#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 0.17 -0.89 7.94 -1.26 -4.24 117.00 118.71 3h0m n LEU 2 Ca 0.00 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.03 3h0m n LEU 2 Cb 0.00 0.00 0.57 0.00 0.53 0.00 0.00 43.42 44.52 3h0m n LEU 2 CO 0.00 0.00 0.88 4.11 -1.11 0.00 0.00 177.39 181.27 3h0m h TRP 3 N 0.00 0.00 -0.00 1.96 5.08 -1.90 -1.36 115.95 119.72 3h0m h TRP 3 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3h0m h TRP 3 Cb 0.00 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.16 3h0m h TRP 3 CO 0.00 0.00 -0.04 1.17 -1.28 0.00 0.00 178.44 178.29 3h0m n LYS 4 N -2.39 0.97 -3.93 0.12 4.81 -1.26 -4.90 118.16 111.58 3h0m n LYS 4 Ca 0.01 -0.28 -0.30 0.00 -0.87 0.00 0.00 58.31 56.87 3h0m n LYS 4 Cb 0.19 -1.49 -0.04 0.00 0.02 0.00 0.00 35.03 33.71 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 -2.23 3.43 0.93 1.64 1.02 -0.52 -4.84 119.74 119.18 3h0m s LYS 5 Ca 0.37 -0.47 -0.14 0.00 0.02 0.00 0.00 55.97 55.76 3h0m s LYS 5 Cb 0.21 -3.02 0.15 0.00 -0.52 0.00 0.00 37.83 34.65 3h0m s LYS 5 CO 0.41 0.60 1.18 -1.54 -0.92 0.00 0.00 175.35 175.08 3h0m s SER 6 N -2.62 3.40 0.49 2.83 1.04 -1.26 -4.80 113.70 112.78 3h0m s SER 6 Ca 0.35 0.76 0.28 0.00 0.48 0.00 0.00 55.95 57.82 3h0m s SER 6 Cb -0.13 -1.19 1.15 0.00 0.10 0.00 0.00 66.02 65.96 3h0m s SER 6 CO 0.28 -2.60 1.92 -0.07 0.98 0.00 0.00 173.24 173.75 3h0m h LEU 7 N -1.53 0.00 -0.06 2.42 3.38 -1.97 0.24 115.31 117.78 3h0m h LEU 7 Ca -0.48 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.41 3h0m h LEU 7 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 3h0m h LEU 7 CO 0.56 0.14 -0.29 0.28 0.09 0.00 0.00 178.44 179.22 3h0m h SER 8 N 0.00 0.36 -0.46 -0.43 0.02 -1.99 -0.19 113.55 110.87 3h0m h SER 8 Ca -0.00 -0.65 -0.03 0.00 -0.84 0.00 0.00 61.79 60.27 3h0m h SER 8 Cb 0.61 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 3h0m h SER 8 CO 0.02 0.95 0.18 -0.33 -1.14 0.00 0.00 176.83 176.51 3h0m h GLU 9 N -0.20 0.70 -0.47 3.45 5.08 -1.86 -2.39 114.58 118.89 3h0m h GLU 9 Ca -0.02 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 3h0m h GLU 9 Cb 0.94 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 3h0m h GLU 9 CO 0.06 0.64 0.15 -0.07 -1.00 0.00 0.00 179.01 178.79 3h0m h LEU 10 N 0.61 0.68 0.02 1.33 4.07 -0.57 -2.77 115.31 118.68 3h0m h LEU 10 Ca 0.15 -0.20 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 3h0m h LEU 10 Cb 0.21 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.77 3h0m h LEU 10 CO -0.01 0.70 -0.01 -0.09 -1.08 0.00 0.00 178.44 177.95 3h0m h ARG 11 N 0.62 -0.03 -0.57 1.13 2.43 -0.96 -0.85 114.38 116.16 3h0m h ARG 11 Ca 0.15 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.43 3h0m h ARG 11 Cb 0.27 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.74 3h0m h ARG 11 CO -0.01 0.04 0.11 1.49 -1.51 0.00 0.00 179.97 180.10 3h0m h GLU 12 N -0.09 0.23 -0.24 0.20 4.81 -1.44 0.25 114.58 118.31 3h0m h GLU 12 Ca -0.00 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 3h0m h GLU 12 Cb 0.08 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 3h0m h GLU 12 CO 0.00 0.15 -0.14 -0.07 -0.73 0.00 0.00 179.01 178.23 3h0m h LEU 13 N 0.24 0.38 0.16 1.64 4.07 -1.22 -2.72 115.31 117.86 3h0m h LEU 13 Ca 0.30 -0.09 -0.29 0.00 0.08 0.00 0.00 57.88 57.87 3h0m h LEU 13 Cb 0.43 -0.10 0.01 0.00 1.08 0.00 0.00 40.66 42.09 3h0m h LEU 13 CO -0.39 0.55 -1.32 -0.07 -1.08 0.00 0.00 178.44 176.13 3h0m h LEU 14 N 0.37 0.54 -0.85 1.67 3.38 -0.05 -1.17 115.31 119.19 3h0m h LEU 14 Ca 0.07 -0.58 -0.11 0.00 0.09 0.00 0.00 57.88 57.35 3h0m h LEU 14 Cb 0.47 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3h0m h LEU 14 CO 0.03 1.46 -0.37 0.50 0.09 0.00 0.00 178.44 180.14 3h0m h LYS 15 N 0.09 0.40 -0.64 1.13 3.64 -0.52 -2.68 116.57 118.00 3h0m h LYS 15 Ca -0.17 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 3h0m h LYS 15 Cb 2.03 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.84 3h0m h LYS 15 CO 0.22 0.72 0.00 0.54 -2.27 0.00 0.00 179.45 178.66 3h0m n ARG 16 N -4.05 3.96 -0.57 1.90 1.74 -1.03 -4.95 116.66 113.66 3h0m n ARG 16 Ca -0.01 -2.75 0.00 0.00 -0.77 0.00 0.00 57.85 54.31 3h0m n ARG 16 Cb 0.47 -2.00 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 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 0.89 0.37 0.45 -0.13 0.00 -1.01 -4.78 105.19 100.97 3h0m n GLY 17 Ca 0.25 0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.53 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 0.01 -4.45 1.61 5.08 -1.52 -3.41 114.58 112.74 3h0m h GLU 18 Ca 0.00 -0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 3h0m h GLU 18 Cb 0.00 -0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.08 3h0m h GLU 18 CO 0.00 0.00 -0.70 0.54 -1.00 0.00 0.00 179.01 177.86 3h0m s VAL 19 N -4.99 0.48 0.13 3.13 0.11 -0.76 -5.03 120.40 113.47 3h0m s VAL 19 Ca -0.05 -1.66 0.06 0.00 -2.93 0.00 0.00 61.98 57.40 3h0m s VAL 19 Cb 0.21 -1.32 -0.04 0.00 -1.53 0.00 0.00 36.38 33.70 3h0m s VAL 19 CO 0.76 -0.79 0.01 -0.94 -3.33 0.00 0.00 175.10 170.81 3h0m s SER 20 N -2.61 4.94 0.37 3.54 1.04 -1.26 -4.40 113.70 115.32 3h0m s SER 20 Ca 0.04 -0.27 0.12 0.00 0.48 0.00 0.00 55.95 56.33 3h0m s SER 20 Cb 0.02 -1.13 0.93 0.00 0.10 0.00 0.00 66.02 65.94 3h0m s SER 20 CO -0.05 0.13 1.83 -0.65 0.98 0.00 0.00 173.24 175.48 3h0m h PRO 21 N 3.06 0.56 -0.78 4.02 0.11 -1.89 -1.27 132.00 135.81 3h0m h PRO 21 Ca -0.48 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 3h0m h PRO 21 Cb 1.18 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 3h0m h PRO 21 CO 0.59 0.37 0.40 -0.22 -0.21 0.00 0.00 178.00 178.93 3h0m h LYS 22 N 0.57 1.10 -0.07 1.05 3.64 -1.90 -1.88 116.57 119.09 3h0m h LYS 22 Ca 0.50 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.73 3h0m h LYS 22 Cb 1.00 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3h0m h LYS 22 CO -0.24 0.84 0.03 0.93 -2.27 0.00 0.00 179.45 178.73 3h0m h GLU 23 N 1.09 0.11 -0.43 1.90 5.08 -1.65 0.21 114.58 120.89 3h0m h GLU 23 Ca 0.27 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.69 3h0m h GLU 23 Cb 0.07 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.22 3h0m h GLU 23 CO -0.04 0.26 -0.12 0.28 -1.00 0.00 0.00 179.01 178.40 3h0m h VAL 24 N -0.06 0.55 -0.50 3.13 2.07 -1.32 0.32 116.25 120.43 3h0m h VAL 24 Ca 0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 3h0m h VAL 24 Cb 0.20 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 3h0m h VAL 24 CO -0.00 0.00 0.30 0.58 0.02 0.00 0.00 177.57 178.47 3h0m h VAL 25 N -0.01 1.16 -0.70 2.57 2.07 -1.17 -2.40 116.25 117.77 3h0m h VAL 25 Ca 0.21 -0.37 0.04 0.00 0.82 0.00 0.00 66.70 67.39 3h0m h VAL 25 Cb 0.33 0.50 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 3h0m h VAL 25 CO -0.45 0.17 0.43 -0.33 0.02 0.00 0.00 177.57 177.41 3h0m h GLU 26 N 0.67 0.81 0.14 1.57 5.08 0.12 0.11 114.58 123.09 3h0m h GLU 26 Ca 0.18 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.51 3h0m h GLU 26 Cb 0.01 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.03 3h0m h GLU 26 CO -0.03 0.54 -0.38 1.03 -1.00 0.00 0.00 179.01 179.16 3h0m h SER 27 N 0.84 -1.10 0.03 1.42 0.87 -0.07 -0.24 113.55 115.30 3h0m h SER 27 Ca 0.29 0.12 -0.07 0.00 -1.23 0.00 0.00 61.79 60.90 3h0m h SER 27 Cb 0.05 0.41 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 3h0m h SER 27 CO -0.12 -0.47 -0.21 -0.26 -0.53 0.00 0.00 176.83 175.24 3h0m h PHE 28 N -0.63 0.35 -0.46 2.24 0.04 -1.24 -2.33 116.94 114.90 3h0m h PHE 28 Ca 0.02 -0.06 0.02 0.00 2.80 0.00 0.00 57.97 60.76 3h0m h PHE 28 Cb 0.65 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.67 3h0m h PHE 28 CO -0.32 0.52 0.27 -0.92 -0.60 0.00 0.00 178.31 177.25 3h0m h TYR 29 N 0.29 0.50 0.22 -0.55 5.03 -0.39 0.30 116.97 122.38 3h0m h TYR 29 Ca 0.05 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.38 3h0m h TYR 29 Cb 0.54 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.64 3h0m h TYR 29 CO 0.01 0.29 -0.22 0.22 -1.32 0.00 0.00 178.16 177.14 3h0m h ASP 30 N 0.54 -0.59 -0.84 -2.11 3.58 -0.61 0.14 116.42 116.54 3h0m h ASP 30 Ca 0.19 0.05 0.06 0.00 0.42 0.00 0.00 57.03 57.76 3h0m h ASP 30 Cb 0.03 0.20 -0.05 0.00 1.72 0.00 0.00 39.33 41.23 3h0m h ASP 30 CO -0.09 -0.33 0.55 -0.09 -2.88 0.00 0.00 179.24 176.40 3h0m h ARG 31 N -0.48 0.91 -0.31 0.28 9.65 -1.21 0.35 114.38 123.58 3h0m h ARG 31 Ca -0.00 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.82 3h0m h ARG 31 Cb 0.44 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 28.81 3h0m h ARG 31 CO -0.05 0.60 0.18 -0.92 2.80 0.00 0.00 179.97 182.58 3h0m h TYR 32 N 0.93 0.41 -0.65 2.20 3.20 0.03 -2.09 116.97 121.01 3h0m h TYR 32 Ca 0.36 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.20 3h0m h TYR 32 Cb 0.22 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 3h0m h TYR 32 CO -0.00 0.31 0.30 -0.91 -1.64 0.00 0.00 178.16 176.22 3h0m h ASN 33 N 0.39 0.83 -0.76 -2.11 2.35 0.22 0.17 115.58 116.66 3h0m h ASN 33 Ca 0.11 -0.09 0.02 0.00 -0.55 0.00 0.00 56.30 55.79 3h0m h ASN 33 Cb 0.02 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.14 3h0m h ASN 33 CO -0.02 0.71 0.49 1.56 -1.65 0.00 0.00 177.43 178.52 3h0m h GLN 34 N 0.91 0.94 0.00 0.81 4.20 -0.30 -3.39 115.11 118.29 3h0m h GLN 34 Ca 0.22 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.71 3h0m h GLN 34 Cb 0.11 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.64 3h0m h GLN 34 CO -0.03 0.62 -1.63 -2.37 -0.67 0.00 0.00 178.83 174.76 3h0m n THR 35 N -4.60 0.63 -0.22 -0.54 5.66 -0.80 -4.71 114.28 109.71 3h0m n THR 35 Ca 0.08 -0.38 0.11 0.00 -3.05 0.00 0.00 64.05 60.81 3h0m n THR 35 Cb 0.07 -0.76 0.40 0.00 -1.55 0.00 0.00 70.33 68.48 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 0.63 -0.13 1.09 4.57 -0.87 -0.58 114.58 119.29 3h0m h GLU 36 Ca -0.25 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 57.86 3h0m h GLU 36 Cb 1.56 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 30.00 3h0m h GLU 36 CO 0.01 0.42 -0.06 1.49 -1.18 0.00 0.00 179.01 179.69 3h0m h GLU 37 N 0.65 0.20 0.00 1.92 4.81 -1.84 0.49 114.58 120.81 3h0m h GLU 37 Ca 0.38 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.51 3h0m h GLU 37 Cb 0.59 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 3h0m h GLU 37 CO -0.15 0.27 -0.43 0.87 -0.73 0.00 0.00 179.01 178.84 3h0m h LYS 38 N 0.19 0.00 0.14 1.92 1.57 -1.48 -3.42 116.57 115.49 3h0m h LYS 38 Ca 0.04 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3h0m h LYS 38 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3h0m h LYS 38 CO 0.01 0.91 -0.07 0.28 -0.57 0.00 0.00 179.45 180.02 3h0m h VAL 39 N -1.00 0.65 -4.81 0.50 2.07 -1.14 -3.42 116.25 109.10 3h0m h VAL 39 Ca -0.11 -1.19 -0.24 0.00 0.82 0.00 0.00 66.70 65.97 3h0m h VAL 39 Cb 1.03 1.14 0.13 0.00 -1.52 0.00 0.00 31.29 32.08 3h0m h VAL 39 CO -0.07 0.19 -0.60 0.29 0.02 0.00 0.00 177.57 177.40 3h0m n LYS 40 N -4.88 -4.54 -0.01 1.57 5.02 0.15 -0.75 118.16 114.73 3h0m n LYS 40 Ca -0.06 0.65 -0.06 0.00 -2.02 0.00 0.00 58.31 56.82 3h0m n LYS 40 Cb 0.23 -5.04 0.14 0.00 -0.02 0.00 0.00 35.03 30.34 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 0.57 0.95 -3.06 7.82 0.00 -1.87 -3.38 119.26 120.29 3h0m h ALA 41 Ca -0.45 -0.40 -0.65 0.00 0.00 0.00 0.00 54.91 53.41 3h0m h ALA 41 Cb 1.26 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.84 3h0m h ALA 41 CO 0.38 0.61 -0.56 0.71 0.00 0.00 0.00 179.25 180.38 3h0m s TYR 42 N -4.38 3.32 -0.18 0.00 1.51 -1.26 0.12 117.35 116.47 3h0m s TYR 42 Ca -0.07 0.21 -0.15 0.00 -1.01 0.00 0.00 57.07 56.04 3h0m s TYR 42 Cb 0.13 -1.73 -0.21 0.00 -0.11 0.00 0.00 41.96 40.04 3h0m s TYR 42 CO 0.81 0.56 0.21 -0.89 -1.11 0.00 0.00 175.55 175.14 3h0m n ILE 43 N 0.99 1.62 -3.68 2.71 5.41 0.28 -4.68 119.36 122.01 3h0m n ILE 43 Ca -0.12 -0.28 -0.30 0.00 1.00 0.00 0.00 62.75 63.06 3h0m n ILE 43 Cb 0.52 -1.91 -0.15 0.00 -0.71 0.00 0.00 39.64 37.40 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 -2.45 0.67 0.30 1.39 2.01 -0.66 -4.97 115.64 111.93 3h0m s THR 44 Ca -0.27 -1.35 -0.29 0.00 0.31 0.00 0.00 61.69 60.08 3h0m s THR 44 Cb 0.07 -1.51 -0.10 0.00 0.01 0.00 0.00 72.50 70.97 3h0m s THR 44 CO 0.65 -0.72 1.24 -2.16 -0.69 0.00 0.00 174.62 172.94 3h0m s PRO 45 N 1.62 4.46 -0.07 4.92 0.04 -1.26 0.57 135.00 145.27 3h0m s PRO 45 Ca 0.11 2.05 0.13 0.00 0.04 0.00 0.00 61.00 63.33 3h0m s PRO 45 Cb -0.18 -3.13 0.26 0.00 0.04 0.00 0.00 34.50 31.50 3h0m s PRO 45 CO -0.25 -0.06 1.12 1.28 0.04 0.00 0.00 177.00 179.13 3h0m n LEU 46 N 1.18 1.30 -0.34 -3.56 4.77 0.26 -4.81 117.00 115.81 3h0m n LEU 46 Ca 0.00 -2.28 -0.03 0.00 -0.03 0.00 0.00 56.01 53.67 3h0m n LEU 46 Cb 0.43 -0.19 0.11 0.00 -2.33 0.00 0.00 43.42 41.43 3h0m n LEU 46 CO 0.57 0.64 1.20 1.88 -1.33 0.00 0.00 177.39 180.36 3h0m h TYR 47 N 0.48 1.23 -0.25 -1.77 -1.99 -1.81 0.18 116.97 113.03 3h0m h TYR 47 Ca -0.07 -0.01 0.06 0.00 2.00 0.00 0.00 58.73 60.71 3h0m h TYR 47 Cb 1.38 -0.40 -0.07 0.00 2.00 0.00 0.00 36.73 39.64 3h0m h TYR 47 CO 0.23 0.83 -0.24 0.78 -0.00 0.00 0.00 178.16 179.75 3h0m h GLY 48 N 1.27 -0.16 1.76 3.88 0.00 -1.91 0.23 103.07 108.14 3h0m h GLY 48 Ca 0.33 0.30 -0.14 0.00 0.00 0.00 0.00 47.33 47.82 3h0m h GLY 48 CO -0.06 -0.20 -0.55 1.70 0.00 0.00 0.00 176.54 177.43 3h0m h LYS 49 N -0.25 0.25 -0.48 4.80 3.64 -1.77 -2.89 116.57 119.88 3h0m h LYS 49 Ca 0.14 -0.16 -0.12 0.00 -1.27 0.00 0.00 60.65 59.24 3h0m h LYS 49 Cb 0.46 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 3h0m h LYS 49 CO -0.39 0.74 -0.16 0.00 -2.27 0.00 0.00 179.45 177.37 3h0m h ALA 50 N 1.23 0.81 -0.46 5.00 0.00 -0.30 -1.46 119.26 124.07 3h0m h ALA 50 Ca 0.00 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.64 3h0m h ALA 50 Cb 1.04 -0.18 -0.10 0.00 0.00 0.00 0.00 17.79 18.55 3h0m h ALA 50 CO 0.09 0.65 -0.20 -0.07 0.00 0.00 0.00 179.25 179.72 3h0m h LEU 51 N 0.81 -0.69 -0.54 0.00 4.07 -0.36 0.54 115.31 119.15 3h0m h LEU 51 Ca 0.12 0.17 -0.07 0.00 0.08 0.00 0.00 57.88 58.17 3h0m h LEU 51 Cb 0.71 0.38 -0.02 0.00 1.08 0.00 0.00 40.66 42.81 3h0m h LEU 51 CO 0.05 -0.23 0.04 0.11 -1.08 0.00 0.00 178.44 177.34 3h0m h LYS 52 N -0.10 0.92 0.00 1.13 1.57 -1.34 -2.92 116.57 115.83 3h0m h LYS 52 Ca 0.22 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3h0m h LYS 52 Cb 0.44 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3h0m h LYS 52 CO -0.53 0.91 -0.21 1.96 -0.57 0.00 0.00 179.45 181.01 3h0m h GLN 53 N 0.80 0.00 -0.32 3.15 4.20 -0.80 -2.61 115.11 119.52 3h0m h GLN 53 Ca 0.16 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 3h0m h GLN 53 Cb 0.47 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 3h0m h GLN 53 CO 0.02 0.21 -0.14 0.00 -0.67 0.00 0.00 178.83 178.25 3h0m h ALA 54 N 1.79 1.15 -0.99 3.87 0.00 -0.70 -3.03 119.26 121.34 3h0m h ALA 54 Ca -0.00 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.67 3h0m h ALA 54 Cb 0.44 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 3h0m h ALA 54 CO 0.03 0.54 0.64 0.93 0.00 0.00 0.00 179.25 181.39 3h0m h GLU 55 N 0.52 1.15 -0.04 0.00 5.08 -1.46 -1.91 114.58 117.92 3h0m h GLU 55 Ca 0.09 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3h0m h GLU 55 Cb 0.55 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3h0m h GLU 55 CO 0.03 0.76 0.00 -1.13 -1.00 0.00 0.00 179.01 177.68 3h0m n SER 56 N -4.48 1.55 -4.66 1.42 3.41 -1.15 -4.84 113.62 104.88 3h0m n SER 56 Ca 0.15 -1.54 -0.43 0.00 -0.26 0.00 0.00 58.87 56.79 3h0m n SER 56 Cb 0.16 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.07 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 -1.93 4.08 0.01 1.04 0.20 -0.72 -4.89 118.68 116.49 3h0m s LEU 57 Ca 0.37 1.41 0.00 0.00 0.69 0.00 