10 3h0m s VAL 236 Ca 0.54 -0.61 -0.25 0.00 0.00 0.00 0.00 61.98 61.67 3h0m s VAL 236 Cb 0.15 -1.16 -0.09 0.00 0.00 0.00 0.00 36.38 35.29 3h0m s VAL 236 CO -0.06 0.39 1.33 -0.81 0.00 0.00 0.00 175.10 175.95 3h0m n PRO 237 N 3.54 2.00 -2.80 2.72 -0.04 -1.26 -4.56 135.00 134.60 3h0m n PRO 237 Ca -0.21 0.72 -0.42 0.00 -0.04 0.00 0.00 63.50 63.55 3h0m n PRO 237 Cb 0.52 -2.49 -0.03 0.00 -0.04 0.00 0.00 33.50 31.46 3h0m n PRO 237 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3h0m s VAL 238 N -1.21 4.81 0.57 0.52 1.01 -1.26 -5.03 120.40 119.80 3h0m s VAL 238 Ca 0.63 1.79 -0.20 0.00 0.00 0.00 0.00 61.98 64.20 3h0m s VAL 238 Cb -0.47 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 31.66 3h0m s VAL 238 CO 0.57 -0.04 1.26 -2.84 0.00 0.00 0.00 175.10 174.05 3h0m s PRO 239 N 2.49 3.04 -1.13 2.72 0.02 -1.26 -4.89 135.00 135.99 3h0m s PRO 239 Ca 0.41 1.99 -0.20 0.00 0.02 0.00 0.00 61.00 63.22 3h0m s PRO 239 Cb -0.16 -2.07 -0.05 0.00 0.02 0.00 0.00 34.50 32.23 3h0m s PRO 239 CO 0.11 -1.20 1.95 0.39 -0.33 0.00 0.00 177.00 177.92 3h0m n GLU 240 N -1.35 2.14 -0.03 5.54 1.02 -1.26 -4.78 120.64 121.91 3h0m n GLU 240 Ca 0.12 -2.46 0.01 0.00 -0.02 0.00 0.00 57.16 54.80 3h0m n GLU 240 Cb 0.48 -3.34 0.31 0.00 -0.02 0.00 0.00 31.44 28.86 3h0m n GLU 240 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 3h0m h TRP 241 N 7.98 0.61 -0.11 -0.32 6.55 -1.90 -2.25 115.95 126.51 3h0m h TRP 241 Ca 0.40 -0.04 -0.03 0.00 0.95 0.00 0.00 58.89 60.18 3h0m h TRP 241 Cb 0.78 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.89 3h0m h TRP 241 CO 1.31 0.51 -0.05 0.66 -1.05 0.00 0.00 178.44 179.83 3h0m h SER 242 N 0.59 0.14 0.20 -3.49 4.64 -1.87 -0.94 113.55 112.83 3h0m h SER 242 Ca 0.14 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3h0m h SER 242 Cb 0.20 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3h0m h SER 242 CO -0.01 0.22 -0.21 -0.62 -0.87 0.00 0.00 176.83 175.35 3h0m n GLU 243 N -4.39 0.96 -0.04 4.77 -0.58 -0.88 -4.41 120.64 116.08 3h0m n GLU 243 Ca -0.01 -0.55 -0.03 0.00 -0.42 0.00 0.00 57.16 56.15 3h0m n GLU 243 Cb 0.18 -1.49 -0.08 0.00 -0.57 0.00 0.00 31.44 29.48 3h0m n GLU 243 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3h0m n GLU 244 N -0.54 1.82 -0.23 3.49 4.07 -0.44 -4.56 120.64 124.25 3h0m n GLU 244 Ca 0.13 -0.03 0.05 0.00 -0.06 0.00 0.00 57.16 57.25 3h0m n GLU 244 Cb 0.35 -1.27 0.30 0.00 -0.06 0.00 0.00 31.44 30.75 3h0m n GLU 244 CO 0.00 0.00 0.00 -0.39 -0.06 0.00 0.00 177.13 176.68 3h0m h VAL 245 N 0.00 1.06 0.00 6.31 -1.51 -1.53 -2.73 116.25 117.85 3h0m h VAL 245 Ca -0.22 -0.31 -0.05 0.00 -1.23 0.00 0.00 66.70 64.89 3h0m h VAL 245 Cb 1.38 0.09 -0.01 0.00 -2.13 0.00 0.00 31.29 30.62 3h0m h VAL 245 CO 0.01 0.16 -0.26 0.11 -1.23 0.00 0.00 177.57 176.36 3h0m h LYS 246 N 0.89 0.00 -7.32 5.19 1.57 -1.84 -3.39 116.57 111.68 3h0m h LYS 246 Ca 0.34 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.63 3h0m h LYS 246 Cb 0.19 0.00 0.15 0.00 0.08 0.00 0.00 32.23 32.65 3h0m h LYS 246 CO -0.11 0.26 0.26 0.15 -0.57 0.00 0.00 179.45 179.43 3h0m s LYS 247 N -3.42 1.40 -0.06 3.15 1.02 -1.03 -5.06 119.74 115.75 3h0m s LYS 247 Ca 0.02 0.95 -0.00 0.00 0.02 0.00 0.00 55.97 56.96 3h0m s LYS 247 Cb 0.09 -1.82 0.02 0.00 -0.52 0.00 0.00 37.83 35.61 3h0m s LYS 247 CO 0.66 -2.17 -0.02 -2.00 -0.92 0.00 0.00 175.35 170.90 3h0m s GLU 248 N -4.89 0.69 -0.19 1.68 2.12 -1.26 -4.91 118.70 111.93 3h0m s GLU 248 Ca 0.63 0.00 -0.08 0.00 0.36 0.00 0.00 54.97 55.89 3h0m s GLU 248 Cb -0.18 -0.87 -0.04 0.00 0.26 0.00 0.00 34.13 33.30 3h0m s GLU 248 CO 0.57 -0.19 0.08 0.08 -0.54 0.00 0.00 175.26 175.26 3h0m s VAL 249 N 1.39 4.86 0.30 3.70 1.01 -1.26 -5.09 120.40 125.32 3h0m s VAL 249 Ca -0.04 -0.01 -0.24 0.00 0.00 0.00 0.00 61.98 61.70 3h0m s VAL 249 Cb -0.13 -3.20 -0.10 0.00 0.00 0.00 0.00 36.38 32.95 3h0m s VAL 249 CO -0.03 0.45 0.89 -0.54 0.00 0.00 0.00 175.10 175.87 3h0m s LYS 250 N 0.47 4.49 -0.82 2.72 -0.14 -1.26 -4.25 119.74 120.95 3h0m s LYS 250 Ca 0.04 1.20 -0.01 0.00 -1.36 0.00 0.00 55.97 55.84 3h0m s LYS 250 Cb -0.12 -2.79 0.00 0.00 -1.68 0.00 0.00 37.83 33.23 3h0m s LYS 250 CO 0.00 0.30 0.20 0.41 -0.76 0.00 0.00 175.35 175.50 3h0m n GLY 251 N 0.55 0.03 3.77 -3.33 0.00 -1.26 -5.02 105.19 99.93 3h0m n GLY 251 Ca 0.01 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 3h0m n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0m s LEU 252 N -3.37 3.13 -0.02 0.99 1.43 -1.26 -4.87 118.68 114.70 3h0m s LEU 252 Ca 0.10 1.89 0.05 0.00 -1.03 0.00 0.00 54.13 55.13 3h0m s LEU 252 Cb -0.04 -4.53 -0.01 0.00 0.03 0.00 0.00 46.19 41.64 3h0m s LEU 252 CO 0.12 -1.96 -0.17 -0.54 0.23 0.00 0.00 176.35 174.03 3h0m s LYS 253 N -4.67 1.54 -0.09 1.70 1.02 -1.26 -2.34 119.74 115.64 3h0m s LYS 253 Ca 0.63 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 56.04 3h0m s LYS 253 Cb -0.18 -1.43 0.00 0.00 -0.52 0.00 0.00 37.83 35.70 3h0m s LYS 253 CO 0.52 0.33 -0.22 0.42 -0.92 0.00 0.00 175.35 175.48 3h0m s ILE 254 N -0.26 1.92 -0.18 2.17 1.01 -0.24 -1.24 121.20 124.37 3h0m s ILE 254 Ca 0.03 -0.94 -0.09 0.00 0.00 0.00 0.00 60.65 59.65 3h0m s ILE 254 Cb -0.08 -1.66 -0.05 0.00 0.01 0.00 0.00 42.46 40.68 3h0m s ILE 254 CO 0.00 0.53 0.13 -0.83 0.00 0.00 0.00 174.94 174.77 3h0m s GLY 255 N 0.38 2.06 -0.40 6.18 0.00 -0.50 -0.58 107.32 114.47 3h0m s GLY 255 Ca -0.18 -0.68 -0.06 0.00 0.00 0.00 0.00 44.72 43.80 3h0m s GLY 255 CO 0.08 0.03 0.20 1.08 0.00 0.00 0.00 173.10 174.48 3h0m s LEU 256 N 0.07 4.98 0.02 0.66 1.43 0.71 -1.77 118.68 124.77 3h0m s LEU 256 Ca 0.09 -1.64 -0.31 0.00 -1.03 0.00 0.00 54.13 51.24 3h0m s LEU 256 Cb -0.11 -1.89 -0.10 0.00 0.03 0.00 0.00 46.19 44.12 3h0m s LEU 256 CO -0.01 -0.49 1.95 -2.65 0.23 0.00 0.00 176.35 175.38 3h0m n PRO 257 N 4.76 2.74 0.01 1.29 -0.02 -1.26 -1.71 135.00 140.80 3h0m n PRO 257 Ca -0.08 1.00 0.14 0.00 -2.02 0.00 0.00 63.50 62.54 3h0m n PRO 257 Cb 0.42 -2.94 0.59 0.00 -0.02 0.00 0.00 33.50 31.55 3h0m n PRO 257 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3h0m h LYS 258 N 10.26 0.20 0.00 -0.52 1.57 -1.00 -0.27 116.57 126.81 3h0m h LYS 258 Ca -0.50 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 3h0m h LYS 258 Cb 1.25 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.51 3h0m h LYS 258 CO 0.94 0.13 0.00 0.93 -0.57 0.00 0.00 179.45 180.88 3h0m h GLU 259 N 0.20 0.00 0.00 3.15 3.07 -1.88 -2.81 114.58 116.30 3h0m h GLU 259 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 3h0m h GLU 259 Cb 0.60 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.51 3h0m h GLU 259 CO -0.04 0.00 0.00 0.74 -1.40 0.00 0.00 179.01 178.31 3h0m h PHE 260 N 0.00 0.00 0.00 4.33 0.04 -1.41 -3.09 116.94 116.81 3h0m h PHE 260 Ca 0.00 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 3h0m h PHE 260 Cb 0.60 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 3h0m h PHE 260 CO 0.00 0.00 -0.21 0.74 -0.60 0.00 0.00 178.31 178.24 3h0m h PHE 261 N 0.00 0.00 0.00 -0.55 0.04 -1.58 -2.15 116.94 112.69 3h0m h PHE 261 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3h0m h PHE 261 Cb 0.72 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.87 3h0m h PHE 261 CO 0.00 0.21 0.00 0.39 -0.60 0.00 0.00 178.31 178.31 3h0m n GLU 262 N -3.63 0.06 -2.89 1.51 -0.58 -1.17 -4.82 120.64 109.13 3h0m n GLU 262 Ca -0.01 0.10 -0.41 0.00 -0.42 0.00 0.00 57.16 56.42 3h0m n GLU 262 Cb 0.34 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.67 3h0m n GLU 262 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 3h0m s TYR 263 N -2.92 3.59 -0.24 -0.32 1.51 -0.81 -4.98 117.35 113.18 3h0m s TYR 263 Ca 0.13 1.44 -0.28 0.00 -1.01 0.00 0.00 57.07 57.35 3h0m s TYR 263 Cb 0.15 -2.96 -0.05 0.00 -0.11 0.00 0.00 41.96 38.99 3h0m s TYR 263 CO 0.41 0.01 2.21 -1.21 -1.11 0.00 0.00 175.55 175.86 3h0m s GLU 264 N 1.04 3.08 0.01 -0.62 2.02 -1.26 -4.98 118.70 117.99 3h0m s GLU 264 Ca 0.44 1.97 0.03 0.00 0.02 0.00 0.00 54.97 57.43 3h0m s GLU 264 Cb -0.19 -4.38 -0.04 0.00 0.10 0.00 0.00 34.13 29.63 3h0m s GLU 264 CO 0.21 -2.16 -0.04 -0.51 0.02 0.00 0.00 175.26 172.79 3h0m s LEU 265 N 8.45 3.30 0.32 1.80 1.43 -1.26 -4.83 118.68 127.89 3h0m s LEU 265 Ca 1.00 -0.11 -0.29 0.00 -1.03 0.00 0.00 54.13 53.69 3h0m s LEU 265 Cb -0.32 -1.91 -0.10 0.00 0.03 0.00 0.00 46.19 43.89 3h0m s LEU 265 CO 0.35 0.27 1.36 -1.10 0.23 0.00 0.00 176.35 177.45 3h0m s GLN 266 N -1.56 4.31 0.28 1.70 -0.21 -0.11 -4.87 119.66 119.19 3h0m s GLN 266 Ca 0.19 2.28 0.00 0.00 0.02 0.00 0.00 55.36 57.85 3h0m s GLN 266 Cb -0.11 -3.07 0.52 0.00 1.00 0.00 0.00 33.01 31.35 3h0m s GLN 266 CO 0.09 -0.28 1.84 -1.35 -2.12 0.00 0.00 175.29 173.48 3h0m h PRO 267 N 3.67 0.98 -0.90 2.91 0.11 -1.99 0.29 132.00 137.07 3h0m h PRO 267 Ca -0.49 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.58 3h0m h PRO 267 Cb 1.23 -0.22 -0.05 0.00 0.11 0.00 0.00 31.00 32.07 3h0m h PRO 267 CO 0.68 0.65 0.60 1.96 -0.21 0.00 0.00 178.00 181.67 3h0m h GLN 268 N 1.01 1.18 -0.05 1.05 7.50 -1.97 -0.03 115.11 123.80 3h0m h GLN 268 Ca 0.48 -0.07 -0.02 0.00 0.50 0.00 0.00 58.65 59.55 3h0m h GLN 268 Cb 0.43 -0.27 -0.00 0.00 0.05 0.00 0.00 27.48 27.69 3h0m h GLN 268 CO -0.25 0.78 -0.03 0.28 -1.50 0.00 0.00 178.83 178.11 3h0m h VAL 269 N 1.22 1.33 -0.25 -0.54 2.07 -1.35 -1.35 116.25 117.38 3h0m h VAL 269 Ca 0.33 -1.04 0.05 0.00 0.82 0.00 0.00 66.70 66.87 3h0m h VAL 269 Cb -0.13 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.51 3h0m h VAL 269 CO -0.07 0.28 -0.10 0.50 0.02 0.00 0.00 177.57 178.20 3h0m h LYS 270 N -0.28 -0.05 -0.18 1.57 3.64 -0.87 0.15 116.57 120.55 3h0m h LYS 270 Ca 0.01 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 3h0m h LYS 270 Cb 0.47 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.24 3h0m h LYS 270 CO 0.01 -0.03 -0.18 0.93 -2.27 0.00 0.00 179.45 177.90 3h0m h GLU 271 N -0.05 -0.20 -0.74 1.90 5.08 -1.00 0.80 114.58 120.37 3h0m h GLU 271 Ca 0.13 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.60 3h0m h GLU 271 Cb 0.24 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.47 3h0m h GLU 271 CO -0.29 -0.13 0.39 0.00 -1.00 0.00 0.00 179.01 177.98 3h0m h ALA 272 N 0.86 1.03 -0.12 3.43 0.00 -0.84 -1.92 119.26 121.70 3h0m h ALA 272 Ca 0.11 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3h0m h ALA 272 Cb 0.38 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3h0m h ALA 272 CO -0.30 -0.00 -0.11 0.35 0.00 0.00 0.00 179.25 179.19 3h0m h PHE 273 N 0.66 0.34 -0.90 0.00 3.57 -0.15 -2.10 116.94 118.37 3h0m h PHE 273 Ca 0.36 -0.10 0.09 0.00 3.53 0.00 0.00 57.97 61.85 3h0m h PHE 273 Cb 0.36 -0.07 -0.07 0.00 2.79 0.00 0.00 35.95 38.95 3h0m h PHE 273 CO -0.09 0.68 0.55 0.93 -2.23 0.00 0.00 178.31 178.15 3h0m h GLU 274 N -0.09 0.90 -0.51 1.11 5.08 -0.73 -0.99 114.58 119.36 3h0m h GLU 274 Ca 0.02 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 3h0m h GLU 274 Cb 0.62 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 3h0m h GLU 274 CO 0.03 0.60 0.06 -0.97 -1.00 0.00 0.00 179.01 177.72 3h0m h ASN 275 N 0.93 0.83 -0.52 1.42 -0.73 -1.33 -0.11 115.58 116.07 3h0m h ASN 275 Ca 0.42 -0.27 0.06 0.00 1.87 0.00 0.00 56.30 58.38 3h0m h ASN 275 Cb 0.33 -0.22 -0.05 0.00 0.27 0.00 0.00 38.32 38.64 3h0m h ASN 275 CO -0.23 0.89 0.22 0.15 -0.37 0.00 0.00 177.43 178.10 3h0m h PHE 276 N 0.73 0.40 -0.14 0.67 3.57 -0.63 0.12 116.94 121.66 3h0m h PHE 276 Ca 0.15 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 3h0m h PHE 276 Cb 0.43 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.07 3h0m h PHE 276 CO 0.03 0.16 -0.08 0.82 -2.23 0.00 0.00 178.31 177.01 3h0m h ILE 277 N 0.43 1.32 -0.93 1.41 1.08 -1.02 -1.37 117.51 118.42 3h0m h ILE 277 Ca 0.24 -1.13 0.05 0.00 -0.39 0.00 0.00 64.86 63.63 3h0m h ILE 277 Cb 0.22 1.76 -0.06 0.00 -3.07 0.00 0.00 36.82 35.67 3h0m h ILE 277 CO -0.21 0.33 0.60 0.11 -0.69 0.00 0.00 178.15 178.28 3h0m h LYS 278 N -0.04 1.10 -0.48 2.37 1.57 -0.86 0.32 116.57 120.55 3h0m h LYS 278 Ca 0.03 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.65 3h0m h LYS 278 Cb 0.55 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 3h0m h LYS 278 CO 0.02 0.73 -0.08 1.49 -0.57 0.00 0.00 179.45 181.04 3h0m h GLU 279 N 1.13 0.85 -0.27 3.15 4.57 -0.89 -0.77 114.58 122.35 3h0m h GLU 279 Ca 0.38 -0.28 -0.10 0.00 -1.18 0.00 0.00 59.36 58.18 3h0m h GLU 279 Cb 0.07 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 3h0m h GLU 279 CO -0.14 0.90 -0.23 -0.07 -1.18 0.00 0.00 179.01 178.30 3h0m h LEU 280 N 0.77 0.67 -0.44 1.64 3.38 -0.55 -2.86 115.31 117.92 3h0m h LEU 280 Ca 0.13 -0.46 0.09 0.00 0.09 0.00 0.00 57.88 57.73 3h0m h LEU 280 Cb 0.58 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.07 3h0m h LEU 280 CO 0.04 0.99 -0.07 -0.08 0.09 0.00 0.00 178.44 179.40 3h0m h GLU 281 N 0.36 0.03 -0.46 1.13 4.81 -0.10 -1.91 114.58 118.44 3h0m h GLU 281 Ca 0.05 -0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.36 3h0m h GLU 281 Cb 0.78 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.13 3h0m h GLU 281 CO 0.06 0.02 0.32 0.87 -0.73 0.00 0.00 179.01 179.55 3h0m h LYS 282 N 0.03 0.26 0.00 1.92 1.57 -1.06 0.18 116.57 119.47 3h0m h LYS 282 Ca 0.21 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3h0m h LYS 282 Cb 0.32 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3h0m h LYS 282 CO -0.42 0.17 0.00 0.39 -0.57 0.00 0.00 179.45 179.02 3h0m n GLU 283 N -4.46 0.52 0.00 3.15 -0.58 -0.75 -4.90 120.64 113.61 3h0m n GLU 283 Ca 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.81 3h0m n GLU 283 Cb 0.34 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.71 3h0m n GLU 283 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h0m n GLY 284 N 1.20 1.08 3.73 0.62 0.00 0.05 -5.08 105.19 106.78 3h0m n GLY 284 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3h0m n GLY 284 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h0m s PHE 285 N -2.00 3.49 -0.03 1.61 0.40 -1.06 -4.65 117.98 115.74 3h0m s PHE 285 Ca 0.00 1.43 -0.29 0.00 -0.60 0.00 0.00 56.93 57.47 3h0m s PHE 285 Cb 0.00 -3.37 -0.03 0.00 0.51 0.00 0.00 43.02 40.13 3h0m s PHE 285 CO 0.00 -1.03 0.95 -2.00 0.70 0.00 0.00 175.22 173.83 3h0m s GLU 286 N 0.30 4.52 -0.20 0.44 2.12 -0.99 -4.31 118.70 120.58 3h0m s GLU 286 Ca 0.54 1.34 -0.05 0.00 0.36 0.00 0.00 54.97 57.16 3h0m s GLU 286 Cb -0.30 -3.47 -0.02 0.00 0.26 0.00 0.00 34.13 30.59 3h0m s GLU 286 CO 0.33 -0.09 -0.01 0.42 -0.54 0.00 0.00 175.26 175.37 3h0m s ILE 287 N 1.18 3.78 0.02 -3.70 -1.09 -1.26 -1.08 121.20 119.04 3h0m s ILE 287 Ca 0.49 -0.37 0.05 0.00 -2.23 0.00 0.00 60.65 58.59 3h0m s ILE 287 Cb -0.20 -2.71 -0.02 0.00 -1.58 0.00 0.00 42.46 37.95 3h0m s ILE 287 CO 0.25 0.43 -0.14 -0.54 -1.23 0.00 0.00 174.94 173.70 3h0m s LYS 288 N 1.12 1.05 0.08 2.79 1.02 0.26 -4.98 119.74 121.08 3h0m s LYS 288 Ca 0.02 -0.65 -0.30 0.00 0.02 0.00 0.00 55.97 55.06 3h0m s LYS 288 Cb -0.14 -1.05 -0.05 0.00 -0.52 0.00 0.00 37.83 36.06 3h0m s LYS 288 CO 0.01 0.27 1.08 -1.21 -0.92 0.00 0.00 175.35 174.59 3h0m s GLU 289 N -0.77 4.54 0.35 1.68 2.02 -1.26 -0.20 118.70 125.06 3h0m s GLU 289 Ca 0.04 1.62 0.09 0.00 0.02 0.00 0.00 54.97 56.74 3h0m s GLU 289 Cb -0.07 -3.36 -0.07 0.00 0.10 0.00 0.00 34.13 30.73 3h0m s GLU 289 CO 0.00 -0.06 -0.08 0.14 0.02 0.00 0.00 175.26 175.29 3h0m s VAL 290 N 0.57 2.19 -0.09 2.63 -7.23 -0.69 -4.80 120.40 112.98 3h0m s VAL 290 Ca 0.53 -2.18 -0.01 0.00 -1.81 0.00 0.00 61.98 58.51 3h0m s VAL 290 Cb -0.26 -2.69 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 3h0m s VAL 290 CO 0.30 -0.18 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.45 3h0m s SER 291 N -3.62 4.98 -0.46 4.85 0.01 -1.26 -0.26 113.70 117.94 3h0m s SER 291 Ca 0.33 0.05 0.04 0.00 1.31 0.00 0.00 55.95 57.68 3h0m s SER 291 Cb 0.03 -1.41 0.16 0.00 0.21 0.00 0.00 66.02 65.02 3h0m s SER 291 CO 0.17 0.35 0.35 -0.76 0.41 0.00 0.00 173.24 173.75 3h0m s LEU 292 N -0.70 2.13 0.61 2.44 1.43 -1.26 -4.67 118.68 118.66 3h0m s LEU 292 Ca 0.11 -3.08 0.38 0.00 -1.03 0.00 0.00 54.13 50.50 3h0m s LEU 292 Cb -0.12 -0.72 2.04 0.00 0.03 0.00 0.00 46.19 47.43 3h0m s LEU 292 CO 0.02 -0.18 2.15 -0.65 0.23 0.00 0.00 176.35 177.92 3h0m h PRO 293 N 5.84 0.00 0.00 1.29 0.11 -1.96 -2.59 132.00 134.69 3h0m h PRO 293 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 3h0m h PRO 293 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 3h0m h PRO 293 CO 0.44 0.00 -1.24 0.72 -0.21 0.00 0.00 178.00 177.71 3h0m n HIS 294 N -2.89 0.00 -0.34 0.65 8.25 -1.26 -4.67 115.22 114.97 3h0m n HIS 294 Ca -0.03 0.00 0.23 0.00 -0.26 0.00 0.00 57.72 57.66 3h0m n HIS 294 Cb 0.14 -0.19 0.50 0.00 1.12 0.00 0.00 29.99 31.56 3h0m n HIS 294 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 3h0m h VAL 295 N 0.00 0.49 -0.10 1.59 -1.51 -1.82 0.17 116.25 115.07 3h0m h VAL 295 Ca 0.00 -0.14 0.03 0.00 -1.23 0.00 0.00 66.70 65.36 3h0m h VAL 295 Cb 0.54 0.06 -0.00 0.00 -2.13 0.00 0.00 31.29 29.76 3h0m h VAL 295 CO 0.00 0.07 0.25 0.07 -1.23 0.00 0.00 177.57 176.73 3h0m h LYS 296 N 0.40 0.00 -0.01 5.19 2.10 -1.83 0.44 116.57 122.86 3h0m h LYS 296 Ca 0.62 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.27 3h0m h LYS 296 Cb 1.