0.00 54.13 56.60 3h0m s LEU 57 Cb 0.20 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.42 3h0m s LEU 57 CO 0.32 -0.75 0.00 0.29 -0.29 0.00 0.00 176.35 175.92 3h0m n LYS 58 N 6.54 0.00 -2.12 1.98 5.02 -1.26 -4.95 118.16 123.37 3h0m n LYS 58 Ca 0.13 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 3h0m n LYS 58 Cb 0.46 -0.39 -0.03 0.00 -0.02 0.00 0.00 35.03 35.06 3h0m n LYS 58 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3h0m s GLU 59 N -2.00 3.40 0.36 1.97 2.12 -1.26 -4.87 118.70 118.42 3h0m s GLU 59 Ca 0.00 1.24 0.19 0.00 0.36 0.00 0.00 54.97 56.76 3h0m s GLU 59 Cb 0.00 -4.14 0.57 0.00 0.26 0.00 0.00 34.13 30.81 3h0m s GLU 59 CO 0.00 -1.78 1.68 0.00 -0.54 0.00 0.00 175.26 174.62 3h0m h ARG 60 N 12.19 0.00 0.00 4.30 3.08 -1.94 -3.21 114.38 128.79 3h0m h ARG 60 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.74 3h0m h ARG 60 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.20 3h0m h ARG 60 CO 1.05 0.39 0.00 -1.91 -1.07 0.00 0.00 179.97 178.43 3h0m n GLU 61 N -3.43 0.28 -1.70 0.04 2.13 -1.26 -4.62 120.64 112.07 3h0m n GLU 61 Ca 0.00 0.07 -0.44 0.00 0.66 0.00 0.00 57.16 57.46 3h0m n GLU 61 Cb 0.55 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.74 3h0m n GLU 61 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3h0m n LEU 62 N -1.32 3.65 -0.23 4.31 4.32 -1.22 -4.87 117.00 121.65 3h0m n LEU 62 Ca 0.10 1.11 0.25 0.00 -0.02 0.00 0.00 56.01 57.45 3h0m n LEU 62 Cb 0.20 -1.51 0.62 0.00 -1.62 0.00 0.00 43.42 41.11 3h0m n LEU 62 CO 0.18 -0.11 1.24 -0.65 -1.22 0.00 0.00 177.39 176.84 3h0m h PRO 63 N 5.39 0.20 -0.14 3.23 0.11 -1.86 0.02 132.00 138.94 3h0m h PRO 63 Ca -0.45 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 3h0m h PRO 63 Cb 1.24 -0.05 -0.08 0.00 0.11 0.00 0.00 31.00 32.23 3h0m h PRO 63 CO 0.85 0.13 -0.52 1.28 -0.21 0.00 0.00 178.00 179.52 3h0m n LEU 64 N -4.41 3.17 -0.14 2.35 4.77 0.55 -4.99 117.00 118.31 3h0m n LEU 64 Ca 0.20 -4.04 -0.04 0.00 -0.03 0.00 0.00 56.01 52.10 3h0m n LEU 64 Cb 0.87 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 3h0m n LEU 64 CO 0.34 1.52 0.23 0.33 -1.33 0.00 0.00 177.39 178.47 3h0m n PHE 65 N -1.05 -0.14 -0.89 -1.77 7.35 -0.01 -1.58 117.46 119.37 3h0m n PHE 65 Ca 0.24 0.40 0.08 0.00 -0.76 0.00 0.00 57.45 57.42 3h0m n PHE 65 Cb 0.75 -0.44 0.17 0.00 0.35 0.00 0.00 39.48 40.31 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 4.29 3.66 7.13 0.00 -1.26 -4.32 105.19 113.61 3h0m n GLY 66 Ca 0.01 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 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 -2.57 4.81 0.49 -0.61 -1.09 -0.61 -4.77 121.20 116.85 3h0m s ILE 67 Ca 0.32 1.75 -0.22 0.00 -2.23 0.00 0.00 60.65 60.26 3h0m s ILE 67 Cb 0.27 -4.19 -0.06 0.00 -1.58 0.00 0.00 42.46 36.89 3h0m s ILE 67 CO 0.06 -0.05 1.23 -2.84 -1.23 0.00 0.00 174.94 172.10 3h0m s PRO 68 N 2.58 3.52 -0.14 2.79 0.02 -1.26 -0.33 135.00 142.18 3h0m s PRO 68 Ca 0.40 1.92 -0.08 0.00 0.02 0.00 0.00 61.00 63.27 3h0m s PRO 68 Cb -0.16 -2.33 0.05 0.00 0.02 0.00 0.00 34.50 32.08 3h0m s PRO 68 CO 0.10 -0.79 0.33 -1.50 -0.33 0.00 0.00 177.00 174.81 3h0m s ILE 69 N -1.47 -0.03 0.41 2.83 2.07 -0.54 -4.43 121.20 120.04 3h0m s ILE 69 Ca 0.67 0.11 -0.06 0.00 -1.41 0.00 0.00 60.65 59.96 3h0m s ILE 69 Cb -0.32 -0.49 -0.05 0.00 0.13 0.00 0.00 42.46 41.73 3h0m s ILE 69 CO 0.39 0.05 0.71 0.00 -1.91 0.00 0.00 174.94 174.17 3h0m s ALA 70 N 1.25 3.46 -0.03 1.50 0.00 -1.15 -1.44 121.76 125.34 3h0m s ALA 70 Ca -0.09 -0.48 -0.02 0.00 0.00 0.00 0.00 51.96 51.37 3h0m s ALA 70 Cb -0.09 -2.51 0.02 0.00 0.00 0.00 0.00 23.12 20.54 3h0m s ALA 70 CO -0.10 -0.11 0.07 0.08 0.00 0.00 0.00 175.76 175.70 3h0m s VAL 71 N -2.47 -0.03 0.40 0.00 1.01 -0.76 -1.70 120.40 116.85 3h0m s VAL 71 Ca 0.47 0.11 -0.26 0.00 0.00 0.00 0.00 61.98 62.30 3h0m s VAL 71 Cb -0.10 -0.13 -0.09 0.00 0.00 0.00 0.00 36.38 36.06 3h0m s VAL 71 CO 0.38 0.05 1.30 -0.75 0.00 0.00 0.00 175.10 176.07 3h0m s LYS 72 N 0.64 3.98 -0.03 2.72 2.20 -0.96 -0.53 119.74 127.74 3h0m s LYS 72 Ca -0.05 2.15 0.00 0.00 -0.36 0.00 0.00 55.97 57.71 3h0m s LYS 72 Cb -0.07 -2.76 0.04 0.00 -1.51 0.00 0.00 37.83 33.53 3h0m s LYS 72 CO -0.02 -0.49 1.18 -3.47 -0.36 0.00 0.00 175.35 172.19 3h0m n ASP 73 N 0.14 3.37 -0.00 1.43 -0.08 -0.99 -1.70 116.55 118.71 3h0m n ASP 73 Ca 0.04 -2.15 0.00 0.00 -1.51 0.00 0.00 54.79 51.16 3h0m n ASP 73 Cb 0.44 -0.60 0.00 0.00 2.34 0.00 0.00 41.12 43.30 3h0m n ASP 73 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 3h0m n ASN 74 N 0.52 1.78 -4.50 1.67 6.94 -1.26 -0.21 115.26 120.19 3h0m n ASN 74 Ca 0.04 -1.91 -0.35 0.00 -0.02 0.00 0.00 54.58 52.34 3h0m n ASN 74 Cb 0.57 -0.01 -0.12 0.00 -2.36 0.00 0.00 39.78 37.86 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 -0.93 4.24 -0.07 1.53 1.01 -0.69 -0.54 121.20 125.75 3h0m s ILE 75 Ca 0.01 -0.22 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 3h0m s ILE 75 Cb 0.01 -2.92 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 3h0m s ILE 75 CO 0.00 0.42 1.40 -0.76 0.00 0.00 0.00 174.94 176.00 3h0m s LEU 76 N 0.91 4.27 -0.21 2.97 1.02 -0.44 -4.89 118.68 122.30 3h0m s LEU 76 Ca 0.02 1.97 -0.01 0.00 0.02 0.00 0.00 54.13 56.13 3h0m s LEU 76 Cb -0.14 -3.55 0.01 0.00 0.02 0.00 0.00 46.19 42.54 3h0m s LEU 76 CO 0.02 -0.77 -0.11 -0.69 0.02 0.00 0.00 176.35 174.82 3h0m s VAL 77 N 3.16 2.69 0.26 -1.59 1.01 -1.26 -1.16 120.40 123.51 3h0m s VAL 77 Ca 0.62 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 3h0m s VAL 77 Cb -0.28 -2.23 -0.10 0.00 0.00 0.00 0.00 36.38 33.77 3h0m s VAL 77 CO 0.23 0.42 1.46 -0.70 0.00 0.00 0.00 175.10 176.50 3h0m s GLU 78 N 1.36 4.25 0.00 2.72 2.12 -1.23 -2.40 118.70 125.51 3h0m s GLU 78 Ca 0.04 2.33 0.00 0.00 0.36 0.00 0.00 54.97 57.70 3h0m s GLU 78 Cb -0.14 -3.10 0.00 0.00 0.26 0.00 0.00 34.13 31.15 3h0m s GLU 78 CO -0.08 -0.44 0.00 0.41 -0.54 0.00 0.00 175.26 174.61 3h0m n GLY 79 N 2.16 2.88 3.63 -1.50 0.00 0.03 -4.97 105.19 107.42 3h0m n GLY 79 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.51 2.25 0.37 1.61 0.41 -1.01 -4.81 118.70 117.01 3h0m s GLU 80 Ca 0.00 -1.37 -0.28 0.00 -0.41 0.00 0.00 54.97 52.91 3h0m s GLU 80 Cb 0.00 -2.17 -0.11 0.00 -1.78 0.00 0.00 34.13 30.07 3h0m s GLU 80 CO 0.00 0.38 1.49 1.63 -0.49 0.00 0.00 175.26 178.27 3h0m n LYS 81 N -0.66 2.65 -3.95 1.61 5.02 -1.26 -1.87 118.16 119.70 3h0m n LYS 81 Ca -0.07 0.93 -0.31 0.00 -2.02 0.00 0.00 58.31 56.84 3h0m n LYS 81 Cb 0.58 -2.66 -0.15 0.00 -0.02 0.00 0.00 35.03 32.78 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 -1.03 1.66 -0.04 -0.18 2.01 -0.63 -4.84 115.64 112.59 3h0m s THR 82 Ca 0.54 -1.45 0.21 0.00 0.31 0.00 0.00 61.69 61.31 3h0m s THR 82 Cb -0.48 -1.97 -0.32 0.00 0.01 0.00 0.00 72.50 69.73 3h0m s THR 82 CO 0.63 -0.21 0.44 0.35 -0.69 0.00 0.00 174.62 175.14 3h0m n THR 83 N 4.60 0.08 -2.17 -0.82 -2.24 -1.23 -4.60 114.28 107.89 3h0m n THR 83 Ca -0.09 -0.50 -0.08 0.00 -2.27 0.00 0.00 64.05 61.10 3h0m n THR 83 Cb 0.43 -0.01 -0.01 0.00 -2.10 0.00 0.00 70.33 68.64 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 -1.77 -1.08 -2.35 0.00 0.00 -1.26 -1.23 120.51 112.82 3h0m n ALA 85 Ca -0.10 0.23 -0.30 0.00 0.00 0.00 0.00 53.44 53.27 3h0m n ALA 85 Cb 0.50 -3.87 -0.15 0.00 0.00 0.00 0.00 19.45 15.94 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 -2.87 3.20 0.44 0.00 0.15 0.12 -1.57 113.70 113.16 3h0m s SER 86 Ca 0.42 -0.57 0.09 0.00 0.70 0.00 0.00 55.95 56.59 3h0m s SER 86 Cb -0.20 -0.31 0.96 0.00 -1.71 0.00 0.00 66.02 64.75 3h0m s SER 86 CO 0.52 0.26 2.08 0.11 1.20 0.00 0.00 173.24 177.41 3h0m h LYS 87 N 4.84 0.40 0.00 5.44 1.79 -1.84 -1.71 116.57 125.49 3h0m h LYS 87 Ca -0.46 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 3h0m h LYS 87 Cb 1.14 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 3h0m h LYS 87 CO 0.44 0.27 0.00 0.97 -1.08 0.00 0.00 179.45 180.05 3h0m h ILE 88 N 0.41 0.00 0.00 1.86 2.10 -1.75 -3.05 117.51 117.08 3h0m h ILE 88 Ca 0.11 -0.32 0.00 0.00 1.08 0.00 0.00 64.86 65.73 3h0m h ILE 88 Cb -0.03 1.13 0.00 0.00 -1.09 0.00 0.00 36.82 36.83 3h0m h ILE 88 CO -0.02 0.00 -0.15 0.18 -1.08 0.00 0.00 178.15 177.07 3h0m n LEU 89 N -2.43 1.10 -4.77 2.19 4.32 -1.02 -1.36 117.00 115.03 3h0m n LEU 89 Ca 0.02 -1.63 -0.39 0.00 -0.02 0.00 0.00 56.01 53.99 3h0m n LEU 89 Cb 0.27 -0.13 -0.03 0.00 -1.62 0.00 0.00 43.42 41.90 3h0m n LEU 89 CO 0.22 0.39 0.81 -1.83 -1.22 0.00 0.00 177.39 175.77 3h0m s GLU 90 N -1.06 4.35 0.00 3.23 -1.05 -0.67 -2.40 118.70 121.10 3h0m s GLU 90 Ca 0.10 1.80 0.00 0.00 -0.15 0.00 0.00 54.97 56.72 3h0m s GLU 90 Cb 0.08 -2.91 0.00 0.00 -0.44 0.00 0.00 34.13 30.86 3h0m s GLU 90 CO 0.01 -0.05 0.00 0.09 0.95 0.00 0.00 175.26 176.26 3h0m n ASN 91 N 0.60 -0.57 -4.61 0.83 3.02 -1.26 -4.69 115.26 108.58 3h0m n ASN 91 Ca 0.02 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.14 3h0m n ASN 91 Cb 0.46 -0.68 -0.02 0.00 -0.61 0.00 0.00 39.78 38.92 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 -3.06 2.50 -0.18 3.10 5.36 -1.01 -4.90 117.98 119.79 3h0m s PHE 92 Ca 0.00 0.74 -0.21 0.00 -0.96 0.00 0.00 56.93 56.50 3h0m s PHE 92 Cb 0.00 -4.17 -0.03 0.00 -0.34 0.00 0.00 43.02 38.48 3h0m s PHE 92 CO 0.00 -1.90 0.61 0.08 -1.46 0.00 0.00 175.22 172.55 3h0m s VAL 93 N 5.04 5.05 -0.00 3.12 1.01 -1.26 -1.61 120.40 131.74 3h0m s VAL 93 Ca 0.59 1.17 -0.30 0.00 0.00 0.00 0.00 61.98 63.44 3h0m s VAL 93 Cb -0.15 -3.93 -0.06 0.00 0.00 0.00 0.00 36.38 32.24 3h0m s VAL 93 CO 0.29 0.15 1.54 0.00 0.00 0.00 0.00 175.10 177.09 3h0m s ALA 94 N 1.67 3.63 -1.18 5.51 0.00 -0.78 -4.88 121.76 125.73 3h0m s ALA 94 Ca 0.29 0.97 0.28 0.00 0.00 0.00 0.00 51.96 53.51 3h0m s ALA 94 Cb -0.16 -3.67 1.31 0.00 0.00 0.00 0.00 23.12 20.60 3h0m s ALA 94 CO 0.11 -1.13 1.95 -2.30 0.00 0.00 0.00 175.76 174.39 3h0m n PRO 95 N 6.03 0.18 -3.66 0.00 -0.02 -1.26 -0.79 135.00 135.47 3h0m n PRO 95 Ca 0.15 0.01 -0.10 0.00 -2.02 0.00 0.00 63.50 61.55 3h0m n PRO 95 Cb 0.42 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.37 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 -2.82 -0.22 0.03 6.00 1.13 -1.26 -4.94 117.35 115.27 3h0m s TYR 96 Ca 0.19 -0.09 -0.27 0.00 -1.41 0.00 0.00 57.07 55.49 3h0m s TYR 96 Cb 0.19 0.42 -0.05 0.00 -1.10 0.00 0.00 41.96 41.42 3h0m s TYR 96 CO 0.48 -0.88 0.85 -0.51 -2.51 0.00 0.00 175.55 172.98 3h0m s ASP 97 N -2.84 7.28 0.60 -0.18 1.01 -1.26 -3.57 116.67 117.71 3h0m s ASP 97 Ca 0.06 1.53 -0.19 0.00 0.71 0.00 0.00 52.55 54.67 3h0m s ASP 97 Cb -0.01 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 3h0m s ASP 97 CO -0.06 -0.09 1.11 0.00 0.21 0.00 0.00 175.17 176.34 3h0m n ALA 98 N 3.23 0.63 -0.28 5.23 0.00 -0.31 -4.80 120.51 124.21 3h0m n ALA 98 Ca 0.01 0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.56 3h0m n ALA 98 Cb 0.50 -2.20 0.32 0.00 0.00 0.00 0.00 19.45 18.08 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 0.66 0.92 -0.56 0.00 2.02 -1.33 -1.79 112.91 112.84 3h0m h THR 99 Ca -0.49 -0.28 -0.08 0.00 0.77 0.00 0.00 66.41 66.33 3h0m h THR 99 Cb 1.35 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 3h0m h THR 99 CO 0.52 0.15 0.04 -0.37 0.37 0.00 0.00 175.52 176.23 3h0m h VAL 100 N 0.82 1.26 -0.75 3.16 -1.51 -1.87 -1.80 116.25 115.56 3h0m h VAL 100 Ca 0.42 -1.06 -0.05 0.00 -1.23 0.00 0.00 66.70 64.79 3h0m h VAL 100 Cb 0.51 0.85 -0.03 0.00 -2.13 0.00 0.00 31.29 30.48 3h0m h VAL 100 CO -0.19 0.38 0.27 0.40 -1.23 0.00 0.00 177.57 177.21 3h0m h ILE 101 N 0.84 1.26 -0.67 7.19 1.08 -1.71 0.12 117.51 125.61 3h0m h ILE 101 Ca 0.16 -0.84 0.05 0.00 -0.39 0.00 0.00 64.86 63.84 3h0m h ILE 101 Cb 0.49 0.39 -0.05 0.00 -3.07 0.00 0.00 36.82 34.57 3h0m h ILE 101 CO 0.02 0.34 0.39 -0.08 -0.69 0.00 0.00 178.15 178.13 3h0m h GLU 102 N 1.10 0.72 0.01 2.37 4.81 -1.07 -0.29 114.58 122.24 3h0m h GLU 102 Ca 0.25 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.23 3h0m h GLU 102 Cb 0.25 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 3h0m h GLU 102 CO -0.02 0.48 -0.91 0.00 -0.73 0.00 0.00 179.01 177.83 3h0m h ARG 103 N 0.74 0.12 -0.05 1.92 3.08 -0.69 -1.68 114.38 117.82 3h0m h ARG 103 Ca 0.29 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 3h0m h ARG 103 Cb 0.12 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 3h0m h ARG 103 CO -0.15 0.95 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.61 3h0m h LEU 104 N 0.06 0.10 -0.71 3.04 3.38 -0.61 -2.51 115.31 118.07 3h0m h LEU 104 Ca -0.04 -0.35 0.08 0.00 0.09 0.00 0.00 57.88 57.66 3h0m h LEU 104 Cb 1.57 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 42.23 3h0m h LEU 104 CO 0.13 0.42 0.37 0.11 0.09 0.00 0.00 178.44 179.57 3h0m h LYS 105 N -0.23 0.64 0.00 1.13 1.57 -1.02 0.17 116.57 118.83 3h0m h LYS 105 Ca 0.01 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3h0m h LYS 105 Cb 0.38 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 3h0m h LYS 105 CO 0.00 0.42 -0.03 -0.22 -0.57 0.00 0.00 179.45 179.06 3h0m h LYS 106 N 0.66 0.00 -0.12 3.15 3.64 -1.30 -2.36 116.57 120.23 3h0m h LYS 106 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 3h0m h LYS 106 Cb 0.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 3h0m h LYS 106 CO -0.23 0.03 0.00 0.00 -2.27 0.00 0.00 179.45 176.98 3h0m n ALA 107 N -2.12 2.51 -0.12 5.00 0.00 0.55 -4.93 120.51 121.40 3h0m n ALA 107 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.82 3h0m n ALA 107 Cb 0.23 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.66 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 1.25 0.74 3.65 0.00 0.00 -0.89 -0.33 105.19 109.62 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 -2.40 1.19 -0.21 4.61 0.00 -0.80 -4.23 121.76 119.92 3h0m s ALA 109 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.39 3h0m s ALA 109 Cb 0.00 -3.40 0.05 0.00 0.00 0.00 0.00 23.12 19.78 3h0m s ALA 109 CO 0.00 -2.87 -0.05 -0.51 0.00 0.00 0.00 175.76 172.32 3h0m s LEU 110 N -6.66 2.16 -0.23 0.00 1.43 0.56 -4.60 118.68 111.34 3h0m s LEU 110 Ca 0.67 -0.98 -0.29 0.00 -1.03 0.00 0.00 54.13 52.50 3h0m s LEU 110 Cb -0.23 -1.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.91 3h0m s LEU 110 CO 0.59 -0.22 1.62 -0.63 0.23 0.00 0.00 176.35 177.94 3h0m s ILE 111 N 1.50 3.69 -2.55 -0.59 1.09 -1.26 -1.47 121.20 121.61 3h0m s ILE 111 Ca -0.03 0.77 0.22 0.00 -1.10 0.00 0.00 60.65 60.51 3h0m s ILE 111 Cb -0.17 -3.71 0.12 0.00 -1.06 0.00 0.00 42.46 37.64 3h0m s ILE 111 CO -0.07 -0.30 1.16 1.33 -0.10 0.00 0.00 174.94 176.96 3h0m n VAL 112 N 6.45 0.00 0.00 2.92 0.24 -0.52 -4.59 118.33 122.83 3h0m n VAL 112 Ca 0.19 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 62.05 3h0m n VAL 112 Cb 0.45 1.40 0.00 0.00 -1.47 0.00 0.00 33.84 34.23 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 1.29 1.27 3.34 7.63 0.00 -1.26 -0.57 105.19 116.88 3h0m n GLY 113 Ca 0.12 -1.08 -0.34 0.00 0.00 0.00 0.00 46.02 44.72 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 3.39 0.09 1.61 -0.14 0.19 -1.83 119.74 121.05 3h0m s LYS 114 Ca 0.00 -0.65 0.03 0.00 -1.36 0.00 0.00 55.97 53.99 3h0m s LYS 114 Cb 0.00 -2.83 -0.04 0.00 -1.68 0.00 0.00 37.83 33.28 3h0m s LYS 114 CO 0.00 0.01 0.11 -0.08 -0.76 0.00 0.00 175.35 174.63 3h0m s THR 115 N 0.91 4.69 0.75 2.17 -1.32 0.31 0.10 115.64 123.25 3h0m s THR 115 Ca -0.02 -0.74 -0.12 0.00 -1.21 0.00 0.00 61.69 59.61 3h0m s THR 115 Cb -0.15 -3.28 0.05 0.00 -1.51 0.00 0.00 72.50 67.60 3h0m s THR 115 CO 0.00 0.10 1.10 0.21 -2.21 0.00 0.00 174.62 173.82 3h0m s ASN 116 N -2.51 4.58 0.21 8.08 2.47 0.32 -2.35 114.94 125.75 3h0m s ASN 116 Ca 0.31 1.89 -0.21 0.00 0.42 0.00 0.00 52.86 55.27 3h0m s ASN 116 Cb -0.12 -2.53 0.04 0.00 -1.45 0.00 0.00 41.25 37.19 3h0m s ASN 116 CO 0.23 -1.99 0.63 -1.48 -3.72 0.00 0.00 177.10 170.78 3h0m s LEU 117 N -5.67 -0.33 0.52 3.21 2.34 -1.26 -2.58 118.68 114.91 3h0m s LEU 117 Ca 0.63 -0.33 -0.22 0.00 0.06 0.00 0.00 54.13 54.27 3h0m s LEU 117 Cb -0.18 2.57 -0.06 0.00 -0.56 0.00 0.00 46.19 47.96 3h0m s LEU 117 CO 0.52 -1.14 1.29 -1.81 -1.06 0.00 0.00 176.35 174.15 3h0m s ASP 118 N -2.84 5.56 0.10 1.48 1.01 -1.14 -3.03 116.67 117.82 3h0m s ASP 118 Ca 0.06 2.60 -0.31 0.00 0.71 0.00 0.00 52.55 55.62 3h0m s ASP 118 Cb -0.03 -2.62 -0.10 0.00 1.01 0.00 0.00 42.92 41.18 3h0m s ASP 118 CO -0.03 -1.36 1.88 -0.70 0.21 0.00 0.00 175.17 175.17 3h0m s GLU 119 N -2.85 4.14 -2.00 8.23 2.12 -0.80 -0.75 118.70 126.78 3h0m s GLU 119 Ca 0.69 2.61 0.00 0.00 0.36 0.00 0.00 54.97 58.63 3h0m s GLU 119 Cb -0.36 -3.75 0.00 0.00 0.26 0.00 0.00 34.13 30.28 3h0m s GLU 119 CO 0.43 -0.88 0.00 1.19 -0.54 0.00 0.00 175.26 175.46 3h0m n PHE 120 N 6.20 -0.42 -1.46 5.30 3.72 -0.36 -2.41 117.46 128.03 3h0m n PHE 120 Ca 0.18 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.51 3h0m n PHE 120 Cb 0.39 -3.65 -0.03 0.00 -0.94 0.00 0.00 39.48 35.25 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 -0.05 -0.15 -3.54 4.37 0.00 0.08 -4.81 120.51 116.41 3h0m n ALA 121 Ca -0.22 0.11 -0.39 0.00 0.00 0.00 0.00 53.44 52.94 3h0m n ALA 121 Cb 0.68 -1.09 -0.10 0.00 0.00 0.00 0.00 19.45 18.94 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 -3.10 2.38 0.00 0.00 -1.94 -1.01 -4.65 119.30 110.97 3h0m s MET 122 Ca 0.00 -1.66 0.00 0.00 -1.71 0.00 0.00 55.69 52.32 3h0m s MET 122 Cb 0.00 -3.74 0.00 0.00 2.01 0.00 0.00 34.83 33.10 3h0m s MET 122 CO 0.00 -1.05 0.00 0.41 -0.01 0.00 0.00 175.02 174.37 3h0m n GLY 123 N 4.81 2.16 0.19 -0.03 0.00 -1.26 -4.52 105.19 106.54 3h0m n GLY 123 Ca -0.07 -1.48 0.08 0.00 0.00 0.00 0.00 46.02 44.55 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 2.02 0.00 1.61 7.64 -1.26 -2.35 113.62 121.28 3h0m n SER 124 Ca 0.00 -3.05 0.00 0.00 1.01 0.00 0.00 58.87 56.83 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 -1.23 0.00 0.00 6.43 3.41 -1.23 -0.91 113.62 120.09 3h0m n SER 125 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 3h0m n SER 125 Cb 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 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 0.18 6.66 -1.04 -1.16 -4.17 114.28 114.76 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 -0.02 0.80 0.00 -1.82 0.00 0.00 70.33 69.29 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 2.21 0.00 -0.28 -2.82 5.08 -1.90 -2.26 114.58 114.61 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 -3.83 0.37 -1.64 4.33 4.01 -1.26 -4.75 117.16 114.39 3h0m n TYR 128 Ca 0.03 -0.18 -0.50 0.00 -0.16 0.00 0.00 57.90 57.08 3h0m n TYR 128 Cb 0.38 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.36 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 0.47 2.34 0.00 7.72 2.88 -0.85 -1.91 113.62 124.27 3h0m n SER 129 Ca 0.14 1.09 0.09 0.00 -1.33 0.00 0.00 58.87 58.86 3h0m n SER 129 Cb 0.32 -1.28 0.44 0.00 -0.75 0.00 0.00 64.21 62.94 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 3.46 1.93 -0.11 -1.46 0.00 -0.61 -3.96 120.51 119.76 3h0m n ALA 130 Ca 0.19 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.36 3h0m n ALA 130 Cb 0.22 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.42 0.00 -3.59 0.00 3.72 -1.26 -4.93 117.46 109.98 3h0m n PHE 131 Ca 0.06 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.40 3h0m n PHE 131 Cb 0.20 -0.72 -0.04 0.00 -0.94 0.00 0.00 39.48 37.99 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 -2.60 -0.20 0.26 1.38 -0.71 -1.25 -5.16 117.98 109.69 3h0m s PHE 132 Ca -0.31 0.27 -0.30 0.00 -1.04 0.00 0.00 56.93 55.55 3h0m s PHE 132 Cb 0.10 0.49 -0.09 0.00 -1.21 0.00 0.00 43.02 42.30 3h0m s PHE 132 CO 0.42 -0.23 1.10 -1.25 -1.34 0.00 0.00 175.22 173.92 3h0m s PRO 133 N -1.68 4.63 0.38 1.99 0.04 -1.26 -4.68 135.00 134.42 3h0m s PRO 133 Ca 0.05 1.79 -0.20 0.00 0.04 0.00 0.00 61.00 62.68 3h0m s PRO 133 Cb -0.01 -3.21 -0.10 0.00 0.04 0.00 0.00 34.50 31.22 3h0m s PRO 133 CO -0.04 0.18 0.88 0.99 0.04 0.00 0.00 177.00 179.05 3h0m s THR 134 N -0.95 4.45 0.01 1.26 2.01 -1.26 -4.83 115.64 116.33 3h0m s THR 134 Ca 0.46 1.38 0.05 0.00 0.31 0.00 0.00 61.69 63.88 3h0m s THR 134 Cb -0.32 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 3h0m s THR 134 CO 0.40 -0.21 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.44 3h0m s LYS 135 N -2.95 2.34 -0.18 4.92 -0.14 0.07 -4.40 119.74 119.40 3h0m s LYS 135 Ca 0.58 -0.82 -0.29 0.00 -1.36 0.00 0.00 55.97 54.08 3h0m s LYS 135 Cb -0.11 -2.34 -0.04 0.00 -1.68 0.00 0.00 37.83 33.66 3h0m s LYS 135 CO 0.16 0.58 1.74 1.21 -0.76 0.00 0.00 175.35 178.28 3h0m s ASN 136 N -1.26 6.27 0.00 2.83 3.84 0.63 -4.71 114.94 122.55 3h0m s ASN 136 Ca 0.15 1.81 0.00 0.00 0.21 0.00 0.00 52.86 55.02 3h0m s ASN 136 Cb -0.11 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.06 3h0m s ASN 136 CO 0.05 -1.32 0.98 -0.81 -2.79 0.00 0.00 177.10 173.21 3h0m n PRO 137 N 7.77 0.00 0.00 0.43 -0.04 -1.26 -1.24 135.00 140.67 3h0m n PRO 137 Ca 0.20 0.48 0.11 0.00 -0.04 0.00 0.00 63.50 64.25 3h0m n PRO 137 Cb 0.45 -1.51 -0.09 0.00 -0.04 0.00 0.00 33.50 32.31 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 -1.48 0.07 -3.15 0.54 7.02 -1.26 -4.08 117.44 115.10 3h0m n TRP 138 Ca 0.00 0.02 0.05 0.00 -1.02 0.00 0.00 57.50 56.55 3h0m n TRP 138 Cb 0.01 -0.25 -0.01 0.00 -2.42 0.00 0.00 31.31 28.64 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 -3.64 -0.73 0.00 -0.99 -1.08 -0.37 -4.91 116.67 104.94 3h0m s ASP 139 Ca 0.03 0.27 0.14 0.00 -0.52 0.00 0.00 52.55 52.47 3h0m s ASP 139 Cb 0.15 1.54 0.81 0.00 -1.46 0.00 0.00 42.92 43.96 3h0m s ASP 139 CO 0.86 -0.13 1.27 0.18 0.52 0.00 0.00 175.17 177.86 3h0m n LEU 140 N 5.35 0.00 -0.04 -1.34 4.77 -0.93 0.69 117.00 125.48 3h0m n LEU 140 Ca 0.01 0.04 0.14 0.00 -0.03 0.00 0.00 56.01 56.17 3h0m n LEU 140 Cb 0.55 -0.04 0.67 0.00 -2.33 0.00 0.00 43.42 42.26 3h0m n LEU 140 CO -0.10 -0.02 0.93 -0.62 -1.33 0.00 0.00 177.39 176.25 3h0m n GLU 141 N -1.04 0.47 -4.36 3.23 1.02 -1.26 -4.71 120.64 113.98 3h0m n GLU 141 Ca 0.10 -0.09 -0.27 0.00 -0.02 0.00 0.00 57.16 56.88 3h0m n GLU 141 Cb 0.06 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 29.87 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 -2.59 1.78 0.31 3.49 0.52 0.22 -3.29 118.95 119.39 3h0m s ARG 142 Ca 0.27 -1.41 -0.28 0.00 -0.52 0.00 0.00 55.73 53.79 3h0m s ARG 142 Cb 0.20 -1.99 -0.09 0.00 0.52 0.00 0.00 34.95 33.58 3h0m s ARG 142 CO 0.48 0.41 1.04 0.08 0.02 0.00 0.00 175.30 177.34 3h0m s VAL 143 N -1.72 3.74 -2.23 3.52 1.01 -0.74 -0.27 120.40 123.72 3h0m s VAL 143 Ca 0.23 1.59 0.24 0.00 0.00 0.00 0.00 61.98 64.04 3h0m s VAL 143 Cb -0.08 -3.95 0.56 0.00 0.00 0.00 0.00 36.38 32.90 3h0m s VAL 143 CO 0.13 0.26 1.73 -0.81 0.00 0.00 0.00 175.10 176.40 3h0m n PRO 144 N 0.82 1.45 0.00 2.72 -0.04 -1.26 -4.47 135.00 134.22 3h0m n PRO 144 Ca 0.01 -0.66 0.00 0.00 -0.04 0.00 0.00 63.50 62.81 3h0m n PRO 144 Cb 0.47 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 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 1.04 -0.02 3.65 0.55 0.00 -1.26 -4.35 105.19 104.80 3h0m n GLY 145 Ca 0.17 -1.92 -0.09 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.83 -0.27 0.21 -0.02 0.00 -0.09 -2.97 107.32 103.35 3h0m s GLY 146 Ca 0.00 -0.02 0.23 0.00 0.00 0.00 0.00 44.72 44.92 3h0m s GLY 146 CO 0.00 -0.03 1.07 1.48 0.00 0.00 0.00 173.10 175.61 3h0m h SER 147 N 2.03 0.00 0.00 1.64 4.64 -1.59 -3.39 113.55 116.89 3h0m h SER 147 Ca -0.26 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.01 3h0m h SER 147 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 3h0m h SER 147 CO 0.31 0.00 0.05 -1.20 -0.87 0.00 0.00 176.83 175.12 3h0m n SER 148 N -2.67 2.31 -0.03 4.97 7.64 -1.02 -2.88 113.62 121.93 3h0m n SER 148 Ca 0.00 -1.76 -0.09 0.00 1.01 0.00 0.00 58.87 58.03 3h0m n SER 148 Cb 0.55 -0.55 -0.02 0.00 -1.01 0.00 0.00 64.21 63.17 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 4.52 -0.23 1.89 0.23 0.00 -1.69 -2.55 103.07 105.23 3h0m h GLY 149 Ca 0.04 0.32 -0.07 0.00 0.00 0.00 0.00 47.33 47.62 3h0m h GLY 149 CO 0.18 -0.20 -0.29 -1.33 0.00 0.00 0.00 176.54 174.90 3h0m h GLY 150 N -0.29 0.14 1.78 4.60 0.00 -1.70 -1.25 103.07 106.35 3h0m h GLY 150 Ca 0.12 -0.11 -0.16 0.00 0.00 0.00 0.00 47.33 47.19 3h0m h GLY 150 CO -0.37 0.10 -0.68 1.76 0.00 0.00 0.00 176.54 177.35 3h0m h SER 151 N 0.12 0.26 0.32 0.19 0.02 -1.69 -1.38 113.55 111.39 3h0m h SER 151 Ca 0.02 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.79 3h0m h SER 151 Cb 0.58 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.05 3h0m h SER 151 CO 0.04 0.86 -0.15 0.00 -1.14 0.00 0.00 176.83 176.44 3h0m h ALA 152 N 1.14 -0.43 -0.58 3.77 0.00 -1.28 -3.19 119.26 118.69 3h0m h ALA 152 Ca -0.02 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 54.86 3h0m h ALA 152 Cb 1.22 0.16 -0.09 0.00 0.00 0.00 0.00 17.79 19.08 3h0m h ALA 152 CO 0.10 -0.43 0.04 0.00 0.00 0.00 0.00 179.25 178.97 3h0m h ALA 153 N -0.84 0.61 0.00 0.00 0.00 -1.22 0.10 119.26 117.91 3h0m h ALA 153 Ca -0.04 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3h0m h ALA 153 Cb 0.45 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3h0m h ALA 153 CO 0.07 -0.37 -0.37 0.66 0.00 0.00 0.00 179.25 179.24 3h0m h SER 154 N 0.16 0.00 0.88 0.00 4.64 -1.38 -0.50 113.55 117.35 3h0m h SER 154 Ca 0.30 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.45 3h0m h SER 154 Cb 0.47 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.54 3h0m h SER 154 CO -0.46 0.37 -0.84 0.58 -0.87 0.00 0.00 176.83 175.62 3h0m h VAL 155 N 0.00 1.58 0.03 0.95 2.07 -1.21 -1.21 116.25 118.46 3h0m h VAL 155 Ca -0.00 -2.90 -0.00 0.00 0.82 0.00 0.00 66.70 64.62 3h0m h VAL 155 Cb 0.72 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 33.07 3h0m h VAL 155 CO 0.05 0.82 -0.02 0.00 0.02 0.00 0.00 177.57 178.44 3h0m h ALA 156 N 1.16 -0.05 0.00 1.67 0.00 0.44 -2.94 119.26 119.55 3h0m h ALA 156 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3h0m h ALA 156 Cb 1.50 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.31 3h0m h ALA 156 CO 0.11 -0.41 0.00 1.33 0.00 0.00 0.00 179.25 180.28 3h0m n VAL 157 N -5.00 0.26 -2.43 0.00 0.24 -0.32 -4.42 118.33 106.66 3h0m n VAL 157 Ca -0.08 0.01 -0.15 0.00 -2.04 0.00 0.00 64.34 62.08 3h0m n VAL 157 Cb 0.15 -0.61 0.00 0.00 -1.47 0.00 0.00 33.84 31.91 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 -1.63 -1.86 0.03 1.34 4.77 -0.66 -4.89 117.00 114.10 3h0m n LEU 158 Ca 0.06 -0.07 0.08 0.00 -0.03 0.00 0.00 56.01 56.05 3h0m n LEU 158 Cb 0.32 -2.17 0.35 0.00 -2.33 0.00 0.00 43.42 39.59 3h0m n LEU 158 CO 0.25 -0.05 0.76 -1.54 -1.33 0.00 0.00 177.39 175.48 3h0m n SER 159 N -0.86 0.13 -3.72 -1.43 3.41 -0.55 -4.64 113.62 105.96 3h0m n SER 159 Ca -0.14 0.53 -0.14 0.00 -0.26 0.00 0.00 58.87 58.86 3h0m n SER 159 Cb 0.61 -0.56 -0.09 0.00 -0.26 0.00 0.00 64.21 63.91 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 -3.06 -1.03 0.17 7.33 0.00 -1.00 -4.71 121.76 119.46 3h0m s ALA 160 Ca 0.07 0.91 0.03 0.00 0.00 0.00 0.00 51.96 52.96 3h0m s ALA 160 Cb 0.10 -0.36 -0.00 0.00 0.00 0.00 0.00 23.12 22.86 3h0m s ALA 160 CO 0.30 -0.24 1.38 -1.00 0.00 0.00 0.00 175.76 176.20 3h0m h PRO 161 N 4.67 0.17 -4.02 0.00 0.13 -1.82 -3.32 132.00 127.80 3h0m h PRO 161 Ca -0.28 -0.18 -0.10 0.00 -0.87 0.00 0.00 66.00 64.56 3h0m h PRO 161 Cb 1.18 0.05 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 3h0m h PRO 161 CO 0.31 0.93 -0.51 0.54 -0.23 0.00 0.00 178.00 179.04 3h0m s VAL 162 N -3.19 0.17 -0.04 1.56 0.11 -1.26 -4.31 120.40 113.44 3h0m s VAL 162 Ca -0.02 -1.49 -0.20 0.00 -2.93 0.00 0.00 61.98 57.34 3h0m s VAL 162 Cb 0.10 -1.46 0.04 0.00 -1.53 0.00 0.00 36.38 33.53 3h0m s VAL 162 CO 0.82 -0.79 0.44 -0.55 -3.33 0.00 0.00 175.10 171.70 3h0m s SER 163 N -2.90 -0.37 -0.15 3.54 0.15 -0.39 -2.95 113.70 110.64 3h0m s SER 163 Ca 0.07 0.37 -0.06 0.00 0.70 0.00 0.00 55.95 57.04 3h0m s SER 163 Cb 0.06 0.45 -0.04 0.00 -1.71 0.00 0.00 66.02 64.79 3h0m s SER 163 CO -0.10 -0.46 0.05 -0.76 1.20 0.00 0.00 173.24 173.17 3h0m s LEU 164 N -1.11 3.78 0.00 3.45 1.02 -0.69 -0.89 118.68 124.25 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 -1.92 -0.00 0.00 0.02 0.00 0.00 46.19 44.25 3h0m s LEU 164 CO 0.06 0.26 0.04 0.61 0.02 0.00 0.00 176.35 177.33 3h0m n GLY 165 N 2.98 3.86 3.15 -3.19 0.00 -0.45 -2.27 105.19 109.25 3h0m n GLY 165 Ca -0.18 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.73 1.31 -0.22 1.61 1.04 -1.26 -1.39 113.70 113.05 3h0m s SER 166 Ca 0.06 -0.73 -0.01 0.00 0.48 0.00 0.00 55.95 55.75 3h0m s SER 166 Cb 0.00 0.01 0.07 0.00 0.10 0.00 0.00 66.02 66.20 3h0m s SER 166 CO 0.04 -0.23 0.01 -0.62 0.98 0.00 0.00 173.24 173.42 3h0m s ASP 167 N -2.16 3.38 -0.20 7.02 -1.08 1.00 -3.39 116.67 121.24 3h0m s ASP 167 Ca 0.01 -1.06 0.09 0.00 -0.52 0.00 0.00 52.55 51.07 3h0m s ASP 167 Cb -0.05 -0.83 -0.19 0.00 -1.46 0.00 0.00 42.92 40.39 3h0m s ASP 167 CO 0.00 -0.30 -0.07 0.41 0.52 0.00 0.00 175.17 175.74 3h0m n THR 168 N 4.89 1.28 -2.33 1.71 -1.04 -1.26 -2.10 114.28 115.43 3h0m n THR 168 Ca -0.09 -0.64 -0.03 0.00 -2.04 0.00 0.00 64.05 61.25 3h0m n THR 168 Cb 0.45 -0.91 0.00 0.00 -1.82 0.00 0.00 70.33 68.06 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 2.14 1.06 0.00 3.41 0.00 -1.26 -4.68 105.19 105.85 3h0m n GLY 169 Ca -0.35 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.28 0.21 0.00 -0.02 0.00 -1.26 -3.63 105.19 100.20 3h0m n GLY 170 Ca -0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 -0.11 1.61 7.64 -1.26 -0.74 113.62 120.76 3h0m n SER 171 Ca 0.00 -0.12 -0.19 0.00 1.01 0.00 0.00 58.87 59.57 3h0m n SER 171 Cb 0.00 -0.27 -0.07 0.00 -1.01 0.00 0.00 64.21 62.86 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 -1.27 1.51 -0.14 0.44 5.41 -1.22 -2.43 119.36 121.66 3h0m n ILE 172 Ca 0.13 -0.11 -0.08 0.00 1.00 0.00 0.00 62.75 63.69 3h0m n ILE 172 Cb 0.20 -2.12 0.01 0.00 -0.71 0.00 0.00 39.64 37.02 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 -1.00 0.59 -0.18 0.38 3.08 -1.69 -1.05 114.38 114.52 3h0m h ARG 173 Ca -0.35 -0.04 -0.18 0.00 0.07 0.00 0.00 59.98 59.49 3h0m h ARG 173 Cb 1.29 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 3h0m h ARG 173 CO -0.21 0.39 -0.61 -0.56 -1.07 0.00 0.00 179.97 177.91 3h0m h GLN 174 N 0.60 0.60 -0.77 0.04 -0.00 -1.24 0.16 115.11 114.50 3h0m h GLN 174 Ca 0.16 -0.41 0.12 0.00 -0.00 0.00 0.00 58.65 58.52 3h0m h GLN 174 Cb -0.06 0.06 -0.08 0.00 -0.00 0.00 0.00 27.48 27.39 3h0m h GLN 174 CO -0.03 1.03 0.38 -1.35 -0.00 0.00 0.00 178.83 178.86 3h0m h PRO 175 N 0.45 0.57 -0.88 0.06 0.11 -1.74 -0.55 132.00 130.02 3h0m h PRO 175 Ca -0.01 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3h0m h PRO 175 Cb 1.18 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 3h0m h PRO 175 CO 0.12 0.38 0.55 0.00 -0.21 0.00 0.00 178.00 178.84 3h0m h ALA 176 N 1.50 1.12 0.43 -0.75 0.00 -0.45 -0.71 119.26 120.39 3h0m h ALA 176 Ca 0.40 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 3h0m h ALA 176 Cb 0.52 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3h0m h ALA 176 CO -0.33 0.56 -0.20 1.03 0.00 0.00 0.00 179.25 180.31 3h0m h SER 177 N 1.20 -0.48 -0.47 0.00 0.87 -0.19 -0.01 113.55 114.47 3h0m h SER 177 Ca 0.32 -0.10 0.05 0.00 -1.23 0.00 0.00 61.79 60.83 3h0m h SER 177 Cb -0.08 0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 3h0m h SER 177 CO -0.06 -0.16 0.31 -0.26 -0.53 0.00 0.00 176.83 176.13 3h0m h PHE 178 N -0.83 0.44 -0.27 2.24 -1.00 -1.02 -2.49 116.94 114.01 3h0m h PHE 178 Ca -0.06 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.73 3h0m h PHE 178 Cb 0.55 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.97 3h0m h PHE 178 CO 0.01 0.24 0.00 0.00 -1.61 0.00 0.00 178.31 176.95 3h0m n GLY 180 N 1.46 0.10 3.12 0.00 0.00 -0.39 -4.76 105.19 104.71 3h0m n GLY 180 Ca 0.18 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.18 0.44 0.10 1.61 1.01 -0.16 -4.88 120.40 115.34 3h0m s VAL 181 Ca 0.15 -1.77 -0.30 0.00 0.00 0.00 0.00 61.98 60.06 3h0m s VAL 181 Cb -0.06 -1.46 -0.06 0.00 0.00 0.00 0.00 36.38 34.80 3h0m s VAL 181 CO 0.38 -0.88 1.01 -0.63 0.00 0.00 0.00 175.10 174.98 3h0m s ILE 182 N -3.50 4.41 -0.08 2.22 1.01 0.10 -4.31 121.20 121.06 3h0m s ILE 182 Ca 0.07 1.93 -0.04 0.00 0.00 0.00 0.00 60.65 62.61 3h0m s ILE 182 Cb 0.05 -4.24 0.04 0.00 0.01 0.00 0.00 42.46 38.32 3h0m s ILE 182 CO -0.07 0.26 0.19 -0.83 0.00 0.00 0.00 174.94 174.50 3h0m s GLY 183 N 0.25 -0.09 -0.03 6.18 0.00 -0.66 -1.14 107.32 111.83 3h0m s GLY 183 Ca 0.49 0.79 0.06 0.00 0.00 0.00 0.00 44.72 46.07 3h0m s GLY 183 CO 0.30 1.03 -0.22 -1.50 0.00 0.00 0.00 173.10 172.71 3h0m s ILE 184 N 1.06 1.77 -0.24 0.90 2.07 -0.45 -0.84 121.20 125.48 3h0m s ILE 184 Ca -0.08 -0.94 -0.03 0.00 -1.41 0.00 0.00 60.65 58.19 3h0m s ILE 184 Cb -0.10 -1.48 0.01 0.00 0.13 0.00 0.00 42.46 41.03 3h0m s ILE 184 CO -0.06 0.50 -0.05 -0.75 -1.91 0.00 0.00 174.94 172.67 3h0m s LYS 185 N -0.41 3.09 1.10 3.50 2.20 -0.64 -2.14 119.74 126.44 3h0m s LYS 185 Ca 0.05 -0.81 -0.18 0.00 -0.36 0.00 0.00 55.97 54.67 3h0m s LYS 185 Cb -0.10 -3.01 0.25 0.00 -1.51 0.00 0.00 37.83 33.46 3h0m s LYS 185 CO 0.00 -0.31 1.21 -1.25 -0.36 0.00 0.00 175.35 174.65 3h0m s PRO 186 N 1.41 -0.41 0.39 4.03 0.04 -1.26 -1.30 135.00 137.90 3h0m s PRO 186 Ca 0.03 -0.26 -0.26 0.00 0.04 0.00 0.00 61.00 60.55 3h0m s PRO 186 Cb -0.15 -1.71 -0.11 0.00 0.04 0.00 0.00 34.50 32.57 3h0m s PRO 186 CO -0.04 -3.14 1.27 2.41 0.04 0.00 0.00 177.00 177.55 3h0m n THR 187 N -4.31 2.34 -1.69 1.26 -1.04 -1.26 -4.32 114.28 105.26 3h0m n THR 187 Ca 0.15 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.23 3h0m n THR 187 Cb 0.59 -1.56 -0.03 0.00 -1.82 0.00 0.00 70.33 67.51 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 -1.16 1.73 0.00 -1.42 5.04 -0.84 -1.03 117.35 119.67 3h0m s TYR 188 Ca 0.59 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.98 3h0m s TYR 188 Cb -0.53 -4.21 0.00 0.00 0.35 0.00 0.00 41.96 37.57 3h0m s TYR 188 CO 0.60 -5.22 0.00 0.41 -1.34 0.00 0.00 175.55 170.00 3h0m n GLY 189 N 4.38 1.54 0.14 8.97 0.00 -1.26 -4.92 105.19 114.05 3h0m n GLY 189 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.22 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 2.46 0.00 -5.72 1.61 2.43 -1.42 -0.94 114.38 112.81 3h0m h ARG 190 Ca 0.00 0.00 -0.59 0.00 -0.81 0.00 0.00 59.98 58.58 3h0m h ARG 190 Cb 0.00 0.00 -0.30 0.00 -0.42 0.00 0.00 29.97 29.25 3h0m h ARG 190 CO 0.00 0.55 -0.85 0.08 -1.51 0.00 0.00 179.97 178.24 3h0m s VAL 191 N -3.25 1.58 0.57 0.20 1.01 -1.26 -0.74 120.40 118.50 3h0m s VAL 191 Ca 0.01 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 60.96 3h0m s VAL 191 Cb 0.10 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 3h0m s VAL 191 CO 0.74 0.45 1.33 -0.55 0.00 0.00 0.00 175.10 177.07 3h0m s SER 192 N -0.25 5.12 -0.04 3.32 0.15 -1.26 -4.75 113.70 115.98 3h0m s SER 192 Ca 0.02 2.71 0.15 0.00 0.70 0.00 0.00 55.95 59.53 3h0m s SER 192 Cb -0.10 -2.63 0.49 0.00 -1.71 0.00 0.00 66.02 62.07 3h0m s SER 192 CO 0.01 -1.67 1.41 0.54 1.20 0.00 0.00 173.24 174.73 3h0m n ARG 193 N -1.26 3.01 -2.42 5.44 1.74 -1.26 -4.72 116.66 117.20 3h0m n ARG 193 Ca 0.12 -2.44 -0.43 0.00 -0.77 0.00 0.00 57.85 54.33 3h0m n ARG 193 Cb 0.46 -1.52 -0.02 0.00 -1.02 0.00 0.00 32.46 30.36 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 -1.38 2.56 0.00 -1.55 5.04 -1.26 -2.14 117.35 118.61 3h0m s TYR 194 Ca 0.36 0.74 0.00 0.00 -2.44 0.00 0.00 57.07 55.73 3h0m s TYR 194 Cb 0.22 -4.22 0.00 0.00 0.35 0.00 0.00 41.96 38.30 3h0m s TYR 194 CO 0.20 -1.77 0.00 0.41 -1.34 0.00 0.00 175.55 173.05 3h0m n GLY 195 N 4.83 0.79 3.57 8.97 0.00 -1.26 -0.82 105.19 121.26 3h0m n GLY 195 Ca 0.15 0.00 -0.39 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 4.26 -0.09 0.99 2.96 -0.91 -1.33 118.68 124.55 3h0m s LEU 196 Ca 0.00 -0.12 -0.29 0.00 -0.22 0.00 0.00 54.13 53.50 3h0m s LEU 196 Cb 0.00 -2.24 -0.07 0.00 0.50 0.00 0.00 46.19 44.38 3h0m s LEU 196 CO 0.00 -0.20 2.10 0.52 -1.32 0.00 0.00 176.35 177.45 3h0m n VAL 197 N 5.13 0.56 -2.16 1.68 0.31 0.30 -4.87 118.33 119.27 3h0m n VAL 197 Ca -0.11 -0.29 -0.42 0.00 -0.01 0.00 0.00 64.34 63.51 3h0m n VAL 197 Cb 0.50 -2.41 -0.03 0.00 -0.91 0.00 0.00 33.84 30.99 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 6.33 3.56 -0.00 3.52 0.00 -1.26 -4.95 121.76 128.97 3h0m s ALA 198 Ca 0.95 1.16 -0.01 0.00 0.00 0.00 0.00 51.96 54.06 3h0m s ALA 198 Cb -0.40 -3.51 -0.00 0.00 0.00 0.00 0.00 23.12 19.20 3h0m s ALA 198 CO 0.39 -0.60 -0.01 0.34 0.00 0.00 0.00 175.76 175.89 3h0m n PHE 199 N 2.88 0.00 -3.87 0.00 7.35 -1.26 -4.77 117.46 117.79 3h0m n PHE 199 Ca 0.08 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.46 3h0m n PHE 199 Cb 0.42 -0.02 -0.15 0.00 0.35 0.00 0.00 39.48 40.08 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 -2.59 1.99 0.32 3.13 0.00 -1.26 -2.36 121.76 120.99 3h0m s ALA 200 Ca -0.01 -1.76 0.04 0.00 0.00 0.00 0.00 51.96 50.23 3h0m s ALA 200 Cb 0.00 -1.64 0.65 0.00 0.00 0.00 0.00 23.12 22.13 3h0m s ALA 200 CO 0.01 -1.51 1.88 0.77 0.00 0.00 0.00 175.76 176.91 3h0m h SER 201 N 7.93 0.81 0.32 0.00 0.02 -1.93 0.12 113.55 120.82 3h0m h SER 201 Ca -0.12 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3h0m h SER 201 Cb 1.04 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.44 3h0m h SER 201 CO 0.46 0.46 -0.00 -1.54 -1.14 0.00 0.00 176.83 175.07 3h0m n SER 202 N -4.55 0.02 0.00 3.07 3.41 -1.26 -4.08 113.62 110.23 3h0m n SER 202 Ca 0.16 -0.53 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 3h0m n SER 202 Cb 0.34 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 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 -1.15 0.00 -4.76 1.04 4.77 -0.53 -4.96 117.00 111.42 3h0m n LEU 203 Ca 0.19 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.75 3h0m n LEU 203 Cb 0.19 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 3h0m n LEU 203 CO 0.21 0.00 1.21 -1.81 -1.33 0.00 0.00 177.39 175.67 3h0m s ASP 204 N -2.32 6.35 -0.12 -1.43 1.01 0.31 -4.45 116.67 116.02 3h0m s ASP 204 Ca 0.00 3.00 -0.11 0.00 0.71 0.00 0.00 52.55 56.16 3h0m s ASP 204 Cb 0.00 -2.65 0.03 0.00 1.01 0.00 0.00 42.92 41.32 3h0m s ASP 204 CO 0.00 -0.91 0.32 -1.10 0.21 0.00 0.00 175.17 173.69 3h0m s GLN 205 N -1.09 0.36 0.50 8.23 -1.52 -0.89 -4.87 119.66 120.37 3h0m s GLN 205 Ca 0.60 0.46 -0.22 0.00 -1.95 0.00 0.00 55.36 54.25 3h0m s GLN 205 Cb -0.48 0.15 -0.06 0.00 -0.22 0.00 0.00 33.01 32.40 3h0m s GLN 205 CO 0.54 -0.06 1.23 0.42 -0.25 0.00 0.00 175.29 177.17 3h0m s ILE 206 N 0.30 2.72 0.00 1.08 1.01 -1.26 -0.00 121.20 125.05 3h0m s ILE 206 Ca -0.01 0.54 0.00 0.00 0.00 0.00 0.00 60.65 61.18 3h0m s ILE 206 Cb -0.03 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.17 3h0m s ILE 206 CO -0.01 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.53 3h0m n GLY 207 N 0.54 3.10 3.05 6.18 0.00 -0.49 -4.48 105.19 113.09 3h0m n GLY 207 Ca 0.09 -1.35 -0.21 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.46 0.88 -0.06 1.61 1.01 -0.91 -1.35 120.40 119.12 3h0m s VAL 208 Ca 0.00 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 3h0m s VAL 208 Cb 0.00 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 3h0m s VAL 208 CO 0.00 0.26 -0.03 -0.36 0.00 0.00 0.00 175.10 174.97 3h0m s PHE 209 N -0.10 3.06 0.29 5.22 0.08 -0.07 -1.34 117.98 125.12 3h0m s PHE 209 Ca 0.02 0.11 -0.09 0.00 0.12 0.00 0.00 56.93 57.08 3h0m s PHE 209 Cb -0.06 -1.73 0.04 0.00 -0.57 0.00 0.00 43.02 40.69 3h0m s PHE 209 CO -0.00 0.42 0.55 0.41 -0.10 0.00 0.00 175.22 176.50 3h0m n GLY 210 N 2.03 1.44 0.03 4.36 0.00 -0.29 -1.27 105.19 111.49 3h0m n GLY 210 Ca -0.18 -1.26 -0.02 0.00 0.00 0.00 0.00 46.02 44.56 3h0m n GLY 210 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h0m n ARG 211 N -0.41 2.41 -4.78 1.61 1.74 -1.26 -0.72 116.66 115.25 3h0m n ARG 211 Ca -0.05 -0.02 -0.32 0.00 -0.77 0.00 0.00 57.85 56.69 3h0m n ARG 211 Cb 0.45 -1.16 -0.13 0.00 -1.02 0.00 0.00 32.46 30.60 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 -2.22 2.41 0.46 5.56 0.52 -1.26 -4.47 118.95 119.95 3h0m s ARG 212 Ca -0.03 -0.76 0.12 0.00 -0.52 0.00 0.00 55.73 54.54 3h0m s ARG 212 Cb 0.02 -2.35 1.07 0.00 0.52 0.00 0.00 34.95 34.21 3h0m s ARG 212 CO 0.27 0.60 2.08 1.15 0.02 0.00 0.00 175.30 179.42 3h0m h THR 213 N 4.16 1.02 -0.49 0.02 2.02 -1.93 -1.62 112.91 116.09 3h0m h THR 213 Ca -0.47 -0.10 -0.12 0.00 0.77 0.00 0.00 66.41 66.49 3h0m h THR 213 Cb 1.16 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 3h0m h THR 213 CO 0.50 0.05 -0.17 -0.33 0.37 0.00 0.00 175.52 175.95 3h0m h GLU 214 N 0.29 0.97 -0.01 6.66 5.08 -1.95 -0.45 114.58 125.16 3h0m h GLU 214 Ca 0.11 -0.38 0.03 0.00 -1.00 0.00 0.00 59.36 58.12 3h0m h GLU 214 Cb 0.10 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 3h0m h GLU 214 CO -0.02 1.05 -0.16 -0.44 -1.00 0.00 0.00 179.01 178.44 3h0m h ASP 215 N 0.85 -0.46 -0.62 1.42 3.32 -1.73 -1.84 116.42 117.36 3h0m h ASP 215 Ca 0.12 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 3h0m h ASP 215 Cb 0.73 0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 3h0m h ASP 215 CO 0.06 -0.22 0.27 0.58 -1.72 0.00 0.00 179.24 178.21 3h0m h VAL 216 N -0.25 1.22 -0.14 -1.35 2.07 -1.35 -2.38 116.25 114.07 3h0m h VAL 216 Ca 0.06 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 3h0m h VAL 216 Cb 0.33 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 3h0m h VAL 216 CO -0.16 0.27 -0.15 0.00 0.02 0.00 0.00 177.57 177.54 3h0m h ALA 217 N 1.11 1.49 0.05 1.67 0.00 -0.92 -2.38 119.26 120.28 3h0m h ALA 217 Ca 0.21 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3h0m h ALA 217 Cb 0.16 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.88 3h0m h ALA 217 CO -0.02 0.36 -0.56 1.25 0.00 0.00 0.00 179.25 180.28 3h0m h LEU 218 N 0.21 0.41 -0.86 0.00 5.85 -1.09 -2.07 115.31 117.75 3h0m h LEU 218 Ca 0.04 -0.85 -0.01 0.00 0.84 0.00 0.00 57.88 57.90 3h0m h LEU 218 Cb 0.40 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 3h0m h LEU 218 CO 0.02 1.21 0.51 0.58 -0.34 0.00 0.00 178.44 180.43 3h0m h VAL 219 N -0.35 1.24 -0.19 1.05 2.07 -1.41 -1.88 116.25 116.79 3h0m h VAL 219 Ca -0.08 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 66.90 3h0m h VAL 219 Cb 1.34 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3h0m h VAL 219 CO 0.11 0.26 0.11 0.25 0.02 0.00 0.00 177.57 178.31 3h0m h LEU 220 N 1.19 0.18 -0.90 2.57 5.85 -1.49 -2.27 115.31 120.44 3h0m h LEU 220 Ca 0.31 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.09 3h0m h LEU 220 Cb -0.04 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 3h0m h LEU 220 CO -0.06 0.13 0.57 -0.08 -0.34 0.00 0.00 178.44 178.67 3h0m h GLU 221 N 0.23 1.03 -0.23 1.25 4.81 -0.95 -1.64 114.58 119.07 3h0m h GLU 221 Ca 0.07 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3h0m h GLU 221 Cb -0.01 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 3h0m h GLU 221 CO -0.03 0.68 0.02 0.28 -0.73 0.00 0.00 179.01 179.23 3h0m h VAL 222 N 1.06 1.24 0.00 0.32 2.07 -1.02 -3.19 116.25 116.73 3h0m h VAL 222 Ca 0.38 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 67.09 3h0m h VAL 222 Cb 0.13 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 3h0m h VAL 222 CO -0.16 0.26 -0.14 2.30 0.02 0.00 0.00 177.57 179.85 3h0m n ILE 223 N -4.69 0.28 -2.13 4.57 -5.35 -0.88 -4.84 119.36 106.32 3h0m n ILE 223 Ca -0.04 -0.15 -0.27 0.00 -0.27 0.00 0.00 62.75 62.03 3h0m n ILE 223 Cb 0.22 -0.40 0.07 0.00 -1.74 0.00 0.00 39.64 37.78 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 -3.77 4.81 0.00 7.28 0.01 -0.64 -4.52 113.70 116.87 3h0m s SER 224 Ca 0.11 0.57 0.00 0.00 1.31 0.00 0.00 55.95 57.94 3h0m s SER 224 Cb 0.15 -1.20 0.00 0.00 0.21 0.00 0.00 66.02 65.18 3h0m s SER 224 CO 0.60 -1.63 0.00 0.61 0.41 0.00 0.00 173.24 173.23 3h0m n GLY 225 N -3.00 2.51 3.64 3.44 0.00 0.08 -4.98 105.19 106.88 3h0m n GLY 225 Ca 0.08 -1.97 -0.45 0.00 0.00 0.00 0.00 46.02 43.68 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 0.62 1.79 -3.98 1.61 -0.00 -1.24 -4.43 117.44 111.81 3h0m n TRP 226 Ca 0.00 0.58 -0.24 0.00 -0.00 0.00 0.00 57.50 57.83 3h0m n TRP 226 Cb 0.00 -2.36 -0.17 0.00 -0.00 0.00 0.00 31.31 28.78 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 -0.12 1.76 0.60 5.87 2.15 -1.26 -5.02 116.67 120.64 3h0m s ASP 227 Ca 0.64 -0.21 0.36 0.00 0.43 0.00 0.00 52.55 53.76 3h0m s ASP 227 Cb -0.68 -0.66 1.90 0.00 -0.30 0.00 0.00 42.92 43.18 3h0m s ASP 227 CO 0.56 -0.11 2.22 1.05 -0.17 0.00 0.00 175.17 178.71 3h0m h GLU 228 N 7.93 0.00 -0.02 4.34 4.11 -1.97 -1.49 114.58 127.48 3h0m h GLU 228 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 3h0m h GLU 228 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 3h0m h GLU 228 CO 0.38 0.03 0.00 1.63 0.07 0.00 0.00 179.01 181.12 3h0m n LYS 229 N -3.39 1.32 -3.83 1.06 5.02 -1.26 -4.70 118.16 112.39 3h0m n LYS 229 Ca -0.02 -0.47 -0.28 0.00 -2.02 0.00 0.00 58.31 55.52 3h0m n LYS 229 Cb 0.15 -1.47 -0.16 0.00 -0.02 0.00 0.00 35.03 33.53 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 -1.93 2.98 0.43 4.39 2.15 -0.56 -4.82 116.67 119.30 3h0m s ASP 230 Ca 0.41 -0.79 0.19 0.00 0.43 0.00 0.00 52.55 52.79 3h0m s ASP 230 Cb 0.20 -0.80 0.99 0.00 -0.30 0.00 0.00 42.92 43.01 3h0m s ASP 230 CO 0.34 -0.25 1.91 0.28 -0.17 0.00 0.00 175.17 177.27 3h0m h SER 231 N 8.15 0.00 0.28 -0.34 0.02 -1.84 -2.70 113.55 117.12 3h0m h SER 231 Ca -0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 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 0.37 0.27 -0.35 0.35 -1.14 0.00 0.00 176.83 176.32 3h0m n THR 232 N -3.84 0.00 -2.63 -2.27 -2.24 -1.26 -4.88 114.28 97.16 3h0m n THR 232 Ca -0.02 -0.10 -0.40 0.00 -2.27 0.00 0.00 64.05 61.26 3h0m n THR 232 Cb 0.35 0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 68.97 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 -2.63 7.46 0.16 3.42 1.04 -1.02 -4.44 113.70 117.69 3h0m s SER 233 Ca 0.20 2.05 -0.23 0.00 0.48 0.00 0.00 55.95 58.45 3h0m s SER 233 Cb 0.19 -2.61 -0.08 0.00 0.10 0.00 0.00 66.02 63.62 3h0m s SER 233 CO 0.58 -0.02 0.73 0.00 0.98 0.00 0.00 173.24 175.51 3h0m s ALA 234 N -0.89 3.46 -1.38 5.32 0.00 -0.36 -4.78 121.76 123.14 3h0m s ALA 234 Ca 0.44 0.27 -0.09 0.00 0.00 0.00 0.00 51.96 52.57 3h0m s ALA 234 Cb -0.28 -2.88 0.09 0.00 0.00 0.00 0.00 23.12 20.06 3h0m s ALA 234 CO 0.35 0.32 2.23 1.63 0.00 0.00 0.00 175.76 180.29 3h0m n LYS 235 N 1.41 3.74 -4.68 0.00 5.02 -1.26 -3.62 118.16 118.77 3h0m n LYS 235 Ca -0.06 -3.14 -0.25 0.00 -2.02 0.00 0.00 58.31 52.84 3h0m n LYS 235 Cb 0.50 -2.90 -0.16 0.00 -0.02 0.00 0.00 35.03 32.45 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 0.77 1.22 0.47 -0.18 1.01 -1.26 -5.07 120.40 117.36 3h0m s VAL 236 Ca 0.49 -0.59 -0.24 0.00 0.00 0.00 0.00 61.98 61.64 3h0m s VAL 236 Cb 0.14 -1.07 -0.07 0.00 0.00 0.00 0.00 36.38 35.37 3h0m s VAL 236 CO -0.05 0.36 1.35 -2.16 0.00 0.00 0.00 175.10 174.60 3h0m s PRO 237 N 0.22 3.61 -0.21 2.72 0.04 -1.26 -4.54 135.00 135.58 3h0m s PRO 237 Ca -0.06 2.23 -0.29 0.00 0.04 0.00 0.00 61.00 62.92 3h0m s PRO 237 Cb -0.12 