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.87 3h0m h LYS 296 CO -0.34 0.00 -0.04 0.66 -2.00 0.00 0.00 179.45 177.73 3h0m n TYR 297 N -3.26 0.00 -0.24 0.07 4.01 0.59 -4.29 117.16 114.05 3h0m n TYR 297 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3h0m n TYR 297 Cb 0.34 -0.06 0.13 0.00 -0.31 0.00 0.00 39.34 39.43 3h0m n TYR 297 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 3h0m h SER 298 N 1.02 0.49 -0.01 7.72 0.02 -0.24 -2.32 113.55 120.23 3h0m h SER 298 Ca 0.00 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3h0m h SER 298 Cb 0.30 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 3h0m h SER 298 CO 0.00 0.29 0.00 0.40 -1.14 0.00 0.00 176.83 176.38 3h0m h ILE 299 N 0.63 1.21 -0.11 3.27 1.08 -1.79 0.23 117.51 122.03 3h0m h ILE 299 Ca 0.33 -0.62 -0.13 0.00 -0.39 0.00 0.00 64.86 64.06 3h0m h ILE 299 Cb 0.31 1.61 -0.01 0.00 -3.07 0.00 0.00 36.82 35.66 3h0m h ILE 299 CO -0.24 0.16 -0.49 1.55 -0.69 0.00 0.00 178.15 178.44 3h0m h PRO 300 N -0.24 0.28 -0.34 2.37 0.13 -1.85 -0.56 132.00 131.79 3h0m h PRO 300 Ca 0.00 -0.16 0.02 0.00 -0.87 0.00 0.00 66.00 65.00 3h0m h PRO 300 Cb 0.26 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.38 3h0m h PRO 300 CO 0.00 0.71 0.17 1.15 -0.23 0.00 0.00 178.00 179.80 3h0m h THR 301 N 0.23 0.99 -0.33 1.56 2.02 -1.25 -2.81 112.91 113.31 3h0m h THR 301 Ca 0.01 -0.12 -0.16 0.00 0.77 0.00 0.00 66.41 66.91 3h0m h THR 301 Cb 0.94 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 3h0m h THR 301 CO 0.08 0.07 -0.43 0.22 0.37 0.00 0.00 175.52 175.82 3h0m h TYR 302 N 0.36 1.03 -0.15 3.16 3.20 -0.61 -1.63 116.97 122.32 3h0m h TYR 302 Ca 0.14 -0.32 0.00 0.00 3.14 0.00 0.00 58.73 61.69 3h0m h TYR 302 Cb 0.05 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.11 3h0m h TYR 302 CO -0.10 1.13 0.00 0.66 -1.64 0.00 0.00 178.16 178.21 3h0m n TYR 303 N -4.04 0.41 -0.06 -3.82 4.01 -0.25 -1.13 117.16 112.29 3h0m n TYR 303 Ca -0.03 -0.15 -0.12 0.00 -0.16 0.00 0.00 57.90 57.44 3h0m n TYR 303 Cb 0.56 -0.14 -0.04 0.00 -0.31 0.00 0.00 39.34 39.42 3h0m n TYR 303 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3h0m n ILE 304 N 0.10 0.80 0.18 -0.72 5.41 -0.96 -4.65 119.36 119.52 3h0m n ILE 304 Ca 0.06 -0.11 -0.14 0.00 1.00 0.00 0.00 62.75 63.56 3h0m n ILE 304 Cb 0.37 -1.71 -0.08 0.00 -0.71 0.00 0.00 39.64 37.51 3h0m n ILE 304 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3h0m h ILE 305 N -0.46 0.73 0.52 1.39 2.04 -1.12 -2.50 117.51 118.11 3h0m h ILE 305 Ca -0.28 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 3h0m h ILE 305 Cb 1.16 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 3h0m h ILE 305 CO -0.17 0.02 -0.44 0.00 0.00 0.00 0.00 178.15 177.57 3h0m h ALA 306 N 0.27 -1.02 -0.54 1.87 0.00 -1.39 -1.73 119.26 116.73 3h0m h ALA 306 Ca -0.04 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 54.81 3h0m h ALA 306 Cb 0.33 0.61 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 3h0m h ALA 306 CO 0.06 -1.10 0.37 -1.35 0.00 0.00 0.00 179.25 177.23 3h0m h PRO 307 N -0.95 0.20 0.79 0.00 0.11 -1.76 0.34 132.00 130.74 3h0m h PRO 307 Ca -0.06 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.00 3h0m h PRO 307 Cb 0.81 -0.05 0.01 0.00 0.11 0.00 0.00 31.00 31.88 3h0m h PRO 307 CO -0.02 0.13 -0.38 0.77 -0.21 0.00 0.00 178.00 178.30 3h0m h SER 308 N 0.21 -0.90 -0.46 -2.05 0.02 -0.93 -1.65 113.55 107.79 3h0m h SER 308 Ca 0.25 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.26 3h0m h SER 308 Cb 0.72 0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.47 3h0m h SER 308 CO -0.05 -0.54 0.31 -0.33 -1.14 0.00 0.00 176.83 175.08 3h0m h GLU 309 N -1.26 0.49 -0.50 3.45 5.08 -1.17 -1.64 114.58 119.04 3h0m h GLU 309 Ca -0.11 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.23 3h0m h GLU 309 Cb 0.82 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 3h0m h GLU 309 CO 0.18 0.32 0.32 0.00 -1.00 0.00 0.00 179.01 178.83 3h0m h ALA 310 N 1.73 0.63 -0.33 3.43 0.00 -0.62 0.83 119.26 124.94 3h0m h ALA 310 Ca 0.19 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 3h0m h ALA 310 Cb 0.12 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3h0m h ALA 310 CO -0.05 0.04 -0.05 0.66 0.00 0.00 0.00 179.25 179.86 3h0m h SER 311 N 0.64 0.50 -0.01 0.00 4.64 -0.32 -0.86 113.55 118.15 3h0m h SER 311 Ca 0.19 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 3h0m h SER 311 Cb -0.04 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 3h0m h SER 311 CO -0.06 0.60 -0.02 -1.28 -0.87 0.00 0.00 176.83 175.20 3h0m h SER 312 N 0.50 0.03 0.57 4.97 0.87 -1.21 -3.13 113.55 116.15 3h0m h SER 312 Ca 0.10 -0.65 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 3h0m h SER 312 Cb 0.39 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 3h0m h SER 312 CO 0.02 0.67 0.00 0.78 -0.53 0.00 0.00 176.83 177.77 3h0m h ASN 313 N -0.61 0.00 -0.42 6.23 2.35 -0.63 -2.49 115.58 120.01 3h0m h ASN 313 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3h0m h ASN 313 Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.04 3h0m h ASN 313 CO 0.00 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.96 3h0m n LEU 314 N -2.91 3.49 0.25 1.61 4.32 -0.35 -4.32 117.00 119.10 3h0m n LEU 314 Ca -0.01 -1.53 0.12 0.00 -0.02 0.00 0.00 56.01 54.58 3h0m n LEU 314 Cb 0.20 -0.27 0.63 0.00 -1.62 0.00 0.00 43.42 42.35 3h0m n LEU 314 CO 0.22 0.76 0.91 0.00 -1.22 0.00 0.00 177.39 178.07 3h0m h ALA 315 N 4.50 1.15 0.00 -1.18 0.00 -1.38 -3.11 119.26 119.24 3h0m h ALA 315 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3h0m h ALA 315 Cb 0.98 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3h0m h ALA 315 CO 0.00 0.20 0.00 0.07 0.00 0.00 0.00 179.25 179.52 3h0m h ARG 316 N 0.00 0.00 -5.62 0.00 0.11 -1.80 -3.41 114.38 103.67 3h0m h ARG 316 Ca -0.00 0.00 -0.62 0.00 0.10 0.00 0.00 59.98 59.46 3h0m h ARG 316 Cb 0.51 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 31.45 3h0m h ARG 316 CO 0.02 0.00 0.71 0.71 0.10 0.00 0.00 179.97 181.52 3h0m s TYR 317 N -3.28 2.63 0.00 4.08 2.02 -1.18 -4.71 117.35 116.92 3h0m s TYR 317 Ca 0.07 -0.54 0.00 0.00 -0.37 0.00 0.00 57.07 56.22 3h0m s TYR 317 Cb 0.10 -4.38 0.00 0.00 -0.40 0.00 0.00 41.96 37.28 3h0m s TYR 317 CO 0.54 -1.73 0.07 -0.40 -1.57 0.00 0.00 175.55 172.46 3h0m n ASP 318 N 7.99 0.00 0.00 2.29 5.68 -1.26 -4.80 116.55 126.44 3h0m n ASP 318 Ca 0.02 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.31 3h0m n ASP 318 Cb 0.47 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 3h0m n ASP 318 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h0m n GLY 319 N 0.00 0.51 0.08 6.12 0.00 -1.25 -4.62 105.19 106.03 3h0m n GLY 319 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3h0m n GLY 319 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3h0m n VAL 320 N -2.99 1.46 0.15 1.61 0.31 -1.26 -4.76 118.33 112.85 3h0m n VAL 320 Ca 0.00 0.16 0.10 0.00 -0.01 0.00 0.00 64.34 64.59 3h0m n VAL 320 Cb 0.00 -2.34 -0.16 0.00 -0.91 0.00 0.00 33.84 30.43 3h0m n VAL 320 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3h0m n ARG 321 N -4.54 0.57 -3.79 5.55 1.74 -1.26 -5.04 116.66 109.90 3h0m n ARG 321 Ca -0.13 -0.16 -0.04 0.00 -0.77 0.00 0.00 57.85 56.75 3h0m n ARG 321 Cb 0.40 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 3h0m n ARG 321 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 3h0m s TYR 322 N -3.38 -0.08 0.00 -1.55 1.13 -1.26 -5.17 117.35 107.03 3h0m s TYR 322 Ca -0.05 -0.28 0.00 0.00 -1.41 0.00 0.00 57.07 55.33 3h0m s TYR 322 Cb 0.14 0.67 0.00 0.00 -1.10 0.00 0.00 41.96 41.67 3h0m s TYR 322 CO 0.87 -0.93 0.00 0.41 -2.51 0.00 0.00 175.55 173.40 3h0m n GLY 323 N -0.51 0.36 3.77 5.49 0.00 -1.26 -4.26 105.19 108.77 3h0m n GLY 323 Ca -0.05 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 3h0m n GLY 323 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3h0m s TYR 324 N 0.00 2.84 -0.04 1.61 5.04 -0.84 -4.90 117.35 121.05 3h0m s TYR 324 Ca 0.00 1.39 -0.01 0.00 -2.44 0.00 0.00 57.07 56.01 3h0m s TYR 324 Cb 0.00 -3.71 0.03 0.00 0.35 0.00 0.00 41.96 38.63 3h0m s TYR 324 CO 0.00 -2.13 0.02 0.50 -1.34 0.00 0.00 175.55 172.60 3h0m s ARG 325 N -2.14 0.19 0.59 4.97 3.52 -1.26 -3.89 118.95 120.93 3h0m s ARG 325 Ca 0.55 0.20 -0.18 0.00 -0.13 0.00 0.00 55.73 56.17 3h0m s ARG 325 Cb -0.39 -0.56 -0.06 0.00 -1.56 0.00 0.00 34.95 32.38 3h0m s ARG 325 CO 0.51 -0.24 0.73 0.00 -0.81 0.00 0.00 175.30 175.50 3h0m n ALA 326 N 4.73 -0.52 0.12 6.12 0.00 -1.26 -4.94 120.51 124.75 3h0m n ALA 326 Ca -0.15 -0.02 -0.19 0.00 0.00 0.00 0.00 53.44 53.08 3h0m n ALA 326 Cb 0.50 -1.96 -0.14 0.00 0.00 0.00 0.00 19.45 17.85 3h0m n ALA 326 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3h0m h LYS 327 N 0.31 0.38 -5.25 0.00 1.57 -1.98 -3.46 116.57 108.14 3h0m h LYS 327 Ca -0.47 -0.62 -0.67 0.00 -1.87 0.00 0.00 60.65 57.02 3h0m h LYS 327 Cb 1.38 0.23 -0.31 0.00 0.08 0.00 0.00 32.23 33.61 3h0m h LYS 327 CO 0.49 1.29 -0.82 -1.21 -0.57 0.00 0.00 179.45 178.63 3h0m s GLU 328 N -2.69 3.19 -0.23 3.15 2.02 -1.26 -5.10 118.70 117.79 3h0m s GLU 328 Ca -0.06 -0.77 -0.27 0.00 0.02 0.00 0.00 54.97 53.89 3h0m s GLU 328 Cb 0.06 -2.54 0.09 0.00 0.10 0.00 0.00 34.13 31.84 3h0m s GLU 328 CO 0.90 0.08 0.85 1.52 0.02 0.00 0.00 175.26 178.64 3h0m s TYR 329 N 0.63 -0.61 -0.17 1.61 1.13 -1.26 -4.87 117.35 113.82 3h0m s TYR 329 Ca -0.09 1.39 0.22 0.00 -1.41 0.00 0.00 57.07 57.17 3h0m s TYR 329 Cb -0.16 0.35 -0.11 0.00 -1.10 0.00 0.00 41.96 40.94 3h0m s TYR 329 CO 0.03 -0.36 0.85 1.63 -2.51 0.00 0.00 175.55 175.19 3h0m n LYS 330 N 2.01 0.62 -3.93 -3.49 5.02 -1.26 -4.93 118.16 112.19 3h0m n LYS 330 Ca -0.14 0.05 -0.09 0.00 -2.02 0.00 0.00 58.31 56.11 3h0m n LYS 330 Cb 0.56 -1.74 -0.03 0.00 -0.02 0.00 0.00 35.03 33.80 3h0m n LYS 330 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 3h0m s ASP 331 N -5.19 0.03 0.38 4.39 1.47 -1.26 -5.04 116.67 111.46 3h0m s ASP 331 Ca -0.03 -0.97 0.07 0.00 1.18 0.00 0.00 52.55 52.80 3h0m s ASP 331 Cb 0.10 0.69 0.80 0.00 -0.34 0.00 0.00 42.92 44.17 3h0m s ASP 331 CO 0.82 -1.34 2.00 -0.29 0.68 0.00 0.00 175.17 177.05 3h0m h ILE 332 N 2.11 1.06 0.39 2.11 6.09 -1.98 -0.22 117.51 127.06 3h0m h ILE 332 Ca -0.26 -0.23 -0.02 0.00 -1.37 0.00 0.00 64.86 62.98 3h0m h ILE 332 Cb 1.25 0.33 0.00 0.00 0.47 0.00 0.00 36.82 38.87 3h0m h ILE 332 CO 0.34 0.12 -0.19 0.15 -3.07 0.00 0.00 178.15 175.50 3h0m h PHE 333 N 0.67 -0.48 -0.96 2.19 3.57 -1.99 0.54 116.94 120.48 3h0m h PHE 333 Ca 0.24 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.74 3h0m h PHE 333 Cb 0.13 0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.99 3h0m h PHE 333 CO -0.00 -0.29 0.61 0.93 -2.23 0.00 0.00 178.31 177.33 3h0m h GLU 334 N -0.53 1.28 -0.31 1.11 5.08 -1.88 0.10 114.58 119.43 3h0m h GLU 334 Ca -0.05 -0.09 0.05 0.00 -1.00 0.00 0.00 59.36 58.26 3h0m h GLU 334 Cb 0.41 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 3h0m h GLU 334 CO 0.09 0.86 0.05 1.98 -1.00 0.00 0.00 179.01 180.99 3h0m h MET 335 N 1.31 0.15 0.61 2.33 4.05 -0.59 0.49 114.93 123.27 3h0m h MET 335 Ca 0.35 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.73 3h0m h MET 335 Cb -0.11 -0.03 0.01 0.00 -0.80 0.00 0.00 31.60 30.66 3h0m h MET 335 CO -0.07 0.10 -0.29 1.88 0.23 0.00 0.00 176.91 178.75 3h0m h TYR 336 N 0.15 -0.76 0.00 1.39 0.05 -0.10 -1.79 116.97 115.90 3h0m h TYR 336 Ca 0.14 -0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.82 3h0m h TYR 336 Cb 0.16 0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 3h0m h TYR 336 CO -0.18 -0.47 -0.41 0.00 -1.05 0.00 0.00 178.16 176.05 3h0m h ALA 337 N -0.45 1.00 0.13 3.88 0.00 -0.50 -2.55 119.26 120.78 3h0m h ALA 337 Ca -0.08 -0.37 -0.26 0.00 0.00 0.00 0.00 54.91 54.20 3h0m h ALA 337 Cb 0.64 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.37 3h0m h ALA 337 CO 0.14 0.51 -1.26 0.00 0.00 0.00 0.00 179.25 178.64 3h0m h ARG 338 N 0.00 0.27 -0.75 0.00 3.08 -0.94 -2.24 114.38 113.80 3h0m h ARG 338 Ca -0.00 -0.47 0.16 0.00 0.07 0.00 0.00 59.98 59.74 3h0m h ARG 338 Cb 0.92 0.17 -0.11 0.00 0.08 0.00 0.00 29.97 31.03 3h0m h ARG 338 CO 0.05 1.22 0.20 1.15 -1.07 0.00 0.00 179.97 181.53 3h0m h THR 339 N -0.30 0.51 0.01 2.04 2.02 -1.25 -1.02 112.91 114.93 3h0m h THR 339 Ca -0.26 -0.10 -0.09 0.00 0.77 0.00 0.00 66.41 66.74 3h0m h THR 339 Cb 1.75 0.20 0.01 0.00 -1.74 0.00 0.00 68.15 68.37 3h0m h THR 339 CO 0.09 0.05 -0.35 0.03 0.37 0.00 0.00 175.52 175.72 3h0m h ARG 340 N 0.28 0.22 -0.61 6.66 3.08 -1.54 0.14 114.38 122.61 3h0m h ARG 340 Ca 0.43 -0.25 0.03 0.00 0.07 0.00 0.00 59.98 60.26 3h0m h ARG 340 Cb 0.74 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.83 3h0m h ARG 340 CO -0.51 0.99 0.40 0.22 -1.07 0.00 0.00 179.97 180.00 3h0m h ASP 341 N -0.45 0.64 0.88 7.04 3.58 -1.29 -1.09 116.42 125.73 3h0m h ASP 341 Ca -0.05 -0.01 -0.22 0.00 0.42 0.00 0.00 57.03 57.17 3h0m h ASP 341 Cb 1.12 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.99 3h0m h ASP 341 CO 0.07 0.45 -1.18 -0.33 -2.88 0.00 0.00 179.24 175.36 3h0m h GLU 342 N 0.75 0.00 0.00 0.28 5.08 -1.16 -3.37 114.58 116.15 3h0m h GLU 342 Ca 0.24 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.44 3h0m h GLU 342 Cb 0.04 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 3h0m h GLU 342 CO -0.06 0.74 -1.47 0.41 -1.00 0.00 0.00 179.01 177.63 3h0m n GLY 343 N 1.40 -1.19 3.80 -3.84 0.00 0.47 -4.84 105.19 100.99 3h0m n GLY 343 Ca -0.05 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 3h0m n GLY 343 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h0m s PHE 344 N -2.94 3.62 1.01 1.61 0.08 -0.44 -1.61 117.98 119.31 3h0m s PHE 344 Ca -0.03 0.84 -0.12 0.00 0.12 0.00 0.00 56.93 57.73 3h0m s PHE 344 Cb 0.09 -2.31 0.20 0.00 -0.57 0.00 0.00 43.02 40.43 3h0m s PHE 344 CO 0.81 0.49 1.09 0.20 -0.10 0.00 0.00 175.22 177.71 3h0m s GLY 345 N -0.45 1.56 0.17 4.36 0.00 -1.26 -4.81 107.32 106.89 3h0m s GLY 345 Ca 0.22 -0.36 -0.10 0.00 0.00 0.00 0.00 44.72 44.47 3h0m s GLY 345 CO 0.10 0.26 1.64 -0.56 0.00 0.00 0.00 173.10 174.54 3h0m h PRO 346 N -1.94 1.01 -0.45 2.90 0.13 -1.97 -0.32 132.00 131.36 3h0m h PRO 346 Ca -0.55 -0.31 -0.08 0.00 -0.87 0.00 0.00 66.00 64.20 3h0m h PRO 346 Cb 1.33 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 3h0m h PRO 346 CO 0.57 0.99 -0.02 1.49 -0.23 0.00 0.00 178.00 180.80 3h0m h GLU 347 N 0.91 0.81 -0.24 0.86 4.57 -1.95 -1.50 114.58 118.03 3h0m h GLU 347 Ca 0.17 -0.27 0.03 0.00 -1.18 0.00 0.00 59.36 58.12 3h0m h GLU 347 Cb 0.51 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 3h0m h GLU 347 CO 0.02 0.88 0.03 0.28 -1.18 0.00 0.00 179.01 179.04 3h0m h VAL 348 N 0.65 0.87 -0.92 0.32 2.07 -1.84 -1.95 116.25 115.45 3h0m h VAL 348 Ca 0.12 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.65 3h0m h VAL 348 Cb 0.53 0.74 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 3h0m h VAL 348 CO 0.03 0.02 0.59 0.11 0.02 0.00 0.00 177.57 178.34 3h0m h LYS 349 N 0.12 1.07 -0.71 1.57 1.57 -0.84 -1.54 116.57 117.81 3h0m h LYS 349 Ca 0.11 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3h0m h LYS 349 Cb 0.12 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 3h0m h LYS 349 CO -0.16 0.71 0.41 0.00 -0.57 0.00 0.00 179.45 179.84 3h0m h ARG 350 N 1.10 0.97 0.00 3.15 3.08 -0.66 -1.47 114.38 120.56 3h0m h ARG 350 Ca 0.38 -0.10 -0.16 0.00 0.07 0.00 0.00 59.98 60.18 3h0m h ARG 350 Cb 0.09 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 3h0m h ARG 350 CO -0.15 0.70 -0.74 0.00 -1.07 0.00 0.00 179.97 178.72 3h0m h ARG 351 N 0.97 0.00 -0.07 0.04 3.08 -1.04 -1.62 114.38 115.75 3h0m h ARG 351 Ca 0.25 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 3h0m h ARG 351 Cb -0.01 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 3h0m h ARG 351 CO -0.04 0.74 0.02 0.82 -1.07 0.00 0.00 179.97 180.43 3h0m h ILE 352 N 0.00 1.18 0.25 2.04 2.04 -1.03 0.60 117.51 122.59 3h0m h ILE 352 Ca -0.01 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 3h0m h ILE 352 Cb 1.40 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.89 3h0m h ILE 352 CO 0.10 0.15 -0.20 0.24 0.00 0.00 0.00 178.15 178.44 3h0m h MET 353 N -0.10 -0.45 -0.56 2.37 2.86 -1.20 -1.09 114.93 116.76 3h0m h MET 353 Ca 0.02 0.03 0.10 0.00 -2.06 0.00 0.00 59.70 57.79 3h0m h MET 353 Cb 0.22 0.10 -0.08 0.00 0.06 0.00 0.00 31.60 31.91 3h0m h MET 353 CO -0.00 -0.30 0.14 1.25 1.06 0.00 0.00 176.91 179.06 3h0m h LEU 354 N -0.46 0.04 -0.34 1.22 5.85 -1.31 -2.43 115.31 117.89 3h0m h LEU 354 Ca -0.01 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3h0m h LEU 354 Cb 0.41 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 3h0m h LEU 354 CO -0.02 0.04 0.13 1.23 -0.34 0.00 0.00 178.44 179.48 3h0m h GLY 355 N 0.28 0.54 2.00 3.75 0.00 -0.50 -0.60 103.07 108.54 3h0m h GLY 355 Ca 0.29 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3h0m h GLY 355 CO -0.36 0.28 -0.18 0.00 0.00 0.00 0.00 176.54 176.28 3h0m h THR 356 N 0.39 1.01 0.28 4.70 1.03 -1.01 -1.99 112.91 117.33 3h0m h THR 356 Ca 0.11 -0.64 -0.01 0.00 -0.01 0.00 0.00 66.41 65.86 3h0m h THR 356 Cb 0.19 1.36 0.00 0.00 -1.07 0.00 0.00 68.15 68.63 3h0m h THR 356 CO -0.01 0.18 -0.13 0.15 -0.01 0.00 0.00 175.52 175.69 3h0m h PHE 357 N 0.00 -0.34 -0.34 0.00 3.04 -1.15 -2.69 116.94 115.46 3h0m h PHE 357 Ca -0.00 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.04 