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 31.88 3h0m s PRO 237 CO 0.02 -0.81 1.01 0.08 0.04 0.00 0.00 177.00 177.35 3h0m s VAL 238 N -1.28 4.72 0.55 -0.36 1.01 -1.26 -5.03 120.40 118.75 3h0m s VAL 238 Ca 0.63 1.98 -0.20 0.00 0.00 0.00 0.00 61.98 64.39 3h0m s VAL 238 Cb -0.40 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.65 3h0m s VAL 238 CO 0.50 -0.14 1.25 -2.84 0.00 0.00 0.00 175.10 173.87 3h0m s PRO 239 N 2.95 3.15 -1.22 2.72 0.02 -1.26 -4.88 135.00 136.48 3h0m s PRO 239 Ca 0.44 1.96 -0.19 0.00 0.02 0.00 0.00 61.00 63.23 3h0m s PRO 239 Cb -0.16 -2.12 -0.01 0.00 0.02 0.00 0.00 34.50 32.23 3h0m s PRO 239 CO 0.08 -1.10 1.91 0.39 -0.33 0.00 0.00 177.00 177.95 3h0m n GLU 240 N -1.21 2.44 0.01 5.54 1.02 -1.26 -4.78 120.64 122.40 3h0m n GLU 240 Ca 0.11 -2.73 -0.01 0.00 -0.02 0.00 0.00 57.16 54.52 3h0m n GLU 240 Cb 0.48 -3.45 0.28 0.00 -0.02 0.00 0.00 31.44 28.73 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 7.96 0.52 0.00 -0.32 6.55 -1.90 -2.28 115.95 126.49 3h0m h TRP 241 Ca 0.40 -0.07 -0.03 0.00 0.95 0.00 0.00 58.89 60.14 3h0m h TRP 241 Cb 0.82 -0.15 -0.00 0.00 -0.86 0.00 0.00 29.16 28.97 3h0m h TRP 241 CO 1.34 0.56 -0.14 0.66 -1.05 0.00 0.00 178.44 179.81 3h0m h SER 242 N 0.47 0.00 0.21 -3.49 4.64 -1.86 -0.56 113.55 112.96 3h0m h SER 242 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3h0m h SER 242 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3h0m h SER 242 CO 0.02 0.14 -0.28 -0.62 -0.87 0.00 0.00 176.83 175.22 3h0m n GLU 243 N -4.13 0.87 -0.05 4.77 -0.58 -0.89 -4.43 120.64 116.20 3h0m n GLU 243 Ca -0.02 -0.54 -0.03 0.00 -0.42 0.00 0.00 57.16 56.15 3h0m n GLU 243 Cb 0.22 -1.49 -0.09 0.00 -0.57 0.00 0.00 31.44 29.51 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 -0.60 1.68 -0.15 3.49 4.07 -0.31 -4.56 120.64 124.26 3h0m n GLU 244 Ca 0.12 -0.03 0.05 0.00 -0.06 0.00 0.00 57.16 57.23 3h0m n GLU 244 Cb 0.36 -1.30 0.35 0.00 -0.06 0.00 0.00 31.44 30.79 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 1.08 0.00 6.31 -1.51 -1.52 -2.73 116.25 117.88 3h0m h VAL 245 Ca -0.24 -0.26 -0.05 0.00 -1.23 0.00 0.00 66.70 64.92 3h0m h VAL 245 Cb 1.45 0.24 -0.01 0.00 -2.13 0.00 0.00 31.29 30.84 3h0m h VAL 245 CO 0.01 0.14 -0.23 0.11 -1.23 0.00 0.00 177.57 176.37 3h0m h LYS 246 N 0.77 0.00 -7.31 5.19 1.57 -1.84 -3.39 116.57 111.56 3h0m h LYS 246 Ca 0.27 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.54 3h0m h LYS 246 Cb 0.10 0.00 0.15 0.00 0.08 0.00 0.00 32.23 32.56 3h0m h LYS 246 CO -0.08 0.23 0.27 0.15 -0.57 0.00 0.00 179.45 179.46 3h0m s LYS 247 N -3.47 1.60 -0.09 3.15 1.02 -1.03 -5.07 119.74 115.86 3h0m s LYS 247 Ca 0.02 1.11 0.00 0.00 0.02 0.00 0.00 55.97 57.12 3h0m s LYS 247 Cb 0.09 -1.83 0.02 0.00 -0.52 0.00 0.00 37.83 35.60 3h0m s LYS 247 CO 0.65 -2.09 -0.06 -2.00 -0.92 0.00 0.00 175.35 170.94 3h0m s GLU 248 N -4.85 1.23 -0.21 1.68 2.12 -1.26 -4.92 118.70 112.49 3h0m s GLU 248 Ca 0.63 -0.17 -0.08 0.00 0.36 0.00 0.00 54.97 55.71 3h0m s GLU 248 Cb -0.19 -1.30 -0.04 0.00 0.26 0.00 0.00 34.13 32.87 3h0m s GLU 248 CO 0.57 -0.20 0.08 0.08 -0.54 0.00 0.00 175.26 175.25 3h0m s VAL 249 N 1.48 4.74 0.37 3.70 1.01 -1.26 -5.09 120.40 125.36 3h0m s VAL 249 Ca -0.01 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.69 3h0m s VAL 249 Cb -0.13 -3.17 -0.10 0.00 0.00 0.00 0.00 36.38 32.98 3h0m s VAL 249 CO -0.04 0.41 0.98 -0.54 0.00 0.00 0.00 175.10 175.90 3h0m s LYS 250 N 0.82 4.37 -0.89 2.72 1.02 -1.26 -4.22 119.74 122.29 3h0m s LYS 250 Ca 0.04 1.35 -0.01 0.00 0.02 0.00 0.00 55.97 57.37 3h0m s LYS 250 Cb -0.13 -2.58 0.00 0.00 -0.52 0.00 0.00 37.83 34.60 3h0m s LYS 250 CO 0.02 0.07 0.08 0.41 -0.92 0.00 0.00 175.35 175.02 3h0m n GLY 251 N 0.23 -0.04 3.76 -3.33 0.00 -1.26 -5.01 105.19 99.54 3h0m n GLY 251 Ca 0.04 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.25 3.04 0.00 0.99 1.43 -1.26 -4.87 118.68 114.77 3h0m s LEU 252 Ca 0.04 1.84 0.05 0.00 -1.03 0.00 0.00 54.13 55.03 3h0m s LEU 252 Cb -0.02 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.66 3h0m s LEU 252 CO 0.05 -2.06 -0.14 -0.54 0.23 0.00 0.00 176.35 173.89 3h0m s LYS 253 N -4.86 1.10 -0.10 1.70 1.02 -1.26 -2.31 119.74 115.02 3h0m s LYS 253 Ca 0.62 -0.57 0.04 0.00 0.02 0.00 0.00 55.97 56.07 3h0m s LYS 253 Cb -0.17 -1.08 0.00 0.00 -0.52 0.00 0.00 37.83 36.06 3h0m s LYS 253 CO 0.55 0.29 -0.23 0.42 -0.92 0.00 0.00 175.35 175.46 3h0m s ILE 254 N -0.46 2.00 -0.16 2.17 1.01 -0.13 -1.53 121.20 124.09 3h0m s ILE 254 Ca 0.05 -0.98 -0.11 0.00 0.00 0.00 0.00 60.65 59.61 3h0m s ILE 254 Cb -0.06 -1.74 -0.05 0.00 0.01 0.00 0.00 42.46 40.63 3h0m s ILE 254 CO -0.00 0.54 0.20 -0.83 0.00 0.00 0.00 174.94 174.86 3h0m s GLY 255 N 0.45 2.15 -0.42 6.18 0.00 -0.41 -0.91 107.32 114.36 3h0m s GLY 255 Ca -0.17 -0.57 -0.06 0.00 0.00 0.00 0.00 44.72 43.93 3h0m s GLY 255 CO 0.07 0.13 0.23 1.08 0.00 0.00 0.00 173.10 174.61 3h0m s LEU 256 N 0.01 5.23 -0.03 0.66 1.43 0.29 -1.61 118.68 124.66 3h0m s LEU 256 Ca 0.13 -1.82 -0.33 0.00 -1.03 0.00 0.00 54.13 51.08 3h0m s LEU 256 Cb -0.12 -1.90 -0.12 0.00 0.03 0.00 0.00 46.19 44.08 3h0m s LEU 256 CO 0.02 -0.56 1.85 -2.65 0.23 0.00 0.00 176.35 175.25 3h0m n PRO 257 N 4.75 2.30 -0.07 1.29 -0.02 -1.26 -1.82 135.00 140.16 3h0m n PRO 257 Ca -0.06 0.84 0.11 0.00 -2.02 0.00 0.00 63.50 62.37 3h0m n PRO 257 Cb 0.42 -2.69 0.49 0.00 -0.02 0.00 0.00 33.50 31.70 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 8.92 0.41 0.00 -0.52 1.57 -1.03 -1.36 116.57 124.56 3h0m h LYS 258 Ca -0.48 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 3h0m h LYS 258 Cb 1.26 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.48 3h0m h LYS 258 CO 0.94 0.27 -0.04 0.93 -0.57 0.00 0.00 179.45 180.98 3h0m h GLU 259 N 0.42 0.00 0.00 3.15 3.07 -1.88 -2.34 114.58 117.00 3h0m h GLU 259 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 3h0m h GLU 259 Cb 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 3h0m h GLU 259 CO -0.07 0.04 0.00 0.74 -1.40 0.00 0.00 179.01 178.32 3h0m h PHE 260 N 0.00 0.00 0.00 4.33 0.04 -1.62 -3.05 116.94 116.64 3h0m h PHE 260 Ca -0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 3h0m h PHE 260 Cb 0.54 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 3h0m h PHE 260 CO 0.00 0.00 -0.15 0.74 -0.60 0.00 0.00 178.31 178.30 3h0m h PHE 261 N 0.00 0.00 -0.00 -0.55 0.04 -1.51 -2.05 116.94 112.87 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 0.74 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.89 3h0m h PHE 261 CO 0.00 0.15 -0.02 0.39 -0.60 0.00 0.00 178.31 178.23 3h0m n GLU 262 N -4.22 0.96 -2.88 1.51 -0.58 -1.15 -4.81 120.64 109.46 3h0m n GLU 262 Ca -0.02 -0.18 -0.41 0.00 -0.42 0.00 0.00 57.16 56.12 3h0m n GLU 262 Cb 0.22 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.56 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 -2.17 3.56 -0.22 -0.32 1.51 -0.77 -4.99 117.35 113.94 3h0m s TYR 263 Ca 0.40 1.41 -0.29 0.00 -1.01 0.00 0.00 57.07 57.58 3h0m s TYR 263 Cb 0.21 -2.98 -0.06 0.00 -0.11 0.00 0.00 41.96 39.02 3h0m s TYR 263 CO 0.40 -0.05 2.21 0.39 -1.11 0.00 0.00 175.55 177.39 3h0m n GLU 264 N 4.27 1.88 -4.36 -0.62 1.02 -1.26 -4.99 120.64 116.57 3h0m n GLU 264 Ca 0.03 0.52 -0.33 0.00 -0.02 0.00 0.00 57.16 57.37 3h0m n GLU 264 Cb 0.50 -3.11 -0.09 0.00 -0.02 0.00 0.00 31.44 28.72 3h0m n GLU 264 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3h0m s LEU 265 N 7.97 3.38 0.24 -4.62 1.43 -1.26 -4.83 118.68 120.99 3h0m s LEU 265 Ca 1.02 -0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 53.76 3h0m s LEU 265 Cb -0.42 -1.92 -0.10 0.00 0.03 0.00 0.00 46.19 43.78 3h0m s LEU 265 CO 0.38 0.29 1.52 -1.58 0.23 0.00 0.00 176.35 177.19 3h0m s GLN 266 N -1.44 4.21 0.30 1.70 0.74 -0.01 -4.87 119.66 120.30 3h0m s GLN 266 Ca 0.18 2.40 0.05 0.00 0.05 0.00 0.00 55.36 58.04 3h0m s GLN 266 Cb -0.11 -3.10 0.76 0.00 1.10 0.00 0.00 33.01 31.66 3h0m s GLN 266 CO 0.08 -0.53 1.71 -1.35 -0.55 0.00 0.00 175.29 174.66 3h0m h PRO 267 N 5.48 0.47 -0.78 1.67 0.11 -1.99 0.89 132.00 137.85 3h0m h PRO 267 Ca -0.45 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.66 3h0m h PRO 267 Cb 1.21 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 3h0m h PRO 267 CO 0.82 0.31 0.50 1.96 -0.21 0.00 0.00 178.00 181.39 3h0m h GLN 268 N 0.49 0.96 -0.02 1.05 7.50 -1.97 -0.64 115.11 122.47 3h0m h GLN 268 Ca 0.58 -0.06 -0.01 0.00 0.50 0.00 0.00 58.65 59.67 3h0m h GLN 268 Cb 1.08 -0.22 -0.00 0.00 0.05 0.00 0.00 27.48 28.39 3h0m h GLN 268 CO -0.49 0.64 -0.01 0.28 -1.50 0.00 0.00 178.83 177.75 3h0m h VAL 269 N 0.99 1.29 -0.20 -0.54 2.07 -1.23 -1.09 116.25 117.56 3h0m h VAL 269 Ca 0.31 -0.89 0.06 0.00 0.82 0.00 0.00 66.70 67.00 3h0m h VAL 269 Cb -0.02 1.85 -0.07 0.00 -1.52 0.00 0.00 31.29 31.54 3h0m h VAL 269 CO -0.10 0.24 -0.25 0.50 0.02 0.00 0.00 177.57 177.97 3h0m h LYS 270 N -0.31 -0.27 -0.31 1.57 3.64 -1.00 0.20 116.57 120.09 3h0m h LYS 270 Ca 0.01 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.46 3h0m h LYS 270 Cb 0.38 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.21 3h0m h LYS 270 CO 0.00 -0.18 -0.03 1.49 -2.27 0.00 0.00 179.45 178.46 3h0m h GLU 271 N -0.28 0.05 -0.63 1.90 4.81 -1.11 0.04 114.58 119.36 3h0m h GLU 271 Ca 0.12 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 3h0m h GLU 271 Cb 0.47 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 3h0m h GLU 271 CO -0.36 0.04 0.39 0.00 -0.73 0.00 0.00 179.01 178.35 3h0m h ALA 272 N 1.28 0.82 -0.15 2.92 0.00 -0.69 -2.00 119.26 121.45 3h0m h ALA 272 Ca 0.15 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3h0m h ALA 272 Cb 0.21 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3h0m h ALA 272 CO -0.28 0.15 -0.03 0.35 0.00 0.00 0.00 179.25 179.45 3h0m h PHE 273 N 0.78 0.31 -0.75 0.00 3.57 -0.16 -2.07 116.94 118.62 3h0m h PHE 273 Ca 0.25 -0.07 0.11 0.00 3.53 0.00 0.00 57.97 61.80 3h0m h PHE 273 Cb 0.00 -0.08 -0.08 0.00 2.79 0.00 0.00 35.95 38.58 3h0m h PHE 273 CO -0.05 0.56 0.36 0.93 -2.23 0.00 0.00 178.31 177.88 3h0m h GLU 274 N -0.02 0.56 -0.48 1.11 5.08 -0.91 -0.94 114.58 118.98 3h0m h GLU 274 Ca 0.04 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 3h0m h GLU 274 Cb 0.46 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 3h0m h GLU 274 CO 0.01 0.37 -0.13 -0.97 -1.00 0.00 0.00 179.01 177.30 3h0m h ASN 275 N 0.58 0.90 -0.52 1.42 -0.73 -1.34 -0.87 115.58 115.01 3h0m h ASN 275 Ca 0.39 -0.29 0.03 0.00 1.87 0.00 0.00 56.30 58.29 3h0m h ASN 275 Cb 0.48 -0.24 -0.04 0.00 0.27 0.00 0.00 38.32 38.79 3h0m h ASN 275 CO -0.31 1.03 0.30 0.15 -0.37 0.00 0.00 177.43 178.22 3h0m h PHE 276 N 0.80 0.56 -0.20 0.67 3.57 -0.59 -0.42 116.94 121.34 3h0m h PHE 276 Ca 0.13 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 3h0m h PHE 276 Cb 0.65 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 3h0m h PHE 276 CO 0.04 0.31 -0.21 0.82 -2.23 0.00 0.00 178.31 177.04 3h0m h ILE 277 N 0.60 1.33 -0.85 1.41 1.08 -1.07 -1.72 117.51 118.28 3h0m h ILE 277 Ca 0.21 -1.38 0.06 0.00 -0.39 0.00 0.00 64.86 63.36 3h0m h ILE 277 Cb 0.04 1.77 -0.06 0.00 -3.07 0.00 0.00 36.82 35.49 3h0m h ILE 277 CO -0.10 0.42 0.53 0.11 -0.69 0.00 0.00 178.15 178.41 3h0m h LYS 278 N 0.17 0.93 -0.18 2.37 1.57 -0.99 0.39 116.57 120.83 3h0m h LYS 278 Ca 0.03 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 3h0m h LYS 278 Cb 0.76 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 3h0m h LYS 278 CO 0.05 0.62 -0.43 1.49 -0.57 0.00 0.00 179.45 180.61 3h0m h GLU 279 N 0.96 0.42 -0.29 3.15 4.57 -1.02 -0.71 114.58 121.66 3h0m h GLU 279 Ca 0.37 -0.22 -0.12 0.00 -1.18 0.00 0.00 59.36 58.21 3h0m h GLU 279 Cb 0.17 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.76 3h0m h GLU 279 CO -0.17 0.78 -0.29 -0.07 -1.18 0.00 0.00 179.01 178.07 3h0m h LEU 280 N 0.35 0.75 -0.51 1.64 3.38 -0.55 -2.78 115.31 117.59 3h0m h LEU 280 Ca 0.03 -0.47 0.10 0.00 0.09 0.00 0.00 57.88 57.62 3h0m h LEU 280 Cb 0.90 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.35 3h0m h LEU 280 CO 0.08 1.07 -0.01 -0.08 0.09 0.00 0.00 178.44 179.59 3h0m h GLU 281 N 0.45 0.10 -0.64 1.13 4.81 0.03 -1.26 114.58 119.20 3h0m h GLU 281 Ca 0.04 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.37 3h0m h GLU 281 Cb 0.86 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.18 3h0m h GLU 281 CO 0.07 0.07 0.43 0.87 -0.73 0.00 0.00 179.01 179.72 3h0m h LYS 282 N 0.11 0.43 -0.00 1.92 1.57 -1.04 -0.69 116.57 118.87 3h0m h LYS 282 Ca 0.26 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3h0m h LYS 282 Cb 0.39 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3h0m h LYS 282 CO -0.44 0.28 -0.03 0.39 -0.57 0.00 0.00 179.45 179.09 3h0m n GLU 283 N -4.47 0.35 0.00 3.15 -0.58 -0.52 -4.91 120.64 113.67 3h0m n GLU 283 Ca 0.11 -0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 3h0m n GLU 283 Cb 0.39 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.76 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 1.34 1.14 3.74 0.62 0.00 -0.26 -5.09 105.19 106.67 3h0m n GLY 284 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 3.51 0.02 1.61 0.40 -1.06 -4.67 117.98 115.79 3h0m s PHE 285 Ca 0.00 1.52 -0.27 0.00 -0.60 0.00 0.00 56.93 57.58 3h0m s PHE 285 Cb 0.00 -3.35 -0.05 0.00 0.51 0.00 0.00 43.02 40.13 3h0m s PHE 285 CO 0.00 -0.90 0.84 -2.00 0.70 0.00 0.00 175.22 173.86 3h0m s GLU 286 N -0.38 4.54 -0.23 0.44 2.12 -0.98 -4.35 118.70 119.86 3h0m s GLU 286 Ca 0.51 1.18 -0.04 0.00 0.36 0.00 0.00 54.97 56.99 3h0m s GLU 286 Cb -0.31 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 30.67 3h0m s GLU 286 CO 0.36 0.14 -0.04 0.42 -0.54 0.00 0.00 175.26 175.60 3h0m s ILE 287 N 0.41 3.29 0.01 -3.70 -1.09 -1.26 -0.96 121.20 117.90 3h0m s ILE 287 Ca 0.43 -0.63 0.05 0.00 -2.23 0.00 0.00 60.65 58.27 3h0m s ILE 287 Cb -0.21 -2.55 -0.02 0.00 -1.58 0.00 0.00 42.46 38.11 3h0m s ILE 287 CO 0.24 0.35 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.60 3h0m s LYS 288 N 1.44 1.20 0.17 2.79 1.02 -0.09 -4.98 119.74 121.29 3h0m s LYS 288 Ca 0.04 -0.69 -0.30 0.00 0.02 0.00 0.00 55.97 55.05 3h0m s LYS 288 Cb -0.15 -1.20 -0.07 0.00 -0.52 0.00 0.00 37.83 35.89 3h0m s LYS 288 CO -0.03 0.32 0.94 -1.21 -0.92 0.00 0.00 175.35 174.44 3h0m s GLU 289 N -0.74 4.76 0.33 1.68 2.02 -1.26 -0.54 118.70 124.95 3h0m s GLU 289 Ca 0.05 1.45 0.08 0.00 0.02 0.00 0.00 54.97 56.57 3h0m s GLU 289 Cb -0.07 -3.33 -0.06 0.00 0.10 0.00 0.00 34.13 30.77 3h0m s GLU 289 CO 0.00 0.37 -0.07 0.14 0.02 0.00 0.00 175.26 175.73 3h0m s VAL 290 N -0.60 1.99 -0.08 2.63 -7.23 -0.76 -4.80 120.40 111.56 3h0m s VAL 290 Ca 0.43 -2.15 -0.00 0.00 -1.81 0.00 0.00 61.98 58.45 3h0m s VAL 290 Cb -0.24 -2.62 -0.03 0.00 0.56 0.00 0.00 36.38 34.04 3h0m s VAL 290 CO 0.31 -0.21 -0.05 -0.44 -0.31 0.00 0.00 175.10 174.40 3h0m s SER 291 N -3.56 4.80 -0.46 4.85 0.01 -1.26 -0.30 113.70 117.77 3h0m s SER 291 Ca 0.32 0.01 0.04 0.00 1.31 0.00 0.00 55.95 57.64 3h0m s SER 291 Cb 0.04 -1.27 0.17 0.00 0.21 0.00 0.00 66.02 65.17 3h0m s SER 291 CO 0.15 0.36 0.37 0.18 0.41 0.00 0.00 173.24 174.71 3h0m n LEU 292 N 2.26 0.12 0.15 2.44 4.77 -1.26 -4.66 117.00 120.82 3h0m n LEU 292 Ca -0.18 -4.52 0.09 0.00 -0.03 0.00 0.00 56.01 51.37 3h0m n LEU 292 Cb 0.53 0.33 0.50 0.00 -2.33 0.00 0.00 43.42 42.45 3h0m n LEU 292 CO 0.27 1.85 0.81 -0.81 -1.33 0.00 0.00 177.39 178.18 3h0m n PRO 293 N 2.66 0.12 -0.01 3.23 -0.04 -1.26 -2.31 135.00 137.40 3h0m n PRO 293 Ca 0.28 0.61 0.07 0.00 -0.04 0.00 0.00 63.50 64.43 3h0m n PRO 293 Cb 0.46 -1.97 -0.11 0.00 -0.04 0.00 0.00 33.50 31.84 3h0m n PRO 293 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3h0m n