3h0m h PHE 357 Cb 0.34 0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 3h0m h PHE 357 CO 0.00 0.01 0.43 0.00 -2.02 0.00 0.00 178.31 176.74 3h0m h ALA 358 N -0.46 1.99 0.00 2.41 0.00 -0.61 0.21 119.26 122.81 3h0m h ALA 358 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3h0m h ALA 358 Cb 0.51 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3h0m h ALA 358 CO 0.06 -0.61 -1.21 1.28 0.00 0.00 0.00 179.25 178.78 3h0m n LEU 359 N -3.57 0.66 -4.77 0.00 4.77 -0.79 -3.58 117.00 109.71 3h0m n LEU 359 Ca 0.06 -0.36 -0.41 0.00 -0.03 0.00 0.00 56.01 55.27 3h0m n LEU 359 Cb 0.59 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.67 3h0m n LEU 359 CO 0.25 0.16 1.17 -0.94 -1.33 0.00 0.00 177.39 176.70 3h0m s SER 360 N -3.26 6.36 0.35 -1.43 1.04 0.06 -4.60 113.70 112.22 3h0m s SER 360 Ca 0.03 3.02 -0.28 0.00 0.48 0.00 0.00 55.95 59.19 3h0m s SER 360 Cb 0.14 -2.66 -0.11 0.00 0.10 0.00 0.00 66.02 63.49 3h0m s SER 360 CO 0.81 -0.88 1.47 0.00 0.98 0.00 0.00 173.24 175.62 3h0m n ALA 361 N 0.95 2.16 0.00 5.32 0.00 -1.26 -0.75 120.51 126.92 3h0m n ALA 361 Ca 0.03 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3h0m n ALA 361 Cb 0.39 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.45 3h0m n ALA 361 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0m n GLY 362 N 0.89 3.11 0.00 0.00 0.00 -1.26 -4.73 105.19 103.19 3h0m n GLY 362 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3h0m n GLY 362 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3h0m n TYR 363 N -0.49 0.00 -0.24 1.61 4.01 -0.41 -4.77 117.16 116.87 3h0m n TYR 363 Ca 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 3h0m n TYR 363 Cb 0.00 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.13 3h0m n TYR 363 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 3h0m h TYR 364 N 0.00 0.73 -0.51 -0.72 5.03 -1.02 -0.76 116.97 119.72 3h0m h TYR 364 Ca 0.00 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.33 3h0m h TYR 364 Cb 0.00 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 38.03 3h0m h TYR 364 CO 0.00 0.36 0.29 -0.44 -1.32 0.00 0.00 178.16 177.05 3h0m h ASP 365 N 0.73 0.63 1.32 -2.11 3.32 -1.86 -0.44 116.42 118.01 3h0m h ASP 365 Ca 0.31 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.19 3h0m h ASP 365 Cb 0.17 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 3h0m h ASP 365 CO -0.18 0.52 -0.40 0.00 -1.72 0.00 0.00 179.24 177.47 3h0m h ALA 366 N 1.13 0.80 -3.00 3.45 0.00 -1.81 -2.55 119.26 117.28 3h0m h ALA 366 Ca 0.18 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3h0m h ALA 366 Cb 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3h0m h ALA 366 CO -0.03 0.50 0.00 0.66 0.00 0.00 0.00 179.25 180.38 3h0m n TYR 367 N -3.29 0.00 0.07 0.00 4.02 -0.31 -4.51 117.16 113.13 3h0m n TYR 367 Ca 0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.79 3h0m n TYR 367 Cb 0.63 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.90 3h0m n TYR 367 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 3h0m h TYR 368 N 0.00 -0.34 -0.30 -0.72 3.20 -1.47 0.71 116.97 118.05 3h0m h TYR 368 Ca 0.00 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 3h0m h TYR 368 Cb 0.00 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 3h0m h TYR 368 CO 0.00 -0.20 0.14 1.25 -1.64 0.00 0.00 178.16 177.71 3h0m h LEU 369 N -0.24 0.39 -0.43 2.82 5.85 -1.29 -1.08 115.31 121.33 3h0m h LEU 369 Ca 0.04 -0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.71 3h0m h LEU 369 Cb 0.28 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 3h0m h LEU 369 CO -0.11 0.42 -0.02 0.50 -0.34 0.00 0.00 178.44 178.88 3h0m h LYS 370 N 0.35 0.08 -0.56 1.25 1.63 -1.21 -2.04 116.57 116.07 3h0m h LYS 370 Ca 0.10 -0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.89 3h0m h LYS 370 Cb 0.13 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.71 3h0m h LYS 370 CO -0.01 0.05 0.33 0.00 -3.45 0.00 0.00 179.45 176.37 3h0m h ALA 371 N 1.39 1.53 0.00 5.00 0.00 -0.48 -0.43 119.26 126.27 3h0m h ALA 371 Ca 0.22 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3h0m h ALA 371 Cb 0.32 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h0m h ALA 371 CO -0.38 0.41 -0.10 1.96 0.00 0.00 0.00 179.25 181.14 3h0m h GLN 372 N 0.77 0.00 0.00 0.00 1.08 -0.60 -0.47 115.11 115.89 3h0m h GLN 372 Ca 0.20 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.40 3h0m h GLN 372 Cb -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.41 3h0m h GLN 372 CO -0.04 0.10 -0.00 0.87 -0.95 0.00 0.00 178.83 178.81 3h0m h LYS 373 N 0.00 -0.00 -0.76 1.46 1.57 -0.53 -3.19 116.57 115.11 3h0m h LYS 373 Ca -0.00 0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.97 3h0m h LYS 373 Cb 0.82 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.09 3h0m h LYS 373 CO 0.01 0.84 0.53 0.28 -0.57 0.00 0.00 179.45 180.54 3h0m h VAL 374 N -0.98 0.70 0.00 0.50 2.07 -1.09 0.14 116.25 117.59 3h0m h VAL 374 Ca -0.00 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.38 3h0m h VAL 374 Cb 0.84 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3h0m h VAL 374 CO 0.00 0.04 -0.32 -0.09 0.02 0.00 0.00 177.57 177.22 3h0m h ARG 375 N 0.21 0.00 0.05 1.57 2.43 -1.15 -1.67 114.38 115.81 3h0m h ARG 375 Ca 0.38 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 59.30 3h0m h ARG 375 Cb 1.16 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.72 3h0m h ARG 375 CO -0.08 0.32 -1.06 -0.09 -1.51 0.00 0.00 179.97 177.55 3h0m h ARG 376 N 0.00 0.42 -0.22 0.20 2.43 -0.73 -1.99 114.38 114.49 3h0m h ARG 376 Ca -0.00 -0.52 0.05 0.00 -0.81 0.00 0.00 59.98 58.69 3h0m h ARG 376 Cb 0.59 0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 30.26 3h0m h ARG 376 CO 0.04 1.18 -0.08 -0.07 -1.51 0.00 0.00 179.97 179.54 3h0m h LEU 377 N 0.21 -0.26 -0.64 3.80 3.38 -1.06 -0.19 115.31 120.53 3h0m h LEU 377 Ca -0.11 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 3h0m h LEU 377 Cb 1.72 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 3h0m h LEU 377 CO 0.19 -0.10 0.29 0.40 0.09 0.00 0.00 178.44 179.31 3h0m h ILE 378 N -0.03 1.23 -0.69 1.22 2.04 -1.32 -0.23 117.51 119.73 3h0m h ILE 378 Ca 0.11 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.31 3h0m h ILE 378 Cb 0.20 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 3h0m h ILE 378 CO -0.25 0.27 0.43 0.74 0.00 0.00 0.00 178.15 179.34 3h0m h THR 379 N 0.89 1.19 -0.57 -0.27 2.02 -1.14 -2.80 112.91 112.23 3h0m h THR 379 Ca 0.22 -0.39 -0.11 0.00 0.77 0.00 0.00 66.41 66.90 3h0m h THR 379 Cb 0.15 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 3h0m h THR 379 CO -0.02 0.19 -0.06 0.78 0.37 0.00 0.00 175.52 176.77 3h0m h ASN 380 N 0.93 1.03 -0.74 4.18 2.35 -0.26 -1.81 115.58 121.27 3h0m h ASN 380 Ca 0.25 -0.32 0.14 0.00 -0.55 0.00 0.00 56.30 55.82 3h0m h ASN 380 Cb -0.06 -0.28 -0.14 0.00 0.05 0.00 0.00 38.32 37.90 3h0m h ASN 380 CO -0.05 1.11 -0.27 0.44 -1.65 0.00 0.00 177.43 177.01 3h0m h ASP 381 N 0.93 -0.96 -0.09 5.81 3.32 -0.82 -1.49 116.42 123.13 3h0m h ASP 381 Ca 0.15 0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 3h0m h ASP 381 Cb 0.62 0.55 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 3h0m h ASP 381 CO 0.04 -0.28 0.02 -0.26 -1.72 0.00 0.00 179.24 177.04 3h0m h PHE 382 N -0.06 0.15 -0.54 4.55 0.04 -1.17 -0.90 116.94 119.01 3h0m h PHE 382 Ca 0.32 -0.02 0.04 0.00 2.80 0.00 0.00 57.97 61.12 3h0m h PHE 382 Cb 0.57 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.64 3h0m h PHE 382 CO -0.65 0.32 0.36 -0.07 -0.60 0.00 0.00 178.31 177.66 3h0m h LEU 383 N -0.07 0.50 0.06 1.54 3.38 -0.96 0.11 115.31 119.86 3h0m h LEU 383 Ca 0.03 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3h0m h LEU 383 Cb 0.25 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3h0m h LEU 383 CO 0.00 0.34 -0.03 0.50 0.09 0.00 0.00 178.44 179.34 3h0m h LYS 384 N 0.57 -0.08 -0.97 1.13 3.64 -1.09 -3.11 116.57 116.67 3h0m h LYS 384 Ca 0.23 0.01 0.22 0.00 -1.27 0.00 0.00 60.65 59.83 3h0m h LYS 384 Cb 0.17 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 31.93 3h0m h LYS 384 CO -0.06 0.49 0.63 0.00 -2.27 0.00 0.00 179.45 178.24 3h0m h ALA 385 N 0.10 2.16 0.00 5.00 0.00 -0.70 0.63 119.26 126.45 3h0m h ALA 385 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3h0m h ALA 385 Cb 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3h0m h ALA 385 CO 0.01 -0.49 0.00 1.19 0.00 0.00 0.00 179.25 179.96 3h0m n PHE 386 N -4.58 0.00 0.09 0.00 3.72 0.34 -2.14 117.46 114.90 3h0m n PHE 386 Ca 0.22 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.57 3h0m n PHE 386 Cb 0.75 -0.21 -0.00 0.00 -0.94 0.00 0.00 39.48 39.08 3h0m n PHE 386 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3h0m h GLU 387 N 0.00 0.01 0.00 -1.08 5.08 -0.85 -3.34 114.58 114.39 3h0m h GLU 387 Ca 0.00 -0.01 -0.35 0.00 -1.00 0.00 0.00 59.36 57.99 3h0m h GLU 387 Cb 0.16 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.35 3h0m h GLU 387 CO 0.00 0.85 -2.23 0.39 -1.00 0.00 0.00 179.01 177.02 3h0m n GLU 388 N -3.54 0.68 -4.32 2.33 1.02 -0.91 -5.05 120.64 110.85 3h0m n GLU 388 Ca -0.01 0.07 -0.16 0.00 -0.02 0.00 0.00 57.16 57.04 3h0m n GLU 388 Cb 0.81 -1.59 -0.10 0.00 -0.02 0.00 0.00 31.44 30.54 3h0m n GLU 388 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3h0m s VAL 389 N -2.52 0.81 -0.19 2.62 -7.23 -0.94 -4.97 120.40 107.99 3h0m s VAL 389 Ca -0.10 -2.01 0.11 0.00 -1.81 0.00 0.00 61.98 58.17 3h0m s VAL 389 Cb 0.07 -2.43 -0.19 0.00 0.56 0.00 0.00 36.38 34.39 3h0m s VAL 389 CO 0.82 -0.23 -0.02 0.47 -0.31 0.00 0.00 175.10 175.83 3h0m n ASP 390 N -0.42 1.25 -4.12 4.85 8.00 -0.37 -4.45 116.55 121.29 3h0m n ASP 390 Ca -0.03 -0.04 -0.09 0.00 0.71 0.00 0.00 54.79 55.34 3h0m n ASP 390 Cb 0.65 0.51 -0.10 0.00 -0.02 0.00 0.00 41.12 42.16 3h0m n ASP 390 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3h0m s VAL 391 N -2.42 0.14 -0.08 2.53 -7.23 -0.94 -4.35 120.40 108.04 3h0m s VAL 391 Ca -0.15 -1.84 0.04 0.00 -1.81 0.00 0.00 61.98 58.21 3h0m s VAL 391 Cb 0.06 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 35.13 3h0m s VAL 391 CO 0.64 -0.62 -0.21 -0.63 -0.31 0.00 0.00 175.10 173.97 3h0m s ILE 392 N -4.00 1.83 0.07 -0.62 1.01 -0.42 -1.40 121.20 117.66 3h0m s ILE 392 Ca 0.18 -0.89 0.08 0.00 0.00 0.00 0.00 60.65 60.02 3h0m s ILE 392 Cb 0.07 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 3h0m s ILE 392 CO -0.02 0.51 -0.18 0.00 0.00 0.00 0.00 174.94 175.25 3h0m s ALA 393 N 0.32 2.65 0.23 9.38 0.00 -0.73 -0.20 121.76 133.41 3h0m s ALA 393 Ca -0.15 -1.26 -0.23 0.00 0.00 0.00 0.00 51.96 50.33 3h0m s ALA 393 Cb -0.17 -0.71 0.04 0.00 0.00 0.00 0.00 23.12 22.28 3h0m s ALA 393 CO 0.07 0.58 0.81 -1.54 0.00 0.00 0.00 175.76 175.68 3h0m s SER 394 N -1.74 -0.23 0.62 0.00 1.04 -0.77 -4.55 113.70 108.06 3h0m s SER 394 Ca 0.16 -0.53 -0.18 0.00 0.48 0.00 0.00 55.95 55.89 3h0m s SER 394 Cb -0.11 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.61 3h0m s SER 394 CO 0.07 -1.18 1.01 -2.65 0.98 0.00 0.00 173.24 171.48 3h0m n PRO 395 N -0.46 0.90 0.11 4.02 -0.02 -1.26 -0.07 135.00 138.21 3h0m n PRO 395 Ca -0.05 0.35 -0.04 0.00 -2.02 0.00 0.00 63.50 61.75 3h0m n PRO 395 Cb 0.60 -2.23 0.10 0.00 -0.02 0.00 0.00 33.50 31.95 3h0m n PRO 395 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3h0m h THR 396 N 0.44 1.47 -3.47 3.45 2.02 -1.62 -3.41 112.91 111.78 3h0m h THR 396 Ca -0.49 -2.31 -0.20 0.00 0.77 0.00 0.00 66.41 64.18 3h0m h THR 396 Cb 1.36 2.24 -0.26 0.00 -1.74 0.00 0.00 68.15 69.75 3h0m h THR 396 CO 0.51 0.67 -0.58 -0.89 0.37 0.00 0.00 175.52 175.59 3h0m s THR 397 N -3.48 0.01 -0.11 3.16 2.01 -1.26 -4.41 115.64 111.56 3h0m s THR 397 Ca -0.02 -0.07 0.30 0.00 0.31 0.00 0.00 61.69 62.21 3h0m s THR 397 Cb 0.12 -0.19 0.35 0.00 0.01 0.00 0.00 72.50 72.79 3h0m s THR 397 CO 0.79 -0.04 1.88 1.55 -0.69 0.00 0.00 174.62 178.11 3h0m h PRO 398 N 5.82 0.00 -5.12 4.92 0.13 -1.88 -3.46 132.00 132.41 3h0m h PRO 398 Ca -0.25 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.45 3h0m h PRO 398 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 3h0m h PRO 398 CO 0.43 0.00 -0.62 0.95 -0.23 0.00 0.00 178.00 178.53 3h0m s THR 399 N -3.53 1.01 0.66 1.56 -4.23 -1.26 -0.94 115.64 108.92 3h0m s THR 399 Ca 0.03 -2.01 -0.14 0.00 -1.18 0.00 0.00 61.69 58.39 3h0m s THR 399 Cb 0.09 -2.67 -0.00 0.00 1.34 0.00 0.00 72.50 71.26 3h0m s THR 399 CO 0.51 -0.06 1.08 -0.76 -0.54 0.00 0.00 174.62 174.86 3h0m s LEU 400 N -3.41 3.33 -0.40 4.79 1.43 -1.26 -4.96 118.68 118.20 3h0m s LEU 400 Ca 0.35 1.87 -0.37 0.00 -1.03 0.00 0.00 54.13 54.95 3h0m s LEU 400 Cb 0.08 -4.53 -0.16 0.00 0.03 0.00 0.00 46.19 41.61 3h0m s LEU 400 CO 0.14 -1.54 1.30 -2.65 0.23 0.00 0.00 176.35 173.83 3h0m n PRO 401 N -2.58 0.00 -2.60 1.29 -0.02 -1.26 -4.96 135.00 124.87 3h0m n PRO 401 Ca 0.09 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.34 3h0m n PRO 401 Cb 0.53 -1.19 0.09 0.00 -0.02 0.00 0.00 33.50 32.91 3h0m n PRO 401 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3h0m s PHE 402 N 2.54 1.82 0.28 6.00 -0.12 -1.26 -4.84 117.98 122.39 3h0m s PHE 402 Ca 0.84 -0.23 -0.04 0.00 -0.05 0.00 0.00 56.93 57.45 3h0m s PHE 402 Cb -1.19 -2.92 -0.05 0.00 -0.63 0.00 0.00 43.02 38.23 3h0m s PHE 402 CO 0.64 -1.54 0.53 0.15 -0.05 0.00 0.00 175.22 174.94 3h0m s LYS 403 N -5.06 3.61 0.38 1.99 1.02 -1.26 -1.69 119.74 118.72 3h0m s LYS 403 Ca 0.64 -0.06 -0.26 0.00 0.02 0.00 0.00 55.97 56.31 3h0m s LYS 403 Cb -0.06 -2.68 -0.11 0.00 -0.52 0.00 0.00 37.83 34.45 3h0m s LYS 403 CO 0.43 0.24 1.15 1.19 -0.92 0.00 0.00 175.35 177.45 3h0m n PHE 404 N -0.91 1.73 -0.45 3.18 3.72 -1.21 -1.91 117.46 121.62 3h0m n PHE 404 Ca -0.02 0.57 0.00 0.00 -0.05 0.00 0.00 57.45 57.94 3h0m n PHE 404 Cb 0.54 -2.32 0.00 0.00 -0.94 0.00 0.00 39.48 36.76 3h0m n PHE 404 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h0m n GLY 405 N 0.98 1.70 0.14 1.37 0.00 -1.26 -4.87 105.19 103.25 3h0m n GLY 405 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3h0m n GLY 405 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3h0m h GLU 406 N 2.09 0.00 0.00 1.61 4.81 -1.78 -3.29 114.58 118.01 3h0m h GLU 406 Ca 0.00 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 3h0m h GLU 406 Cb 0.00 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 29.24 3h0m h GLU 406 CO 0.00 0.60 -0.69 0.54 -0.73 0.00 0.00 179.01 178.73 3h0m n ARG 407 N -3.49 0.98 -0.01 1.92 1.74 -1.26 -4.64 116.66 111.91 3h0m n ARG 407 Ca 0.00 -2.80 0.09 0.00 -0.77 0.00 0.00 57.85 54.37 3h0m n ARG 407 Cb 0.68 -1.01 -0.12 0.00 -1.02 0.00 0.00 32.46 30.99 3h0m n ARG 407 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3h0m n LEU 408 N -0.52 0.25 0.13 0.55 4.77 -1.24 -3.86 117.00 117.09 3h0m n LEU 408 Ca 0.14 -0.16 -0.05 0.00 -0.03 0.00 0.00 56.01 55.91 3h0m n LEU 408 Cb 0.86 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.92 3h0m n LEU 408 CO -0.04 0.06 0.41 -0.08 -1.33 0.00 0.00 177.39 176.41 3h0m h GLU 409 N 0.00 -0.33 -4.89 3.23 4.81 -1.82 -3.40 114.58 112.17 3h0m h GLU 409 Ca 0.00 0.02 -0.65 0.00 -0.13 0.00 0.00 59.36 58.61 3h0m h GLU 409 Cb 0.68 0.07 -0.18 0.00 0.63 0.00 0.00 28.75 29.95 3h0m h GLU 409 CO 0.00 -0.22 -0.54 1.21 -0.73 0.00 0.00 179.01 178.74 3h0m s ASN 410 N -2.86 5.86 0.46 1.04 3.84 -1.26 -4.97 114.94 117.04 3h0m s ASN 410 Ca -0.05 -0.09 0.27 0.00 0.21 0.00 0.00 52.86 53.21 3h0m s ASN 410 Cb 0.00 -2.08 1.33 0.00 -0.55 0.00 0.00 41.25 39.95 3h0m s ASN 410 CO 0.15 -0.06 1.77 -0.65 -2.79 0.00 0.00 177.10 175.51 3h0m h PRO 411 N 8.36 0.19 -0.96 0.43 0.11 -1.82 -0.66 132.00 137.65 3h0m h PRO 411 Ca -0.35 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.79 3h0m h PRO 411 Cb 1.18 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 3h0m h PRO 411 CO 0.56 0.13 0.62 0.82 -0.21 0.00 0.00 178.00 179.92 3h0m h ILE 412 N 0.20 1.14 -0.17 4.15 2.04 -1.93 -1.34 117.51 121.59 3h0m h ILE 412 Ca 0.61 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 66.08 3h0m h ILE 412 Cb 1.94 -0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 3h0m h ILE 412 CO -0.19 0.22 0.12 -0.33 0.00 0.00 0.00 178.15 177.96 3h0m h GLU 413 N 1.18 0.17 -0.46 2.37 5.08 -1.41 0.26 114.58 121.77 3h0m h GLU 413 Ca 0.39 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.64 3h0m h GLU 413 Cb 0.05 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3h0m h GLU 413 CO -0.14 0.11 -0.12 1.98 -1.00 0.00 0.00 179.01 179.84 3h0m h MET 414 N 0.17 0.90 -0.80 2.33 4.05 -1.33 -3.23 114.93 117.01 3h0m h MET 414 Ca 0.07 -0.35 -0.02 0.00 -0.28 0.00 0.00 59.70 59.12 3h0m h MET 414 Cb 0.06 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 30.78 3h0m h MET 414 CO -0.01 1.00 0.41 1.88 0.23 0.00 0.00 176.91 180.41 3h0m h TYR 415 N 0.74 1.12 0.00 1.39 0.05 -0.78 -2.55 116.97 116.94 3h0m h TYR 415 Ca 0.12 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.86 3h0m h TYR 415 Cb 0.67 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 38.06 3h0m h TYR 415 CO 0.05 0.80 0.00 1.28 -1.05 0.00 0.00 178.16 179.24 3h0m n LEU 416 N -4.33 0.27 0.27 3.88 4.77 -0.80 -1.17 117.00 119.91 3h0m n LEU 416 Ca 0.08 0.63 0.16 0.00 -0.03 0.00 0.00 56.01 56.84 3h0m n LEU 416 Cb 0.12 -0.66 0.73 0.00 -2.33 0.00 0.00 43.42 41.28 3h0m n LEU 416 