HIS 294 N -2.17 0.00 -0.34 0.54 8.25 -1.26 -4.69 115.22 115.55 3h0m n HIS 294 Ca -0.01 0.00 0.25 0.00 -0.26 0.00 0.00 57.72 57.70 3h0m n HIS 294 Cb 0.10 -0.29 0.53 0.00 1.12 0.00 0.00 29.99 31.45 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 0.45 0.00 1.59 -1.51 -1.82 0.32 116.25 115.27 3h0m h VAL 295 Ca 0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 3h0m h VAL 295 Cb 0.63 0.08 0.00 0.00 -2.13 0.00 0.00 31.29 29.86 3h0m h VAL 295 CO 0.00 0.06 0.11 0.07 -1.23 0.00 0.00 177.57 176.58 3h0m h LYS 296 N 0.34 0.00 -0.01 5.19 2.10 -1.83 0.41 116.57 122.77 3h0m h LYS 296 Ca 0.64 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.29 3h0m h LYS 296 Cb 1.69 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.02 3h0m h LYS 296 CO -0.33 0.00 -0.06 0.66 -2.00 0.00 0.00 179.45 177.72 3h0m n TYR 297 N -2.90 0.00 -0.28 0.07 4.01 0.11 -4.29 117.16 113.88 3h0m n TYR 297 Ca -0.02 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.75 3h0m n TYR 297 Cb 0.17 -0.06 0.18 0.00 -0.31 0.00 0.00 39.34 39.32 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 1.34 0.56 0.15 7.72 0.02 -0.30 -2.27 113.55 120.76 3h0m h SER 298 Ca 0.00 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 3h0m h SER 298 Cb 0.37 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.88 3h0m h SER 298 CO 0.00 0.29 -0.07 0.40 -1.14 0.00 0.00 176.83 176.31 3h0m h ILE 299 N 0.68 1.00 -0.89 3.27 1.08 -1.79 0.31 117.51 121.17 3h0m h ILE 299 Ca 0.41 -0.92 0.04 0.00 -0.39 0.00 0.00 64.86 64.00 3h0m h ILE 299 Cb 0.47 1.54 -0.05 0.00 -3.07 0.00 0.00 36.82 35.70 3h0m h ILE 299 CO -0.30 0.21 0.58 -0.65 -0.69 0.00 0.00 178.15 177.30 3h0m h PRO 300 N -0.67 1.05 -0.46 2.37 0.11 -1.85 -0.25 132.00 132.30 3h0m h PRO 300 Ca -0.02 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 3h0m h PRO 300 Cb 0.49 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 3h0m h PRO 300 CO 0.03 0.70 0.21 1.15 -0.21 0.00 0.00 178.00 179.88 3h0m h THR 301 N 1.09 1.19 -0.36 -1.15 2.02 -1.19 -2.69 112.91 111.82 3h0m h THR 301 Ca 0.36 -0.57 -0.12 0.00 0.77 0.00 0.00 66.41 66.84 3h0m h THR 301 Cb 0.06 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 3h0m h THR 301 CO -0.11 0.22 -0.27 0.22 0.37 0.00 0.00 175.52 175.95 3h0m h TYR 302 N 0.61 0.85 -0.34 3.16 3.20 -0.39 -1.99 116.97 122.07 3h0m h TYR 302 Ca 0.16 -0.21 -0.05 0.00 3.14 0.00 0.00 58.73 61.77 3h0m h TYR 302 Cb 0.15 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 3h0m h TYR 302 CO -0.00 0.93 0.06 0.66 -1.64 0.00 0.00 178.16 178.17 3h0m n TYR 303 N -4.09 1.19 -0.06 -3.82 4.01 -0.16 -1.44 117.16 112.78 3h0m n TYR 303 Ca -0.00 -0.53 -0.13 0.00 -0.16 0.00 0.00 57.90 57.08 3h0m n TYR 303 Cb 0.46 -0.37 -0.05 0.00 -0.31 0.00 0.00 39.34 39.07 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 0.20 0.68 0.47 -0.72 5.41 -1.03 -4.76 119.36 119.62 3h0m n ILE 304 Ca 0.18 -0.18 -0.19 0.00 1.00 0.00 0.00 62.75 63.55 3h0m n ILE 304 Cb 0.82 -1.58 -0.09 0.00 -0.71 0.00 0.00 39.64 38.07 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 -0.39 0.07 0.07 1.39 2.04 -1.19 -2.30 117.51 117.19 3h0m h ILE 305 Ca -0.31 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.50 3h0m h ILE 305 Cb 1.29 0.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.39 3h0m h ILE 305 CO -0.17 0.00 -0.51 0.00 0.00 0.00 0.00 178.15 177.47 3h0m h ALA 306 N -1.20 -0.93 -1.02 1.87 0.00 -1.51 -1.13 119.26 115.33 3h0m h ALA 306 Ca -0.12 -0.09 0.25 0.00 0.00 0.00 0.00 54.91 54.95 3h0m h ALA 306 Cb 0.93 0.89 -0.11 0.00 0.00 0.00 0.00 17.79 19.49 3h0m h ALA 306 CO 0.20 -1.10 0.63 -1.35 0.00 0.00 0.00 179.25 177.63 3h0m h PRO 307 N -0.71 0.49 0.61 0.00 0.11 -1.75 0.63 132.00 131.38 3h0m h PRO 307 Ca 0.01 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 3h0m h PRO 307 Cb 0.74 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.74 3h0m h PRO 307 CO -0.31 0.33 -0.29 0.77 -0.21 0.00 0.00 178.00 178.28 3h0m h SER 308 N 0.51 -0.70 -0.15 -2.05 0.02 -0.65 -1.40 113.55 109.13 3h0m h SER 308 Ca 0.63 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.53 3h0m h SER 308 Cb 1.34 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 3h0m h SER 308 CO -0.40 -0.37 0.06 -0.33 -1.14 0.00 0.00 176.83 174.64 3h0m h GLU 309 N -1.03 0.30 -0.76 3.45 5.08 -1.01 -1.45 114.58 119.17 3h0m h GLU 309 Ca -0.08 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 3h0m h GLU 309 Cb 0.68 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 3h0m h GLU 309 CO 0.14 0.28 0.34 0.00 -1.00 0.00 0.00 179.01 178.77 3h0m h ALA 310 N 1.77 0.98 0.00 3.43 0.00 -0.49 0.16 119.26 125.11 3h0m h ALA 310 Ca 0.08 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 3h0m h ALA 310 Cb 0.11 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3h0m h ALA 310 CO -0.00 0.57 -0.51 0.66 0.00 0.00 0.00 179.25 179.97 3h0m h SER 311 N 1.08 0.00 -0.02 0.00 4.64 -0.16 -1.69 113.55 117.40 3h0m h SER 311 Ca 0.26 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.53 3h0m h SER 311 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3h0m h SER 311 CO -0.03 0.51 -0.17 -1.28 -0.87 0.00 0.00 176.83 174.99 3h0m h SER 312 N 0.00 0.18 0.56 4.97 0.87 -1.14 -3.17 113.55 115.82 3h0m h SER 312 Ca -0.01 -0.72 0.00 0.00 -1.23 0.00 0.00 61.79 59.84 3h0m h SER 312 Cb 0.90 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 3h0m h SER 312 CO 0.07 0.87 0.00 0.78 -0.53 0.00 0.00 176.83 178.02 3h0m h ASN 313 N -0.50 0.00 -0.45 6.23 2.35 -0.54 -2.45 115.58 120.22 3h0m h ASN 313 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3h0m h ASN 313 Cb 0.88 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.25 3h0m h ASN 313 CO 0.03 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.99 3h0m n LEU 314 N -3.07 3.26 0.28 1.61 4.32 -0.65 -4.40 117.00 118.35 3h0m n LEU 314 Ca -0.01 -1.83 0.14 0.00 -0.02 0.00 0.00 56.01 54.29 3h0m n LEU 314 Cb 0.20 -0.30 0.80 0.00 -1.62 0.00 0.00 43.42 42.50 3h0m n LEU 314 CO 0.24 0.79 1.02 0.00 -1.22 0.00 0.00 177.39 178.21 3h0m h ALA 315 N 3.17 1.25 0.00 -1.18 0.00 -1.41 -3.09 119.26 118.01 3h0m h ALA 315 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3h0m h ALA 315 Cb 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3h0m h ALA 315 CO 0.00 0.10 -0.01 2.89 0.00 0.00 0.00 179.25 182.23 3h0m n ARG 316 N -3.55 0.09 -2.92 0.00 1.85 -1.26 -4.59 116.66 106.28 3h0m n ARG 316 Ca -0.02 0.07 -0.43 0.00 -1.00 0.00 0.00 57.85 56.47 3h0m n ARG 316 Cb 0.21 -1.60 -0.04 0.00 -1.05 0.00 0.00 32.46 29.98 3h0m n ARG 316 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 3h0m s TYR 317 N -3.03 2.75 0.00 2.89 2.02 -1.17 -4.72 117.35 116.09 3h0m s TYR 317 Ca 0.13 -0.65 0.00 0.00 -0.37 0.00 0.00 57.07 56.18 3h0m s TYR 317 Cb 0.17 -4.22 0.00 0.00 -0.40 0.00 0.00 41.96 37.50 3h0m s TYR 317 CO 0.56 -1.56 0.00 -0.40 -1.57 0.00 0.00 175.55 172.57 3h0m n ASP 318 N 7.37 0.00 0.00 2.29 5.68 -1.26 -4.80 116.55 125.83 3h0m n ASP 318 Ca -0.05 -0.50 0.00 0.00 -0.50 0.00 0.00 54.79 53.73 3h0m n ASP 318 Cb 0.45 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 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 0.55 0.11 6.12 0.00 -1.25 -4.59 105.19 106.13 3h0m n GLY 319 Ca 0.00 -0.04 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.89 1.51 0.34 1.61 0.31 -1.26 -4.75 118.33 113.20 3h0m n VAL 320 Ca 0.00 -0.07 0.09 0.00 -0.01 0.00 0.00 64.34 64.36 3h0m n VAL 320 Cb 0.00 -2.15 -0.13 0.00 -0.91 0.00 0.00 33.84 30.65 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 -4.40 0.67 -3.79 5.55 1.74 -1.26 -5.05 116.66 110.12 3h0m n ARG 321 Ca -0.30 -0.11 -0.03 0.00 -0.77 0.00 0.00 57.85 56.64 3h0m n ARG 321 Cb 0.65 -1.43 -0.00 0.00 -1.02 0.00 0.00 32.46 30.65 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 -3.12 -0.04 0.00 -1.55 1.13 -1.26 -5.17 117.35 107.34 3h0m s TYR 322 Ca -0.02 -0.27 0.00 0.00 -1.41 0.00 0.00 57.07 55.37 3h0m s TYR 322 Cb 0.13 0.65 0.00 0.00 -1.10 0.00 0.00 41.96 41.64 3h0m s TYR 322 CO 0.79 -0.79 0.00 0.41 -2.51 0.00 0.00 175.55 173.46 3h0m n GLY 323 N -0.56 0.57 3.77 5.49 0.00 -1.26 -4.26 105.19 108.94 3h0m n GLY 323 Ca -0.05 -0.89 -0.39 0.00 0.00 0.00 0.00 46.02 44.68 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 3.01 -0.04 1.61 5.04 -0.46 -4.89 117.35 121.62 3h0m s TYR 324 Ca 0.00 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 56.11 3h0m s TYR 324 Cb 0.00 -3.56 0.02 0.00 0.35 0.00 0.00 41.96 38.77 3h0m s TYR 324 CO 0.00 -1.68 -0.02 0.50 -1.34 0.00 0.00 175.55 173.01 3h0m s ARG 325 N -2.08 0.52 0.58 4.97 3.52 -1.26 -3.90 118.95 121.29 3h0m s ARG 325 Ca 0.54 0.01 -0.18 0.00 -0.13 0.00 0.00 55.73 55.97 3h0m s ARG 325 Cb -0.36 -0.66 -0.07 0.00 -1.56 0.00 0.00 34.95 32.30 3h0m s ARG 325 CO 0.46 -0.13 0.64 0.00 -0.81 0.00 0.00 175.30 175.46 3h0m n ALA 326 N 4.20 -0.81 0.02 6.12 0.00 -1.26 -4.94 120.51 123.85 3h0m n ALA 326 Ca -0.24 -0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.09 3h0m n ALA 326 Cb 0.50 -1.90 -0.13 0.00 0.00 0.00 0.00 19.45 17.92 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 0.28 0.04 -5.03 0.00 1.57 -1.98 -3.46 116.57 107.99 3h0m h LYS 327 Ca -0.46 -0.07 -0.66 0.00 -1.87 0.00 0.00 60.65 57.59 3h0m h LYS 327 Cb 1.39 0.02 -0.30 0.00 0.08 0.00 0.00 32.23 33.42 3h0m h LYS 327 CO 0.48 0.79 -0.78 -1.21 -0.57 0.00 0.00 179.45 178.16 3h0m s GLU 328 N -2.64 3.23 -0.27 3.15 2.02 -1.26 -5.10 118.70 117.83 3h0m s GLU 328 Ca -0.03 -0.70 -0.25 0.00 0.02 0.00 0.00 54.97 54.00 3h0m s GLU 328 Cb 0.09 -2.84 0.08 0.00 0.10 0.00 0.00 34.13 31.56 3h0m s GLU 328 CO 0.83 -0.19 0.76 1.52 0.02 0.00 0.00 175.26 178.19 3h0m s TYR 329 N 1.38 -0.75 -0.18 1.61 1.13 -1.26 -4.87 117.35 114.41 3h0m s TYR 329 Ca 0.05 1.81 0.21 0.00 -1.41 0.00 0.00 57.07 57.73 3h0m s TYR 329 Cb -0.14 0.28 -0.07 0.00 -1.10 0.00 0.00 41.96 40.94 3h0m s TYR 329 CO -0.07 -0.37 0.92 1.63 -2.51 0.00 0.00 175.55 175.15 3h0m n LYS 330 N 2.59 0.62 -3.89 -3.49 5.02 -1.26 -4.93 118.16 112.82 3h0m n LYS 330 Ca -0.14 0.12 -0.09 0.00 -2.02 0.00 0.00 58.31 56.19 3h0m n LYS 330 Cb 0.55 -1.79 -0.04 0.00 -0.02 0.00 0.00 35.03 33.73 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 -5.42 -0.17 0.42 4.39 1.47 -1.26 -5.05 116.67 111.06 3h0m s ASP 331 Ca -0.02 -0.72 0.14 0.00 1.18 0.00 0.00 52.55 53.13 3h0m s ASP 331 Cb 0.10 0.61 1.00 0.00 -0.34 0.00 0.00 42.92 44.29 3h0m s ASP 331 CO 0.81 -1.15 1.96 -0.29 0.68 0.00 0.00 175.17 177.18 3h0m h ILE 332 N 2.20 0.87 0.33 2.11 6.09 -1.98 -0.07 117.51 127.06 3h0m h ILE 332 Ca -0.26 -0.15 -0.02 0.00 -1.37 0.00 0.00 64.86 63.06 3h0m h ILE 332 Cb 1.25 0.39 0.00 0.00 0.47 0.00 0.00 36.82 38.93 3h0m h ILE 332 CO 0.34 0.08 -0.16 0.15 -3.07 0.00 0.00 178.15 175.49 3h0m h PHE 333 N 0.45 -0.41 -1.01 2.19 3.57 -1.99 -0.26 116.94 119.49 3h0m h PHE 333 Ca 0.31 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.82 3h0m h PHE 333 Cb 0.62 0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.44 3h0m h PHE 333 CO -0.00 -0.20 0.67 0.93 -2.23 0.00 0.00 178.31 177.47 3h0m h GLU 334 N -0.52 1.31 -0.35 1.11 5.08 -1.87 0.35 114.58 119.69 3h0m h GLU 334 Ca -0.05 -0.08 0.06 0.00 -1.00 0.00 0.00 59.36 58.30 3h0m h GLU 334 Cb 0.39 -0.30 -0.06 0.00 0.50 0.00 0.00 28.75 29.29 3h0m h GLU 334 CO 0.07 0.87 -0.01 1.98 -1.00 0.00 0.00 179.01 180.92 3h0m h MET 335 N 1.35 0.08 0.85 2.33 4.05 -0.70 0.57 114.93 123.47 3h0m h MET 335 Ca 0.37 -0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.75 3h0m h MET 335 Cb -0.13 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 30.65 3h0m h MET 335 CO -0.09 0.05 -0.44 1.88 0.23 0.00 0.00 176.91 178.54 3h0m h TYR 336 N 0.08 -1.16 0.00 1.39 0.05 -0.47 -1.99 116.97 114.87 3h0m h TYR 336 Ca 0.17 -0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.86 3h0m h TYR 336 Cb 0.24 0.40 -0.01 0.00 1.01 0.00 0.00 36.73 38.36 3h0m h TYR 336 CO -0.26 -0.70 -0.32 0.00 -1.05 0.00 0.00 178.16 175.84 3h0m h ALA 337 N -1.07 1.23 0.10 3.88 0.00 -0.71 -2.51 119.26 120.18 3h0m h ALA 337 Ca -0.12 -0.29 -0.28 0.00 0.00 0.00 0.00 54.91 54.23 3h0m h ALA 337 Cb 0.93 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3h0m h ALA 337 CO 0.17 0.40 -1.45 0.00 0.00 0.00 0.00 179.25 178.37 3h0m h ARG 338 N 0.00 0.22 -0.85 0.00 3.08 -0.93 -2.30 114.38 113.59 3h0m h ARG 338 Ca -0.00 -0.38 0.19 0.00 0.07 0.00 0.00 59.98 59.86 3h0m h ARG 338 Cb 0.67 0.14 -0.11 0.00 0.08 0.00 0.00 29.97 30.74 3h0m h ARG 338 CO 0.04 1.18 0.37 1.15 -1.07 0.00 0.00 179.97 181.64 3h0m h THR 339 N -0.34 0.55 0.13 2.04 2.02 -1.29 -0.79 112.91 115.24 3h0m h THR 339 Ca -0.32 -0.15 -0.17 0.00 0.77 0.00 0.00 66.41 66.54 3h0m h THR 339 Cb 1.74 0.08 0.02 0.00 -1.74 0.00 0.00 68.15 68.24 3h0m h THR 339 CO 0.04 0.08 -0.77 0.03 0.37 0.00 0.00 175.52 175.26 3h0m h ARG 340 N 0.44 0.27 -0.58 6.66 3.08 -1.54 0.87 114.38 123.58 3h0m h ARG 340 Ca 0.51 -0.46 0.04 0.00 0.07 0.00 0.00 59.98 60.14 3h0m h ARG 340 Cb 0.88 0.17 -0.03 0.00 0.08 0.00 0.00 29.97 31.07 3h0m h ARG 340 CO -0.48 1.22 0.39 0.22 -1.07 0.00 0.00 179.97 180.25 3h0m h ASP 341 N -0.43 0.54 0.77 7.04 3.58 -1.28 -1.62 116.42 125.02 3h0m h ASP 341 Ca -0.14 -0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.07 3h0m h ASP 341 Cb 1.59 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 42.48 3h0m h ASP 341 CO 0.13 0.36 -1.33 -0.33 -2.88 0.00 0.00 179.24 175.20 3h0m h GLU 342 N 0.62 0.00 0.00 0.28 5.08 -1.13 -3.37 114.58 116.06 3h0m h GLU 342 Ca 0.24 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.45 3h0m h GLU 342 Cb 0.17 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 3h0m h GLU 342 CO -0.07 0.68 -1.28 0.78 -1.00 0.00 0.00 179.01 178.12 3h0m h GLY 343 N 3.32 0.00 -5.56 -3.84 0.00 -0.62 -3.47 103.07 92.90 3h0m h GLY 343 Ca -0.15 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.58 3h0m h GLY 343 CO 0.10 0.00 -0.27 -1.36 0.00 0.00 0.00 176.54 175.00 3h0m s PHE 344 N -2.95 3.56 1.17 5.60 0.08 -0.63 -2.10 117.98 122.72 3h0m s PHE 344 Ca -0.02 0.75 -0.17 0.00 0.12 0.00 0.00 56.93 57.61 3h0m s PHE 344 Cb 0.09 -2.32 0.27 0.00 -0.57 0.00 0.00 43.02 40.49 3h0m s PHE 344 CO 0.80 0.39 1.08 0.20 -0.10 0.00 0.00 175.22 177.60 3h0m s GLY 345 N -0.10 1.56 0.12 4.36 0.00 -1.26 -4.80 107.32 107.19 3h0m s GLY 345 Ca 0.20 -0.73 -0.06 0.00 0.00 0.00 0.00 44.72 44.12 3h0m s GLY 345 CO 0.08 0.09 1.28 -0.56 0.00 0.00 0.00 173.10 173.98 3h0m h PRO 346 N -2.51 0.47 -0.54 2.90 0.13 -1.97 -0.99 132.00 129.50 3h0m h PRO 346 Ca -0.49 -0.51 -0.04 0.00 -0.87 0.00 0.00 66.00 64.09 3h0m h PRO 346 Cb 1.31 0.15 -0.02 0.00 0.13 0.00 0.00 31.00 32.57 3h0m h PRO 346 CO 0.41 1.16 0.18 1.49 -0.23 0.00 0.00 178.00 181.01 3h0m h GLU 347 N 0.26 0.83 -0.36 0.86 4.57 -1.94 -1.18 114.58 117.61 3h0m h GLU 347 Ca -0.09 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 57.92 3h0m h GLU 347 Cb 1.61 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 30.06 3h0m h GLU 347 CO 0.17 0.75 0.22 0.28 -1.18 0.00 0.00 179.01 179.25 3h0m h VAL 348 N 0.74 1.12 -0.86 0.32 2.07 -1.85 -1.89 116.25 115.90 3h0m h VAL 348 Ca 0.18 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.43 3h0m h VAL 348 Cb 0.25 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 3h0m h VAL 348 CO -0.01 0.12 0.57 0.11 0.02 0.00 0.00 177.57 178.38 3h0m h LYS 349 N 0.47 1.09 -0.54 1.57 1.57 -0.91 -1.60 116.57 118.23 3h0m h LYS 349 Ca 0.13 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3h0m h LYS 349 Cb 0.01 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.05 3h0m h LYS 349 CO -0.02 0.72 0.32 0.00 -0.57 0.00 0.00 179.45 179.90 3h0m h ARG 350 N 1.12 0.73 0.00 3.15 3.08 -0.47 -2.02 114.38 119.97 3h0m h ARG 350 Ca 0.33 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 60.20 3h0m h ARG 350 Cb -0.06 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 3h0m h ARG 350 CO -0.08 0.53 -0.51 0.00 -1.07 0.00 0.00 179.97 178.84 3h0m h ARG 351 N 0.72 0.00 -0.15 0.04 3.08 -0.92 -1.53 114.38 115.62 3h0m h ARG 351 Ca 0.19 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.20 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 0.51 -0.08 0.82 -1.07 0.00 0.00 179.97 180.11 3h0m h ILE 352 N 0.00 1.32 0.45 2.04 2.04 -1.12 -0.95 117.51 121.28 3h0m h ILE 352 Ca -0.01 -1.14 -0.02 0.00 1.00 0.00 0.00 64.86 64.70 3h0m h ILE 352 Cb 1.26 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.09 3h0m h ILE 352 CO 0.07 0.33 -0.21 0.24 0.00 0.00 0.00 178.15 178.58 3h0m h MET 353 N -0.02 -0.58 -0.72 2.37 2.86 -1.30 -1.07 114.93 116.48 3h0m h MET 353 Ca 0.03 0.04 0.13 0.00 -2.06 0.00 0.00 59.70 57.84 3h0m h MET 353 Cb 0.56 0.13 -0.09 0.00 0.06 0.00 0.00 31.60 32.26 3h0m h MET 353 CO 0.02 -0.38 0.28 1.25 1.06 0.00 0.00 176.91 179.15 3h0m h LEU 354 N -0.60 0.27 -0.23 1.22 5.85 -1.35 -2.27 115.31 118.19 3h0m h LEU 354 Ca -0.06 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3h0m h LEU 354 Cb 0.46 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 3h0m h LEU 354 CO 0.10 0.12 0.06 1.23 -0.34 0.00 0.00 178.44 179.61 3h0m h GLY 355 N 0.44 0.40 2.00 3.75 0.00 -0.92 0.04 103.07 108.78 3h0m h GLY 355 Ca 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 3h0m h GLY 355 CO -0.38 0.23 -0.12 -0.91 0.00 0.00 0.00 176.54 175.37 3h0m h THR 356 N 0.20 0.37 0.17 4.70 1.35 -0.89 -1.91 112.91 116.90 3h0m h THR 356 Ca 0.07 -0.69 -0.01 0.00 -0.55 0.00 0.00 66.41 65.23 3h0m h THR 356 Cb 0.27 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 3h0m h THR 356 CO -0.00 0.11 -0.08 0.15 -0.25 0.00 0.00 175.52 175.45 3h0m h PHE 357 N 0.00 -0.21 -1.35 4.73 3.04 -1.12 -2.91 116.94 119.12 3h0m h PHE 357 Ca -0.00 -0.00 0.40 0.00 3.98 0.00 0.00 57.97 62.34 3h0m h PHE 357 Cb 0.50 0.07 -0.09 0.00 2.56 0.00 0.00 35.95 38.99 3h0m h PHE 357 CO 0.00 0.20 0.92 0.00 -2.02 0.00 0.00 178.31 177.41 3h0m h ALA 358 N -0.42 2.94 0.00 2.41 0.00 -0.52 -0.28 119.26 123.39 3h0m h ALA 358 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h0m h ALA 358 Cb 0.50 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3h0m h ALA 358 CO 0.04 -1.44 -1.07 1.28 0.00 0.00 0.00 179.25 178.06 3h0m n LEU 359 N -4.40 0.92 -4.77 0.00 4.77 -0.76 -3.58 117.00 109.17 3h0m n LEU 359 Ca 0.33 -0.45 -0.41 0.00 -0.03 0.00 0.00 56.01 55.45 3h0m n LEU 359 Cb 1.37 -0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.45 3h0m n LEU 359 CO 0.31 0.23 1.07 -0.94 -1.33 0.00 0.00 177.39 176.73 3h0m s SER 360 N -3.12 6.55 0.34 -1.43 1.04 -0.12 -4.58 113.70 112.38 3h0m s SER 360 Ca 0.07 2.87 -0.29 0.00 0.48 0.00 0.00 55.95 59.08 3h0m s SER 360 Cb 0.16 -2.66 -0.11 0.00 0.10 0.00 0.00 66.02 63.51 3h0m s SER 360 CO 0.87 -0.72 1.54 0.00 0.98 0.00 0.00 173.24 175.92 3h0m n ALA 361 N 0.71 2.48 0.00 5.32 0.00 -1.26 -0.98 120.51 126.78 3h0m n ALA 361 Ca 0.01 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.80 3h0m n ALA 361 Cb 0.40 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.41 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 1.24 3.23 0.00 0.00 0.00 -1.26 -4.75 105.19 103.65 3h0m n GLY 362 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.06 0.00 -0.26 1.61 4.01 -0.25 -4.78 117.16 116.43 3h0m n TYR 363 Ca 0.00 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.76 3h0m n TYR 363 Cb 0.00 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.17 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 0.72 -0.36 -0.72 5.03 -1.13 -0.28 116.97 120.23 3h0m h TYR 364 Ca 0.00 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.31 3h0m h TYR 364 Cb 0.00 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.05 3h0m h TYR 364 CO 0.00 0.28 0.10 -0.44 -1.32 0.00 0.00 178.16 176.78 3h0m h ASP 365 N 0.68 0.53 1.59 -2.11 5.19 -1.86 0.24 116.42 120.67 3h0m h ASP 365 Ca 0.36 -0.22 -0.06 0.00 -0.62 0.00 0.00 57.03 56.49 3h0m h ASP 365 Cb 0.35 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 3h0m h ASP 365 CO -0.25 0.62 -0.31 0.00 -3.12 0.00 0.00 179.24 176.18 3h0m h ALA 366 N 0.94 0.82 -3.00 3.45 0.00 -1.82 -2.51 119.26 117.13 3h0m h ALA 366 Ca 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h0m h ALA 366 Cb 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3h0m h ALA 366 CO -0.00 0.38 0.00 0.66 0.00 0.00 0.00 179.25 180.29 3h0m n TYR 367 N -3.20 0.00 -0.06 0.00 4.02 -0.14 -4.53 117.16 113.25 3h0m n TYR 367 Ca 0.02 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.84 3h0m n TYR 367 Cb 0.63 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.94 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 0.04 0.28 -0.72 3.20 -1.49 0.14 116.97 118.41 3h0m h TYR 368 Ca 0.00 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 3h0m h TYR 368 Cb 0.00 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.29 3h0m h TYR 368 CO 0.00 -0.01 -0.13 1.25 -1.64 0.00 0.00 178.16 177.63 3h0m h LEU 369 N 0.12 -0.31 -0.59 2.82 5.85 -1.15 -0.94 115.31 121.10 3h0m h LEU 369 Ca 0.12 -0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.90 3h0m h LEU 369 Cb 0.14 0.08 -0.11 0.00 0.37 0.00 0.00 40.66 41.15 3h0m h LEU 369 CO -0.18 -0.13 -0.07 0.50 -0.34 0.00 0.00 178.44 178.22 3h0m h LYS 370 N -0.48 0.06 -0.29 1.25 1.63 -1.26 -1.15 116.57 116.32 3h0m h LYS 370 Ca -0.04 -0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.71 3h0m h LYS 370 Cb 0.36 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.96 3h0m h LYS 370 CO 0.06 0.04 -0.01 0.00 -3.45 0.00 0.00 179.45 176.09 3h0m h ALA 371 N 1.57 1.43 0.00 5.00 0.00 -0.62 0.07 119.26 126.71 3h0m h ALA 371 Ca 0.30 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3h0m h ALA 371 Cb 0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3h0m h ALA 371 CO -0.56 0.40 -0.19 1.96 0.00 0.00 0.00 179.25 180.86 3h0m h GLN 372 N 0.44 0.00 0.10 0.00 1.08 0.00 -0.27 115.11 116.46 3h0m h GLN 372 Ca 0.10 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.29 3h0m h GLN 372 Cb 0.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.74 3h0m h GLN 372 CO 0.01 0.19 -0.05 0.87 -0.95 0.00 0.00 178.83 178.90 3h0m h LYS 373 N 0.00 -0.13 -0.95 1.46 1.57 -0.33 -3.16 116.57 115.02 3h0m h LYS 373 Ca -0.00 0.01 0.27 0.00 -1.87 0.00 0.00 60.65 59.06 3h0m h LYS 373 Cb 0.88 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.18 3h0m h LYS 373 CO 0.02 0.25 0.68 0.28 -0.57 0.00 0.00 179.45 180.12 3h0m h VAL 374 N -0.97 0.53 -0.10 0.50 2.07 -0.96 0.29 116.25 117.61 3h0m h VAL 374 Ca -0.01 -0.01 -0.08 0.00 0.82 0.00 0.00 66.70 67.42 3h0m h VAL 374 Cb 0.44 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3h0m h VAL 374 CO 0.02 0.00 -0.30 -0.09 0.02 0.00 0.00 177.57 177.23 3h0m h ARG 375 N 0.02 0.18 -0.03 1.57 2.43 -1.10 -1.36 114.38 116.10 3h0m h ARG 375 Ca 0.46 -0.06 -0.25 0.00 -0.81 0.00 0.00 59.98 59.31 3h0m h ARG 375 Cb 1.79 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 31.35 3h0m h ARG 375 CO -0.02 0.47 -0.98 -0.09 -1.51 0.00 0.00 179.97 177.84 3h0m h ARG 376 N 0.16 0.66 -0.28 0.20 2.43 -0.41 -1.91 114.38 115.24 3h0m h ARG 376 Ca 0.02 -0.68 0.06 0.00 -0.81 0.00 0.00 59.98 58.58 3h0m h ARG 376 Cb 0.61 0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 30.28 3h0m h ARG 376 CO 0.04 1.27 -0.11 -0.07 -1.51 0.00 0.00 179.97 179.59 3h0m h LEU 377 N 0.39 -0.38 -0.43 3.80 3.38 -1.08 0.41 115.31 121.40 3h0m h LEU 377 Ca -0.11 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3h0m h LEU 377 Cb 1.62 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.57 3h0m h LEU 377 CO 0.19 -0.14 0.24 0.40 0.09 0.00 0.00 178.44 179.21 3h0m h ILE 378 N -0.06 1.15 -0.66 1.22 2.04 -1.27 -0.71 117.51 119.23 3h0m h ILE 378 Ca 0.14 -0.39 0.04 0.00 1.00 0.00 0.00 64.86 65.66 3h0m h ILE 378 Cb 0.28 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 36.95 3h0m h ILE 378 CO -0.32 0.16 0.39 0.74 0.00 0.00 0.00 178.15 179.12 3h0m h THR 379 N 0.55 1.04 -0.46 -0.27 2.02 -1.08 -2.68 112.91 112.05 3h0m h THR 379 Ca 0.15 -0.26 -0.10 0.00 0.77 0.00 0.00 66.41 66.97 3h0m h THR 379 Cb 0.04 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 66.66 3h0m h THR 379 CO -0.02 0.14 -0.12 0.78 0.37 0.00 0.00 175.52 176.66 3h0m h ASN 380 N 0.76 0.84 -0.62 4.18 2.35 -0.17 -1.73 115.58 121.18 3h0m h ASN 380 Ca 0.28 -0.26 0.12 0.00 -0.55 0.00 0.00 56.30 55.89 3h0m h ASN 380 Cb 0.08 -0.23 -0.12 0.00 0.05 0.00 0.00 38.32 38.11 3h0m h ASN 380 CO -0.13 0.97 -0.16 0.44 -1.65 0.00 0.00 177.43 176.89 3h0m h ASP 381 N 0.75 -0.61 -0.33 5.81 3.32 -0.83 -1.15 116.42 123.39 3h0m h ASP 381 Ca 0.12 0.19 -0.05 0.00 0.02 0.00 0.00 57.03 57.31 3h0m h ASP 381 Cb 0.63 0.40 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 3h0m h ASP 381 CO 0.04 -0.21 0.03 -0.26 -1.72 0.00 0.00 179.24 177.12 3h0m h PHE 382 N -0.01 0.61 -0.45 4.55 0.04 -1.08 -0.63 116.94 119.98 3h0m h PHE 382 Ca 0.30 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.95 3h0m h PHE 382 Cb 0.46 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 3h0m h PHE 382 CO -0.52 0.67 0.18 -0.07 -0.60 0.00 0.00 178.31 177.97 3h0m h LEU 383 N 0.39 0.58 -0.01 1.54 3.38 -0.87 0.12 115.31 120.43 3h0m h LEU 383 Ca 0.10 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3h0m h LEU 383 Cb 0.40 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3h0m h LEU 383 CO 0.01 0.52 -0.04 0.50 0.09 0.00 0.00 178.44 179.53 3h0m h LYS 384 N 0.64 0.05 -0.47 1.13 3.64 -1.01 -3.13 116.57 117.42 3h0m h LYS 384 Ca 0.16 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.58 3h0m h LYS 384 Cb 0.12 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 3h0m h LYS 384 CO -0.02 0.65 0.32 0.00 -2.27 0.00 0.00 179.45 178.13 3h0m h ALA 385 N 0.40 2.07 0.00 5.00 0.00 -0.79 -0.93 119.26 125.02 3h0m h ALA 385 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h0m h ALA 385 Cb 0.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3h0m h ALA 385 CO 0.01 -0.18 0.00 1.19 0.00 0.00 0.00 179.25 180.27 3h0m n PHE 386 N -4.46 0.00 0.07 0.00 3.72 0.40 -2.12 117.46 115.07 3h0m n PHE 386 Ca 0.07 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.39 3h0m n PHE 386 Cb 0.34 -0.19 0.04 0.00 -0.94 0.00 0.00 39.48 38.72 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 0.28 0.00 -1.08 5.08 -1.13 -3.34 114.58 114.39 3h0m h GLU 387 Ca 0.00 -0.25 -0.22 0.00 -1.00 0.00 0.00 59.36 57.89 3h0m h GLU 387 Cb 0.15 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 3h0m h GLU 387 CO 0.00 0.92 -1.72 0.39 -1.00 0.00 0.00 179.01 177.59 3h0m n GLU 388 N -3.77 0.64 -4.11 2.33 1.02 -0.90 -5.03 120.64 110.81 3h0m n GLU 388 Ca -0.04 0.16 -0.09 0.00 -0.02 0.00 0.00 57.16 57.16 3h0m n GLU 388 Cb 0.73 -1.72 -0.10 0.00 -0.02 0.00 0.00 31.44 30.32 3h0m n GLU 388 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3h0m s VAL 389 N -2.82 0.46 -0.21 2.62 1.01 -0.99 -4.97 120.40 115.49 3h0m s VAL 389 Ca -0.05 -1.71 0.15 0.00 0.00 0.00 0.00 61.98 60.37 3h0m s VAL 389 Cb 0.08 -1.39 -0.23 0.00 0.00 0.00 0.00 36.38 34.84 3h0m s VAL 389 CO 0.83 -0.84 0.02 0.47 0.00 0.00 0.00 175.10 175.58 3h0m n ASP 390 N 0.31 0.43 -4.07 3.32 8.00 -0.58 -4.44 116.55 119.52 3h0m n ASP 390 Ca -0.15 -0.02 -0.07 0.00 0.71 0.00 0.00 54.79 55.25 3h0m n ASP 390 Cb 0.60 0.75 -0.10 0.00 -0.02 0.00 0.00 41.12 42.35 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 -2.49 0.21 -0.14 2.53 -7.23 -1.01 -4.34 120.40 107.92 3h0m s VAL 391 Ca -0.14 -1.69 0.01 0.00 -1.81 0.00 0.00 61.98 58.35 3h0m s VAL 391 Cb 0.06 -1.39 0.00 0.00 0.56 0.00 0.00 36.38 35.61 3h0m s VAL 391 CO 0.77 -0.94 -0.18 -0.63 -0.31 0.00 0.00 175.10 173.82 3h0m s ILE 392 N -3.68 2.47 0.08 -0.62 1.01 -0.23 -1.29 121.20 118.94 3h0m s ILE 392 Ca 0.05 -0.84 0.06 0.00 0.00 0.00 0.00 60.65 59.92 3h0m s ILE 392 Cb 0.06 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.47 3h0m s ILE 392 CO -0.09 0.53 -0.10 0.00 0.00 0.00 0.00 174.94 175.28 3h0m s ALA 393 N 0.73 2.96 0.19 9.38 0.00 -0.64 -0.58 121.76 133.80 3h0m s ALA 393 Ca -0.08 -1.20 -0.24 0.00 0.00 0.00 0.00 51.96 50.45 3h0m s ALA 393 Cb -0.16 -0.94 0.05 0.00 0.00 0.00 0.00 23.12 22.08 3h0m s ALA 393 CO 0.01 0.64 0.88 -1.54 0.00 0.00 0.00 175.76 175.74 3h0m s SER 394 N -2.03 -0.21 0.62 0.00 1.04 -0.81 -4.56 113.70 107.76 3h0m s SER 394 Ca 0.20 -0.46 -0.18 0.00 0.48 0.00 0.00 55.95 55.99 3h0m s SER 394 Cb -0.11 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 3h0m s SER 394 CO 0.12 -1.04 1.16 -2.65 0.98 0.00 0.00 173.24 171.82 3h0m n PRO 395 N -0.46 1.07 0.11 4.02 -0.02 -1.26 0.17 135.00 138.62 3h0m n PRO 395 Ca -0.06 0.41 -0.04 0.00 -2.02 0.00 0.00 63.50 61.80 3h0m n PRO 395 Cb 0.60 -2.38 0.07 0.00 -0.02 0.00 0.00 33.50 31.77 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 0.58 1.51 -3.75 3.45 2.02 -1.61 -3.41 112.91 111.70 3h0m h THR 396 Ca -0.50 -2.49 -0.24 0.00 0.77 0.00 0.00 66.41 63.95 3h0m h THR 396 Cb 1.35 2.34 -0.28 0.00 -1.74 0.00 0.00 68.15 69.82 3h0m h THR 396 CO 0.52 0.72 -0.72 -0.89 0.37 0.00 0.00 175.52 175.51 3h0m s THR 397 N -3.35 0.05 0.27 3.16 2.01 -1.26 -4.42 115.64 112.09 3h0m s THR 397 Ca -0.01 -0.03 0.35 0.00 0.31 0.00 0.00 61.69 62.31 3h0m s THR 397 Cb 0.12 -0.05 0.39 0.00 0.01 0.00 0.00 72.50 72.96 3h0m s THR 397 CO 0.79 0.01 2.08 1.55 -0.69 0.00 0.00 174.62 178.36 3h0m h PRO 398 N 6.13 0.00 -5.10 4.92 0.13 -1.88 -3.46 132.00 132.74 3h0m h PRO 398 Ca -0.24 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.46 3h0m h PRO 398 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 3h0m h PRO 398 CO 0.51 0.03 -0.61 0.95 -0.23 0.00 0.00 178.00 178.64 3h0m s THR 399 N -3.83 0.96 0.71 1.56 -4.23 -1.26 -0.83 115.64 108.72 3h0m s THR 399 Ca -0.01 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.38 3h0m s THR 399 Cb 0.10 -2.72 0.02 0.00 1.34 0.00 0.00 72.50 71.25 3h0m s THR 399 CO 0.52 -0.02 1.08 -0.76 -0.54 0.00 0.00 174.62 174.91 3h0m s LEU 400 N -3.42 3.17 -0.46 4.79 1.43 -1.26 -4.95 118.68 117.98 3h0m s LEU 400 Ca 0.37 1.79 -0.45 0.00 -1.03 0.00 0.00 54.13 54.81 3h0m s LEU 400 Cb 0.08 -4.52 -0.19 0.00 0.03 0.00 0.00 46.19 41.59 3h0m s LEU 400 CO 0.15 -1.70 1.51 -2.65 0.23 0.00 0.00 176.35 173.89 3h0m n PRO 401 N -3.05 0.00 -2.56 1.29 -0.02 -1.26 -4.96 135.00 124.44 3h0m n PRO 401 Ca 0.09 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.33 3h0m n PRO 401 Cb 0.53 -1.43 0.11 0.00 -0.02 0.00 0.00 33.50 32.68 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 2.78 1.66 0.30 6.00 -0.12 -1.26 -4.84 117.98 122.49 3h0m s PHE 402 Ca 1.00 -0.23 -0.06 0.00 -0.05 0.00 0.00 56.93 57.58 3h0m s PHE 402 Cb -1.43 -3.02 -0.06 0.00 -0.63 0.00 0.00 43.02 37.88 3h0m s PHE 402 CO 0.78 -1.71 0.58 0.15 -0.05 0.00 0.00 175.22 174.97 3h0m s LYS 403 N -5.16 3.67 0.46 1.99 1.02 -1.26 -1.79 119.74 118.67 3h0m s LYS 403 Ca 0.66 0.09 -0.23 0.00 0.02 0.00 0.00 55.97 56.52 3h0m s LYS 403 Cb -0.06 -2.61 -0.10 0.00 -0.52 0.00 0.00 37.83 34.55 3h0m s LYS 403 CO 0.44 0.19 0.95 1.19 -0.92 0.00 0.00 175.35 177.20 3h0m n PHE 404 N -0.90 0.92 -0.02 3.18 3.72 -1.21 -1.93 117.46 121.22 3h0m n PHE 404 Ca -0.01 0.53 0.00 0.00 -0.05 0.00 0.00 57.45 57.92 3h0m n PHE 404 Cb 0.54 -2.19 0.00 0.00 -0.94 0.00 0.00 39.48 36.89 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 1.27 2.30 0.15 1.37 0.00 -1.26 -4.85 105.19 104.17 3h0m n GLY 405 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3h0m n GLY 405 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h0m h GLU 406 N 1.58 0.00 0.00 1.61 5.08 -1.79 -3.27 