CO 0.39 -0.72 0.98 0.28 -1.33 0.00 0.00 177.39 176.99 3h0m h SER 417 N 0.00 0.00 0.01 -1.43 0.02 -1.58 -3.26 113.55 107.31 3h0m h SER 417 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3h0m h SER 417 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3h0m h SER 417 CO 0.00 0.07 -0.18 0.47 -1.14 0.00 0.00 176.83 176.05 3h0m n ASP 418 N -3.27 2.17 0.23 3.07 8.00 -0.31 -4.57 116.55 121.86 3h0m n ASP 418 Ca -0.01 -1.61 0.17 0.00 0.71 0.00 0.00 54.79 54.06 3h0m n ASP 418 Cb 0.28 0.17 0.87 0.00 -0.02 0.00 0.00 41.12 42.42 3h0m n ASP 418 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 3h0m h ILE 419 N 3.12 0.40 -0.01 0.53 3.07 -1.74 0.17 117.51 123.06 3h0m h ILE 419 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 3h0m h ILE 419 Cb 0.77 0.85 0.00 0.00 -0.27 0.00 0.00 36.82 38.17 3h0m h ILE 419 CO 0.00 0.00 -0.48 0.18 -1.05 0.00 0.00 178.15 176.80 3h0m n LEU 420 N -3.68 1.65 -0.10 0.16 4.77 -1.26 -4.61 117.00 113.93 3h0m n LEU 420 Ca 0.01 -0.72 -0.12 0.00 -0.03 0.00 0.00 56.01 55.14 3h0m n LEU 420 Cb 0.29 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.27 3h0m n LEU 420 CO 0.26 0.32 -1.14 0.35 -1.33 0.00 0.00 177.39 175.85 3h0m n THR 421 N -0.31 1.18 0.13 -5.08 -2.24 0.53 -4.62 114.28 103.88 3h0m n THR 421 Ca 0.07 -0.54 0.01 0.00 -2.27 0.00 0.00 64.05 61.32 3h0m n THR 421 Cb 0.38 -1.02 0.33 0.00 -2.10 0.00 0.00 70.33 67.92 3h0m n THR 421 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 3h0m h VAL 422 N 0.00 1.24 -0.90 2.28 -1.51 -1.43 -3.02 116.25 112.91 3h0m h VAL 422 Ca -0.46 -1.12 0.15 0.00 -1.23 0.00 0.00 66.70 64.03 3h0m h VAL 422 Cb 1.82 1.47 -0.07 0.00 -2.13 0.00 0.00 31.29 32.38 3h0m h VAL 422 CO -0.04 0.34 0.58 -0.65 -1.23 0.00 0.00 177.57 176.57 3h0m h PRO 423 N 0.16 0.68 0.00 5.19 0.11 -1.84 -1.29 132.00 135.01 3h0m h PRO 423 Ca 0.02 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 3h0m h PRO 423 Cb 0.58 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 3h0m h PRO 423 CO 0.04 0.45 -0.46 0.00 -0.21 0.00 0.00 178.00 177.82 3h0m h ALA 424 N 1.60 1.16 -0.20 -0.75 0.00 -1.85 -2.20 119.26 117.03 3h0m h ALA 424 Ca 0.46 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3h0m h ALA 424 Cb 0.73 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3h0m h ALA 424 CO -0.21 0.58 -0.21 -0.91 0.00 0.00 0.00 179.25 178.50 3h0m h ASN 425 N 0.00 0.54 -0.52 0.00 4.21 -1.40 0.11 115.58 118.52 3h0m h ASN 425 Ca -0.00 -0.48 0.09 0.00 1.21 0.00 0.00 56.30 57.12 3h0m h ASN 425 Cb 0.86 -0.15 -0.08 0.00 -1.12 0.00 0.00 38.32 37.83 3h0m h ASN 425 CO 0.06 0.91 0.09 -0.07 -1.29 0.00 0.00 177.43 177.12 3h0m h LEU 426 N 0.17 -0.04 -0.42 1.61 3.38 -1.29 -1.44 115.31 117.28 3h0m h LEU 426 Ca 0.03 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3h0m h LEU 426 Cb 0.76 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3h0m h LEU 426 CO 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 178.44 178.58 3h0m n ALA 427 N -2.57 2.64 -1.90 1.53 0.00 -0.84 -4.87 120.51 114.50 3h0m n ALA 427 Ca 0.06 -0.31 -0.17 0.00 0.00 0.00 0.00 53.44 53.02 3h0m n ALA 427 Cb 0.27 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.32 3h0m n ALA 427 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0m n GLY 428 N 1.08 0.71 3.87 0.00 0.00 -0.54 -4.99 105.19 105.33 3h0m n GLY 428 Ca 0.22 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3h0m n GLY 428 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0m s LEU 429 N -4.42 4.09 0.53 0.99 1.43 0.33 -2.11 118.68 119.54 3h0m s LEU 429 Ca 0.00 1.01 -0.21 0.00 -1.03 0.00 0.00 54.13 53.90 3h0m s LEU 429 Cb 0.00 -3.81 -0.05 0.00 0.03 0.00 0.00 46.19 42.36 3h0m s LEU 429 CO 0.00 -0.15 1.25 -2.16 0.23 0.00 0.00 176.35 175.52 3h0m s PRO 430 N -3.04 3.27 -0.20 1.29 0.04 -1.26 -4.58 135.00 130.52 3h0m s PRO 430 Ca 0.49 1.96 -0.15 0.00 0.04 0.00 0.00 61.00 63.35 3h0m s PRO 430 Cb -0.11 -2.19 0.06 0.00 0.04 0.00 0.00 34.50 32.30 3h0m s PRO 430 CO 0.22 -1.00 0.51 0.00 0.04 0.00 0.00 177.00 176.78 3h0m s ALA 431 N -1.47 -1.32 0.03 8.56 0.00 -0.09 -1.74 121.76 125.73 3h0m s ALA 431 Ca 0.71 1.68 0.09 0.00 0.00 0.00 0.00 51.96 54.44 3h0m s ALA 431 Cb -0.33 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 3h0m s ALA 431 CO 0.39 -0.28 -0.25 -1.50 0.00 0.00 0.00 175.76 174.12 3h0m s ILE 432 N 0.95 2.25 -0.20 0.00 2.07 -0.35 -1.53 121.20 124.39 3h0m s ILE 432 Ca -0.05 -1.29 -0.04 0.00 -1.41 0.00 0.00 60.65 57.86 3h0m s ILE 432 Cb -0.06 -1.87 -0.01 0.00 0.13 0.00 0.00 42.46 40.65 3h0m s ILE 432 CO -0.08 0.40 -0.04 -0.55 -1.91 0.00 0.00 174.94 172.76 3h0m s SER 433 N -1.15 4.40 -0.01 4.50 0.15 -0.18 -1.51 113.70 119.91 3h0m s SER 433 Ca 0.12 -0.33 0.06 0.00 0.70 0.00 0.00 55.95 56.50 3h0m s SER 433 Cb -0.10 -1.74 -0.01 0.00 -1.71 0.00 0.00 66.02 62.45 3h0m s SER 433 CO 0.02 0.03 -0.19 0.27 1.20 0.00 0.00 173.24 174.57 3h0m s ILE 434 N 1.17 1.48 0.05 6.45 -4.36 0.49 -1.90 121.20 124.58 3h0m s ILE 434 Ca 0.02 -0.81 -0.31 0.00 -0.26 0.00 0.00 60.65 59.29 3h0m s ILE 434 Cb -0.14 -1.23 -0.06 0.00 1.25 0.00 0.00 42.46 42.27 3h0m s ILE 434 CO -0.01 0.41 1.36 -2.84 0.24 0.00 0.00 174.94 174.10 3h0m s PRO 435 N -0.46 4.32 -0.02 0.37 0.02 -1.26 0.62 135.00 138.60 3h0m s PRO 435 Ca 0.07 1.97 0.04 0.00 0.02 0.00 0.00 61.00 63.10 3h0m s PRO 435 Cb -0.07 -3.41 -0.06 0.00 0.02 0.00 0.00 34.50 30.97 3h0m s PRO 435 CO -0.01 -0.47 0.07 0.44 -0.33 0.00 0.00 177.00 176.71 3h0m n ILE 436 N 4.27 0.09 -3.79 2.83 -5.35 0.78 -4.86 119.36 113.33 3h0m n ILE 436 Ca 0.12 -0.12 -0.04 0.00 -0.27 0.00 0.00 62.75 62.43 3h0m n ILE 436 Cb 0.44 -0.01 -0.01 0.00 -1.74 0.00 0.00 39.64 38.32 3h0m n ILE 436 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h0m s ALA 437 N -2.24 -1.54 -0.10 -1.28 0.00 -1.22 -4.88 121.76 110.50 3h0m s ALA 437 Ca -0.02 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.90 3h0m s ALA 437 Cb 0.02 0.68 0.02 0.00 0.00 0.00 0.00 23.12 23.84 3h0m s ALA 437 CO 0.18 -1.04 -0.12 -1.58 0.00 0.00 0.00 175.76 173.19 3h0m s TRP 438 N -3.12 1.71 -0.11 0.00 0.52 -1.26 -1.60 118.94 115.08 3h0m s TRP 438 Ca 0.14 -0.78 -0.00 0.00 0.02 0.00 0.00 56.10 55.47 3h0m s TRP 438 Cb -0.02 -1.28 0.02 0.00 -1.15 0.00 0.00 33.47 31.04 3h0m s TRP 438 CO 0.04 -0.44 -0.08 0.15 0.02 0.00 0.00 176.95 176.64 3h0m s LYS 439 N 1.11 1.52 -1.43 4.98 -0.14 0.17 -4.68 119.74 121.27 3h0m s LYS 439 Ca -0.05 -0.26 -0.08 0.00 -1.36 0.00 0.00 55.97 54.22 3h0m s LYS 439 Cb -0.14 -1.56 0.04 0.00 -1.68 0.00 0.00 37.83 34.49 3h0m s LYS 439 CO -0.02 -0.24 0.61 -0.25 -0.76 0.00 0.00 175.35 174.69 3h0m n ASP 440 N 4.86 -4.98 0.00 2.83 8.00 -1.26 -2.10 116.55 123.89 3h0m n ASP 440 Ca -0.13 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 54.98 3h0m n ASP 440 Cb 0.50 -4.04 0.00 0.00 -0.02 0.00 0.00 41.12 37.56 3h0m n ASP 440 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h0m n GLY 441 N -1.41 1.06 3.42 0.44 0.00 -1.26 -5.05 105.19 102.40 3h0m n GLY 441 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 3h0m n GLY 441 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0m s LEU 442 N 0.00 2.49 0.67 0.99 1.43 -0.89 -4.90 118.68 118.46 3h0m s LEU 442 Ca 0.00 -0.35 -0.16 0.00 -1.03 0.00 0.00 54.13 52.59 3h0m s LEU 442 Cb 0.00 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.75 3h0m s LEU 442 CO 0.00 0.31 1.16 -2.84 0.23 0.00 0.00 176.35 175.22 3h0m s PRO 443 N -0.89 2.62 -0.04 1.29 0.02 -1.26 -0.66 135.00 136.08 3h0m s PRO 443 Ca 0.12 1.62 0.02 0.00 0.02 0.00 0.00 61.00 62.79 3h0m s PRO 443 Cb -0.10 -1.91 0.01 0.00 0.02 0.00 0.00 34.50 32.52 3h0m s PRO 443 CO 0.01 -1.43 -0.10 0.08 -0.33 0.00 0.00 177.00 175.23 3h0m s VAL 444 N -2.03 0.90 -0.13 3.83 1.01 -0.62 -4.65 120.40 118.71 3h0m s VAL 444 Ca 0.72 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 62.24 3h0m s VAL 444 Cb -0.26 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 3h0m s VAL 444 CO 0.40 0.29 0.12 -0.83 0.00 0.00 0.00 175.10 175.08 3h0m s GLY 445 N 0.43 2.09 -0.13 4.51 0.00 -1.26 -0.15 107.32 112.81 3h0m s GLY 445 Ca -0.08 -0.67 -0.05 0.00 0.00 0.00 0.00 44.72 43.91 3h0m s GLY 445 CO 0.02 -0.29 0.07 -0.32 0.00 0.00 0.00 173.10 172.57 3h0m s GLY 446 N -0.71 1.97 -0.11 0.20 0.00 0.20 -1.71 107.32 107.17 3h0m s GLY 446 Ca 0.13 -0.73 -0.02 0.00 0.00 0.00 0.00 44.72 44.10 3h0m s GLY 446 CO 0.03 -0.29 -0.02 1.62 0.00 0.00 0.00 173.10 174.44 3h0m s GLN 447 N -0.49 3.18 -0.11 2.90 0.74 0.90 -0.38 119.66 126.39 3h0m s GLN 447 Ca 0.10 -0.47 0.03 0.00 0.05 0.00 0.00 55.36 55.07 3h0m s GLN 447 Cb -0.12 -2.80 0.01 0.00 1.10 0.00 0.00 33.01 31.20 3h0m s GLN 447 CO 0.02 0.54 -0.19 -0.51 -0.55 0.00 0.00 175.29 174.60 3h0m s LEU 448 N -0.45 1.93 -0.21 3.68 1.43 -0.57 -1.85 118.68 122.64 3h0m s LEU 448 Ca 0.08 -0.51 -0.08 0.00 -1.03 0.00 0.00 54.13 52.59 3h0m s LEU 448 Cb -0.12 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.80 3h0m s LEU 448 CO 0.02 0.08 0.09 -0.63 0.23 0.00 0.00 176.35 176.14 3h0m s ILE 449 N 0.73 4.79 0.47 -0.59 1.01 0.72 -1.21 121.20 127.12 3h0m s ILE 449 Ca -0.11 -0.02 0.07 0.00 0.00 0.00 0.00 60.65 60.59 3h0m s ILE 449 Cb -0.16 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.11 3h0m s ILE 449 CO 0.02 0.40 0.38 -0.83 0.00 0.00 0.00 174.94 174.90 3h0m s GLY 450 N 0.89 2.23 0.70 6.18 0.00 -0.71 -1.30 107.32 115.31 3h0m s GLY 450 Ca 0.05 -1.72 -0.13 0.00 0.00 0.00 0.00 44.72 42.92 3h0m s GLY 450 CO 0.03 -1.81 1.10 0.54 0.00 0.00 0.00 173.10 172.95 3h0m s LYS 451 N -4.18 2.62 -0.08 2.90 1.02 -1.26 -4.08 119.74 116.67 3h0m s LYS 451 Ca 0.43 1.28 -0.38 0.00 0.02 0.00 0.00 55.97 57.32 3h0m s LYS 451 Cb -0.02 -1.93 -0.16 0.00 -0.52 0.00 0.00 37.83 35.19 3h0m s LYS 451 CO 0.25 -1.38 1.51 0.72 -0.92 0.00 0.00 175.35 175.54 3h0m n HIS 452 N -2.85 1.73 -0.98 3.18 8.25 -1.26 -0.90 115.22 122.38 3h0m n HIS 452 Ca 0.10 0.61 0.00 0.00 -0.26 0.00 0.00 57.72 58.17 3h0m n HIS 452 Cb 0.52 -2.38 0.00 0.00 1.12 0.00 0.00 29.99 29.25 3h0m n HIS 452 CO 0.00 0.00 0.00 0.91 0.64 0.00 0.00 176.34 177.89 3h0m n TRP 453 N 3.76 0.00 -2.01 4.41 7.02 -1.26 -4.93 117.44 124.43 3h0m n TRP 453 Ca 0.22 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.32 3h0m n TRP 453 Cb 0.16 -0.10 0.03 0.00 -2.42 0.00 0.00 31.31 28.98 3h0m n TRP 453 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3h0m n ASP 454 N -0.03 7.08 0.19 -0.99 2.03 -0.08 -4.61 116.55 120.15 3h0m n ASP 454 Ca 0.00 -3.82 0.03 0.00 0.52 0.00 0.00 54.79 51.52 3h0m n ASP 454 Cb 0.01 -0.97 0.37 0.00 -0.72 0.00 0.00 41.12 39.82 3h0m n ASP 454 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 3h0m h GLU 455 N 2.93 0.00 -0.09 -0.67 3.07 -1.92 -3.13 114.58 114.76 3h0m h GLU 455 Ca 0.53 0.00 0.04 0.00 -0.50 0.00 0.00 59.36 59.43 3h0m h GLU 455 Cb 0.17 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.02 3h0m h GLU 455 CO 1.35 0.37 -0.40 1.15 -1.40 0.00 0.00 179.01 180.07 3h0m h THR 456 N 0.00 0.17 -0.12 1.13 2.02 -1.98 0.08 112.91 114.21 3h0m h THR 456 Ca -0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 3h0m h THR 456 Cb 0.69 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 3h0m h THR 456 CO 0.05 0.00 -0.01 0.74 0.37 0.00 0.00 175.52 176.67 3h0m h THR 457 N -0.50 0.91 -0.99 3.16 2.02 -1.94 0.35 112.91 115.92 3h0m h THR 457 Ca 0.07 -0.01 0.20 0.00 0.77 0.00 0.00 66.41 67.44 3h0m h THR 457 Cb 0.62 0.87 -0.10 0.00 -1.74 0.00 0.00 68.15 67.80 3h0m h THR 457 CO -0.36 0.01 0.62 -0.07 0.37 0.00 0.00 175.52 176.08 3h0m h LEU 458 N 0.03 0.70 -0.03 2.58 4.07 -1.54 -1.28 115.31 119.85 3h0m h LEU 458 Ca 0.06 0.09 -0.19 0.00 0.08 0.00 0.00 57.88 57.92 3h0m h LEU 458 Cb 0.07 -0.03 0.01 0.00 1.08 0.00 0.00 40.66 41.79 3h0m h LEU 458 CO -0.10 0.24 -0.73 -0.07 -1.08 0.00 0.00 178.44 176.70 3h0m h LEU 459 N 0.68 0.69 0.14 1.67 3.38 0.12 -2.71 115.31 119.27 3h0m h LEU 459 Ca 0.57 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3h0m h LEU 459 Cb 1.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 3h0m h LEU 459 CO -0.35 1.32 -0.12 1.56 0.09 0.00 0.00 178.44 180.94 3h0m h GLN 460 N 0.13 -0.27 -0.48 1.13 4.20 0.31 0.29 115.11 120.42 3h0m h GLN 460 Ca -0.08 0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.68 3h0m h GLN 460 Cb 1.41 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 29.22 3h0m h GLN 460 CO 0.15 -0.18 0.32 0.82 -0.67 0.00 0.00 178.83 179.26 3h0m h ILE 461 N -0.28 1.03 -0.63 2.54 2.04 -1.36 0.81 117.51 121.65 3h0m h ILE 461 Ca 0.00 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 3h0m h ILE 461 Cb 0.26 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 3h0m h ILE 461 CO -0.02 0.09 0.16 -1.28 0.00 0.00 0.00 178.15 177.10 3h0m h SER 462 N 0.50 0.95 -0.28 1.72 0.87 -1.04 -0.84 113.55 115.43 3h0m h SER 462 Ca 0.20 -0.23 -0.06 0.00 -1.23 0.00 0.00 61.79 60.47 3h0m h SER 462 Cb 0.16 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 3h0m h SER 462 CO -0.05 0.93 -0.06 0.22 -0.53 0.00 0.00 176.83 177.34 3h0m h TYR 463 N 0.93 0.60 -0.80 2.24 3.20 0.16 -2.77 116.97 120.52 3h0m h TYR 463 Ca 0.20 -0.13 0.06 0.00 3.14 0.00 0.00 58.73 62.00 3h0m h TYR 463 Cb 0.35 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 3h0m h TYR 463 CO 0.03 0.73 0.53 1.25 -1.64 0.00 0.00 178.16 179.06 3h0m h LEU 464 N 0.29 0.78 -0.28 2.82 5.85 -0.73 -2.78 115.31 121.27 3h0m h LEU 464 Ca 0.07 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.60 3h0m h LEU 464 Cb 0.54 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.41 3h0m h LEU 464 CO 0.03 0.51 -0.61 -0.25 -0.34 0.00 0.00 178.44 177.77 3h0m h TRP 465 N 0.89 1.06 0.00 1.25 2.91 -1.06 -3.19 115.95 117.81 3h0m h TRP 465 Ca 0.34 -0.40 -0.09 0.00 1.13 0.00 0.00 58.89 59.87 3h0m h TRP 465 Cb 0.20 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.65 3h0m h TRP 465 CO -0.00 1.23 -0.41 1.05 -1.03 0.00 0.00 178.44 179.27 3h0m h GLU 466 N 0.61 0.00 -0.10 2.65 4.11 -1.21 0.44 114.58 121.09 3h0m h GLU 466 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3h0m h GLU 466 Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3h0m h GLU 466 CO 0.13 0.41 0.05 1.96 0.07 0.00 0.00 179.01 181.63 3h0m h GLN 467 N 0.00 0.10 -0.21 1.06 1.08 -1.53 -2.74 115.11 112.87 3h0m h GLN 467 Ca -0.00 -0.01 -0.14 0.00 -1.45 0.00 0.00 58.65 57.05 3h0m h GLN 467 Cb 0.84 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.24 3h0m h GLN 467 CO 0.05 0.07 -0.47 0.87 -0.95 0.00 0.00 178.83 178.40 3h0m h LYS 468 N 0.11 0.55 -3.17 1.46 1.57 -1.34 -3.42 116.57 112.33 3h0m h LYS 468 Ca 0.04 -0.31 -0.50 0.00 -1.87 0.00 0.00 60.65 58.01 3h0m h LYS 468 Cb 0.00 0.02 -0.40 0.00 0.08 0.00 0.00 32.23 31.93 3h0m h LYS 468 CO -0.02 0.90 -0.76 0.12 -0.57 0.00 0.00 179.45 179.12 3h0m s PHE 469 N -4.13 0.59 -1.27 -1.35 5.36 0.15 -5.06 117.98 112.26 3h0m s PHE 469 Ca -0.07 -0.72 -0.12 0.00 -0.96 0.00 0.00 56.93 55.06 3h0m s PHE 469 Cb 0.12 -0.92 0.15 0.00 -0.34 0.00 0.00 43.02 42.03 3h0m s PHE 469 CO 0.83 -0.64 1.74 1.63 -1.46 0.00 0.00 175.22 177.32 3h0m n LYS 470 N 5.17 3.43 0.20 10.12 5.02 -1.05 -4.15 118.16 136.90 3h0m n LYS 470 Ca -0.07 -3.54 0.14 0.00 -2.02 0.00 0.00 58.31 52.82 3h0m n LYS 470 Cb 0.46 -3.04 0.57 0.00 -0.02 0.00 0.00 35.03 33.00 3h0m n LYS 470 CO 0.00 0.00 0.00 1.12 -0.52 0.00 0.00 177.40 178.00 3h0m h HIS 471 N 6.40 0.00 0.00 2.13 2.07 -1.91 -2.89 115.15 120.95 3h0m h HIS 471 Ca 0.39 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.91 3h0m h HIS 471 Cb 0.74 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.72 3h0m h HIS 471 CO 1.23 0.00 0.00 2.48 -3.07 0.00 0.00 177.93 178.57 3h0m n TYR 472 N -2.63 0.05 0.10 6.12 0.18 -1.26 -2.48 117.16 117.24 3h0m n TYR 472 Ca 0.02 0.02 0.09 0.00 1.88 0.00 0.00 57.90 59.90 3h0m n TYR 472 Cb 0.28 -0.53 -0.01 0.00 -0.38 0.00 0.00 39.34 38.70 3h0m n TYR 472 CO 0.00 0.00 0.00 0.93 -2.08 0.00 0.00 176.86 175.71 3h0m h GLU 473 N 0.00 0.00 -6.11 -3.48 5.08 -1.90 -3.44 114.58 104.74 3h0m h GLU 473 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 3h0m h GLU 473 Cb 0.35 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 3h0m h GLU 473 CO 0.00 0.08 1.26 0.15 -1.00 0.00 0.00 179.01 179.50 3h0m s LYS 474 N -3.24 2.82 -0.20 2.33 -0.14 -1.03 -4.97 119.74 115.29 3h0m s LYS 474 Ca -0.00 0.33 -0.02 0.00 -1.36 0.00 0.00 55.97 54.91 3h0m s LYS 474 Cb 0.09 -4.32 -0.00 0.00 -1.68 0.00 0.00 37.83 31.92 3h0m s LYS 474 CO 0.78 -2.54 -0.09 0.42 -0.76 0.00 0.00 175.35 173.17 3h0m s ILE 475 N 7.96 3.01 0.85 2.17 1.01 -1.26 -5.06 121.20 129.88 3h0m s ILE 475 Ca 0.56 -0.62 -0.11 0.00 0.00 0.00 0.00 60.65 60.49 3h0m s ILE 475 Cb -0.11 -2.34 0.15 0.00 0.01 0.00 0.00 42.46 40.16 3h0m s ILE 475 CO 0.19 0.46 1.18 -2.16 0.00 0.00 0.00 174.94 174.61 3h0m s PRO 476 N 1.35 1.28 -1.37 2.79 0.04 -1.26 -4.34 135.00 133.50 3h0m s PRO 476 Ca 0.04 -0.47 -0.09 0.00 0.04 0.00 0.00 61.00 60.52 3h0m s PRO 476 Cb -0.14 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.39 3h0m s PRO 476 CO -0.05 -1.91 0.42 1.28 0.04 0.00 0.00 177.00 176.78 3h0m n LEU 477 N -3.37 -1.68 0.00 -3.56 4.77 -1.26 -4.88 117.00 107.01 3h0m n LEU 477 Ca 0.13 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.98 3h0m n LEU 477 Cb 0.60 -1.99 0.00 0.00 -2.33 0.00 0.00 43.42 39.70 3h0m n LEU 477 CO 0.47 0.51 0.00 0.35 -1.33 0.00 0.00 177.39 177.40