114.58 117.79 3h0m h GLU 406 Ca 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 3h0m h GLU 406 Cb 0.00 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.12 3h0m h GLU 406 CO 0.00 0.54 -0.66 0.54 -1.00 0.00 0.00 179.01 178.43 3h0m n ARG 407 N -3.84 1.01 -0.01 2.33 1.74 -1.26 -4.62 116.66 112.02 3h0m n ARG 407 Ca -0.01 -2.79 0.08 0.00 -0.77 0.00 0.00 57.85 54.36 3h0m n ARG 407 Cb 0.56 -1.05 -0.12 0.00 -1.02 0.00 0.00 32.46 30.83 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 -0.57 0.25 0.11 0.55 4.77 -1.23 -3.88 117.00 117.00 3h0m n LEU 408 Ca 0.14 -0.16 -0.04 0.00 -0.03 0.00 0.00 56.01 55.92 3h0m n LEU 408 Cb 0.84 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.91 3h0m n LEU 408 CO -0.04 0.06 0.42 -0.08 -1.33 0.00 0.00 177.39 176.43 3h0m h GLU 409 N 0.00 -0.28 -5.01 3.23 4.81 -1.82 -3.40 114.58 112.11 3h0m h GLU 409 Ca 0.00 0.02 -0.63 0.00 -0.13 0.00 0.00 59.36 58.62 3h0m h GLU 409 Cb 0.67 0.06 -0.16 0.00 0.63 0.00 0.00 28.75 29.95 3h0m h GLU 409 CO 0.00 -0.19 -0.45 1.21 -0.73 0.00 0.00 179.01 178.85 3h0m s ASN 410 N -2.70 6.10 0.46 1.04 2.47 -1.26 -4.97 114.94 116.08 3h0m s ASN 410 Ca -0.04 0.09 0.20 0.00 0.42 0.00 0.00 52.86 53.53 3h0m s ASN 410 Cb 0.00 -2.14 1.19 0.00 -1.45 0.00 0.00 41.25 38.86 3h0m s ASN 410 CO 0.13 -0.05 1.93 -0.65 -3.72 0.00 0.00 177.10 174.74 3h0m h PRO 411 N 8.11 0.26 -1.00 0.43 0.11 -1.83 -1.24 132.00 136.84 3h0m h PRO 411 Ca -0.35 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.83 3h0m h PRO 411 Cb 1.18 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.16 3h0m h PRO 411 CO 0.60 0.17 0.64 0.82 -0.21 0.00 0.00 178.00 180.02 3h0m h ILE 412 N 0.26 1.02 0.00 4.15 2.04 -1.93 -0.85 117.51 122.20 3h0m h ILE 412 Ca 0.36 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 3h0m h ILE 412 Cb 1.01 -0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 3h0m h ILE 412 CO -0.08 0.20 -0.04 -0.33 0.00 0.00 0.00 178.15 177.90 3h0m h GLU 413 N 1.10 0.00 -0.31 2.37 5.08 -1.52 -0.70 114.58 120.61 3h0m h GLU 413 Ca 0.46 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.70 3h0m h GLU 413 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3h0m h GLU 413 CO -0.21 0.04 -0.27 1.98 -1.00 0.00 0.00 179.01 179.54 3h0m h MET 414 N 0.00 0.73 -0.78 2.33 4.05 -1.24 -3.25 114.93 116.77 3h0m h MET 414 Ca -0.00 -0.37 -0.01 0.00 -0.28 0.00 0.00 59.70 59.03 3h0m h MET 414 Cb 0.07 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.84 3h0m h MET 414 CO 0.00 0.99 0.44 1.88 0.23 0.00 0.00 176.91 180.45 3h0m h TYR 415 N 0.49 1.06 0.00 1.39 0.05 -0.97 -2.61 116.97 116.38 3h0m h TYR 415 Ca 0.05 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.82 3h0m h TYR 415 Cb 0.84 -0.34 0.00 0.00 1.01 0.00 0.00 36.73 38.24 3h0m h TYR 415 CO 0.07 0.73 0.00 1.28 -1.05 0.00 0.00 178.16 179.19 3h0m n LEU 416 N -4.36 0.04 0.26 3.88 4.77 -0.86 -0.98 117.00 119.75 3h0m n LEU 416 Ca 0.08 0.52 0.14 0.00 -0.03 0.00 0.00 56.01 56.72 3h0m n LEU 416 Cb 0.09 -0.52 0.62 0.00 -2.33 0.00 0.00 43.42 41.28 3h0m n LEU 416 CO 0.38 -0.51 0.92 0.28 -1.33 0.00 0.00 177.39 177.14 3h0m h SER 417 N 0.00 0.00 -0.16 -1.43 0.02 -1.60 -3.26 113.55 107.12 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 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 3h0m h SER 417 CO 0.00 0.10 0.00 0.47 -1.14 0.00 0.00 176.83 176.26 3h0m n ASP 418 N -3.27 2.75 0.26 3.07 8.00 -0.16 -4.58 116.55 122.63 3h0m n ASP 418 Ca -0.00 -1.89 0.18 0.00 0.71 0.00 0.00 54.79 53.79 3h0m n ASP 418 Cb 0.34 -0.09 0.92 0.00 -0.02 0.00 0.00 41.12 42.26 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 3.96 0.28 -0.01 0.53 3.07 -1.73 0.15 117.51 123.76 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 0.85 0.85 0.00 0.00 -0.27 0.00 0.00 36.82 38.26 3h0m h ILE 419 CO 0.00 0.00 -0.42 0.18 -1.05 0.00 0.00 178.15 176.86 3h0m n LEU 420 N -3.48 1.54 -0.09 0.16 4.77 -1.26 -4.62 117.00 114.03 3h0m n LEU 420 Ca -0.00 -0.72 -0.11 0.00 -0.03 0.00 0.00 56.01 55.14 3h0m n LEU 420 Cb 0.27 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.26 3h0m n LEU 420 CO 0.23 0.30 -1.06 0.35 -1.33 0.00 0.00 177.39 175.89 3h0m n THR 421 N -0.31 1.02 0.14 -5.08 -2.24 0.45 -4.65 114.28 103.61 3h0m n THR 421 Ca 0.06 -0.46 -0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3h0m n THR 421 Cb 0.34 -1.00 0.26 0.00 -2.10 0.00 0.00 70.33 67.84 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 1.32 -1.00 2.28 -1.51 -1.43 -3.03 116.25 112.88 3h0m h VAL 422 Ca -0.40 -1.57 0.23 0.00 -1.23 0.00 0.00 66.70 63.74 3h0m h VAL 422 Cb 1.70 1.79 -0.09 0.00 -2.13 0.00 0.00 31.29 32.56 3h0m h VAL 422 CO -0.04 0.46 0.64 -0.65 -1.23 0.00 0.00 177.57 176.74 3h0m h PRO 423 N 0.08 0.48 0.00 5.19 0.11 -1.85 -1.38 132.00 134.64 3h0m h PRO 423 Ca 0.00 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.98 3h0m h PRO 423 Cb 0.82 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.81 3h0m h PRO 423 CO 0.06 0.32 -0.52 0.00 -0.21 0.00 0.00 178.00 177.65 3h0m h ALA 424 N 1.63 1.02 -0.04 -0.75 0.00 -1.85 -2.48 119.26 116.79 3h0m h ALA 424 Ca 0.57 -0.47 -0.22 0.00 0.00 0.00 0.00 54.91 54.78 3h0m h ALA 424 Cb 1.28 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 19.00 3h0m h ALA 424 CO -0.30 0.65 -0.85 -0.91 0.00 0.00 0.00 179.25 177.84 3h0m h ASN 425 N 0.00 0.82 -0.66 0.00 4.21 -1.43 0.19 115.58 118.70 3h0m h ASN 425 Ca -0.01 -0.71 0.12 0.00 1.21 0.00 0.00 56.30 56.91 3h0m h ASN 425 Cb 0.99 -0.25 -0.08 0.00 -1.12 0.00 0.00 38.32 37.86 3h0m h ASN 425 CO 0.07 1.42 0.23 -0.07 -1.29 0.00 0.00 177.43 177.78 3h0m h LEU 426 N 0.29 0.19 -0.39 1.61 3.38 -1.29 -1.90 115.31 117.20 3h0m h LEU 426 Ca -0.10 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h0m h LEU 426 Cb 1.51 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.35 3h0m h LEU 426 CO 0.17 0.10 -0.09 0.00 0.09 0.00 0.00 178.44 178.70 3h0m n ALA 427 N -2.52 2.76 -1.65 1.53 0.00 -0.94 -4.85 120.51 114.83 3h0m n ALA 427 Ca 0.11 -0.31 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 3h0m n ALA 427 Cb 0.33 -1.29 -0.04 0.00 0.00 0.00 0.00 19.45 18.45 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 1.23 0.97 3.87 0.00 0.00 -0.72 -4.98 105.19 105.57 3h0m n GLY 428 Ca 0.16 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.41 4.06 0.56 0.99 1.43 0.60 -1.98 118.68 120.92 3h0m s LEU 429 Ca 0.00 1.00 -0.19 0.00 -1.03 0.00 0.00 54.13 53.91 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 -0.19 1.12 -2.16 0.23 0.00 0.00 176.35 175.35 3h0m s PRO 430 N -3.18 3.31 -0.21 1.29 0.04 -1.26 -4.57 135.00 130.42 3h0m s PRO 430 Ca 0.49 1.54 -0.18 0.00 0.04 0.00 0.00 61.00 62.89 3h0m s PRO 430 Cb -0.11 -2.01 0.06 0.00 0.04 0.00 0.00 34.50 32.48 3h0m s PRO 430 CO 0.24 -0.87 0.55 0.00 0.04 0.00 0.00 177.00 176.96 3h0m s ALA 431 N -1.90 -1.39 -0.01 8.56 0.00 -0.42 -1.63 121.76 124.97 3h0m s ALA 431 Ca 0.71 1.66 0.07 0.00 0.00 0.00 0.00 51.96 54.40 3h0m s ALA 431 Cb -0.22 -0.97 -0.02 0.00 0.00 0.00 0.00 23.12 21.90 3h0m s ALA 431 CO 0.29 -0.28 -0.23 -1.50 0.00 0.00 0.00 175.76 174.04 3h0m s ILE 432 N 0.59 1.86 -0.18 0.00 2.07 -0.26 -1.62 121.20 123.67 3h0m s ILE 432 Ca -0.02 -1.06 -0.04 0.00 -1.41 0.00 0.00 60.65 58.11 3h0m s ILE 432 Cb -0.05 -1.56 -0.02 0.00 0.13 0.00 0.00 42.46 40.96 3h0m s ILE 432 CO -0.03 0.48 -0.03 -0.55 -1.91 0.00 0.00 174.94 172.89 3h0m s SER 433 N -0.68 4.72 -0.03 4.50 0.15 -0.02 -1.59 113.70 120.76 3h0m s SER 433 Ca 0.09 -0.19 0.05 0.00 0.70 0.00 0.00 55.95 56.60 3h0m s SER 433 Cb -0.09 -1.79 -0.01 0.00 -1.71 0.00 0.00 66.02 62.42 3h0m s SER 433 CO -0.00 0.11 -0.19 -0.63 1.20 0.00 0.00 173.24 173.72 3h0m s ILE 434 N 0.73 1.56 0.04 6.45 -1.09 0.14 -1.65 121.20 127.37 3h0m s ILE 434 Ca -0.01 -0.82 -0.30 0.00 -2.23 0.00 0.00 60.65 57.28 3h0m s ILE 434 Cb -0.14 -1.31 -0.04 0.00 -1.58 0.00 0.00 42.46 39.38 3h0m s ILE 434 CO 0.02 0.44 1.06 -2.16 -1.23 0.00 0.00 174.94 173.08 3h0m s PRO 435 N -0.27 4.53 -0.00 2.79 0.05 -1.26 0.66 135.00 141.49 3h0m s PRO 435 Ca 0.03 1.56 0.02 0.00 0.05 0.00 0.00 61.00 62.66 3h0m s PRO 435 Cb -0.09 -3.40 -0.03 0.00 0.05 0.00 0.00 34.50 31.02 3h0m s PRO 435 CO 0.01 -0.10 0.04 0.44 0.05 0.00 0.00 177.00 177.44 3h0m n ILE 436 N 3.74 0.00 -3.74 0.56 -5.35 0.68 -4.86 119.36 110.39 3h0m n ILE 436 Ca 0.07 -0.05 -0.04 0.00 -0.27 0.00 0.00 62.75 62.46 3h0m n ILE 436 Cb 0.49 0.41 -0.01 0.00 -1.74 0.00 0.00 39.64 38.79 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 -2.14 -1.63 -0.14 -1.28 0.00 -1.21 -4.90 121.76 110.47 3h0m s ALA 437 Ca -0.01 0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.12 3h0m s ALA 437 Cb 0.01 0.65 0.02 0.00 0.00 0.00 0.00 23.12 23.80 3h0m s ALA 437 CO 0.08 -1.02 -0.17 -1.58 0.00 0.00 0.00 175.76 173.07 3h0m s TRP 438 N -3.33 2.36 -0.12 0.00 0.52 -1.26 -1.27 118.94 115.84 3h0m s TRP 438 Ca 0.12 -1.26 -0.00 0.00 0.02 0.00 0.00 56.10 54.97 3h0m s TRP 438 Cb -0.02 -1.67 0.02 0.00 -1.15 0.00 0.00 33.47 30.66 3h0m s TRP 438 CO 0.02 -0.64 -0.09 0.15 0.02 0.00 0.00 176.95 176.41 3h0m s LYS 439 N 1.17 1.72 -1.49 4.98 -0.14 -0.03 -4.67 119.74 121.27 3h0m s LYS 439 Ca -0.01 -0.33 -0.04 0.00 -1.36 0.00 0.00 55.97 54.23 3h0m s LYS 439 Cb -0.14 -1.70 0.02 0.00 -1.68 0.00 0.00 37.83 34.33 3h0m s LYS 439 CO -0.07 -0.24 0.41 -0.25 -0.76 0.00 0.00 175.35 174.44 3h0m n ASP 440 N 4.84 -5.36 0.00 2.83 8.00 -1.26 -2.25 116.55 123.35 3h0m n ASP 440 Ca -0.14 -0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.15 3h0m n ASP 440 Cb 0.50 -4.39 0.00 0.00 -0.02 0.00 0.00 41.12 37.21 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 -1.29 0.91 3.46 0.44 0.00 -1.26 -5.05 105.19 102.40 3h0m n GLY 441 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 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 2.67 0.57 0.99 1.43 -0.95 -4.90 118.68 118.48 3h0m s LEU 442 Ca 0.00 -0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 52.62 3h0m s LEU 442 Cb 0.00 -1.54 -0.05 0.00 0.03 0.00 0.00 46.19 44.63 3h0m s LEU 442 CO 0.00 0.31 1.19 -2.84 0.23 0.00 0.00 176.35 175.24 3h0m s PRO 443 N -0.98 3.16 -0.06 1.29 0.02 -1.26 -0.86 135.00 136.32 3h0m s PRO 443 Ca 0.13 1.77 0.03 0.00 0.02 0.00 0.00 61.00 62.95 3h0m s PRO 443 Cb -0.11 -2.00 0.01 0.00 0.02 0.00 0.00 34.50 32.42 3h0m s PRO 443 CO 0.02 -1.04 -0.14 0.08 -0.33 0.00 0.00 177.00 175.59 3h0m s VAL 444 N -1.63 1.26 -0.14 3.83 1.01 -0.39 -4.65 120.40 119.68 3h0m s VAL 444 Ca 0.75 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 62.07 3h0m s VAL 444 Cb -0.29 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 3h0m s VAL 444 CO 0.32 0.38 0.12 -0.83 0.00 0.00 0.00 175.10 175.09 3h0m s GLY 445 N 0.39 2.10 -0.12 4.51 0.00 -1.26 -0.23 107.32 112.71 3h0m s GLY 445 Ca -0.10 -0.67 -0.07 0.00 0.00 0.00 0.00 44.72 43.88 3h0m s GLY 445 CO 0.03 -0.26 0.13 -0.32 0.00 0.00 0.00 173.10 172.69 3h0m s GLY 446 N -0.65 2.14 -0.09 0.20 0.00 0.21 -1.70 107.32 107.44 3h0m s GLY 446 Ca 0.13 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.20 3h0m s GLY 446 CO 0.02 -0.38 -0.07 1.62 0.00 0.00 0.00 173.10 174.29 3h0m s GLN 447 N -0.99 2.96 -0.12 2.90 0.74 0.13 -0.69 119.66 124.59 3h0m s GLN 447 Ca 0.15 -0.56 0.01 0.00 0.05 0.00 0.00 55.36 55.01 3h0m s GLN 447 Cb -0.12 -2.65 0.02 0.00 1.10 0.00 0.00 33.01 31.36 3h0m s GLN 447 CO 0.04 0.55 -0.15 -0.51 -0.55 0.00 0.00 175.29 174.67 3h0m s LEU 448 N -0.50 1.70 -0.20 3.68 1.43 -0.62 -1.91 118.68 122.27 3h0m s LEU 448 Ca 0.07 -0.44 -0.08 0.00 -1.03 0.00 0.00 54.13 52.66 3h0m s LEU 448 Cb -0.12 -1.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 3h0m s LEU 448 CO 0.02 -0.00 0.08 -0.63 0.23 0.00 0.00 176.35 176.05 3h0m s ILE 449 N 1.10 4.83 0.46 -0.59 1.01 0.26 -1.10 121.20 127.17 3h0m s ILE 449 Ca -0.04 -0.01 0.07 0.00 0.00 0.00 0.00 60.65 60.67 3h0m s ILE 449 Cb -0.14 -3.20 -0.00 0.00 0.01 0.00 0.00 42.46 39.13 3h0m s ILE 449 CO -0.04 0.43 0.39 -0.83 0.00 0.00 0.00 174.94 174.90 3h0m s GLY 450 N 0.58 2.19 0.65 6.18 0.00 -0.65 -1.07 107.32 115.20 3h0m s GLY 450 Ca 0.04 -1.78 -0.15 0.00 0.00 0.00 0.00 44.72 42.84 3h0m s GLY 450 CO 0.01 -1.77 1.09 0.54 0.00 0.00 0.00 173.10 172.96 3h0m s LYS 451 N -4.18 2.95 -0.04 2.90 1.02 -1.26 -4.10 119.74 117.03 3h0m s LYS 451 Ca 0.45 1.28 -0.39 0.00 0.02 0.00 0.00 55.97 57.34 3h0m s LYS 451 Cb -0.02 -1.98 -0.17 0.00 -0.52 0.00 0.00 37.83 35.13 3h0m s LYS 451 CO 0.26 -1.12 1.38 0.72 -0.92 0.00 0.00 175.35 175.68 3h0m n HIS 452 N -2.41 1.46 -0.93 3.18 8.25 -1.26 -0.94 115.22 122.57 3h0m n HIS 452 Ca 0.10 0.74 0.00 0.00 -0.26 0.00 0.00 57.72 58.29 3h0m n HIS 452 Cb 0.52 -2.30 0.00 0.00 1.12 0.00 0.00 29.99 29.33 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 2.98 0.00 -1.87 4.41 7.02 -1.26 -4.92 117.44 123.79 3h0m n TRP 453 Ca 0.21 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 56.30 3h0m n TRP 453 Cb 0.14 -0.24 0.04 0.00 -2.42 0.00 0.00 31.31 28.83 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 -0.01 7.51 0.17 -0.99 -0.08 -0.12 -4.58 116.55 118.45 3h0m n ASP 454 Ca 0.00 -3.81 0.03 0.00 -1.51 0.00 0.00 54.79 49.50 3h0m n ASP 454 Cb 0.01 -1.07 0.42 0.00 2.34 0.00 0.00 41.12 42.82 3h0m n ASP 454 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3h0m h GLU 455 N 2.94 0.09 -0.25 -0.67 3.07 -1.92 -3.17 114.58 114.69 3h0m h GLU 455 Ca 0.57 -0.02 0.05 0.00 -0.50 0.00 0.00 59.36 59.45 3h0m h GLU 455 Cb 0.09 -0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 27.91 3h0m h GLU 455 CO 1.43 0.31 -0.46 1.15 -1.40 0.00 0.00 179.01 180.04 3h0m h THR 456 N 0.09 0.10 0.02 1.13 2.02 -1.98 -0.35 112.91 113.93 3h0m h THR 456 Ca 0.02 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.21 3h0m h THR 456 Cb 0.43 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 3h0m h THR 456 CO 0.03 0.00 -0.10 0.74 0.37 0.00 0.00 175.52 176.56 3h0m h THR 457 N -0.45 0.75 -1.01 3.16 2.02 -1.94 0.23 112.91 115.68 3h0m h THR 457 Ca 0.09 0.00 0.24 0.00 0.77 0.00 0.00 66.41 67.51 3h0m h THR 457 Cb 0.62 0.75 -0.11 0.00 -1.74 0.00 0.00 68.15 67.67 3h0m h THR 457 CO -0.48 0.00 0.62 -0.07 0.37 0.00 0.00 175.52 175.96 3h0m h LEU 458 N -0.18 0.62 -0.01 2.58 4.07 -1.56 -1.13 115.31 119.70 3h0m h LEU 458 Ca 0.03 0.11 -0.27 0.00 0.08 0.00 0.00 57.88 57.84 3h0m h LEU 458 Cb 0.22 0.01 0.02 0.00 1.08 0.00 0.00 40.66 41.99 3h0m h LEU 458 CO -0.09 0.13 -1.05 -0.07 -1.08 0.00 0.00 178.44 176.29 3h0m h LEU 459 N 0.56 0.89 0.16 1.67 3.38 0.41 -2.77 115.31 119.60 3h0m h LEU 459 Ca 0.62 -0.72 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3h0m h LEU 459 Cb 1.25 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.73 3h0m h LEU 459 CO -0.40 1.52 -0.08 1.56 0.09 0.00 0.00 178.44 181.13 3h0m h GLN 460 N 0.38 -0.20 -0.67 1.13 4.20 0.40 -0.12 115.11 120.22 3h0m h GLN 460 Ca -0.13 0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.68 3h0m h GLN 460 Cb 1.70 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 29.49 3h0m h GLN 460 CO 0.20 -0.03 0.44 0.82 -0.67 0.00 0.00 178.83 179.60 3h0m h ILE 461 N -0.34 0.94 -0.59 2.54 2.04 -1.35 -0.09 117.51 120.66 3h0m h ILE 461 Ca -0.02 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.57 3h0m h ILE 461 Cb 0.27 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 3h0m h ILE 461 CO 0.04 0.10 0.11 -1.28 0.00 0.00 0.00 178.15 177.12 3h0m h SER 462 N 0.57 0.94 -0.60 1.72 0.87 -1.10 -0.29 113.55 115.65 3h0m h SER 462 Ca 0.30 -0.26 -0.07 0.00 -1.23 0.00 0.00 61.79 60.53 3h0m h SER 462 Cb 0.44 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 3h0m h SER 462 CO -0.10 0.95 0.08 0.22 -0.53 0.00 0.00 176.83 177.46 3h0m h TYR 463 N 0.88 1.07 -0.50 2.24 3.20 0.45 -2.24 116.97 122.07 3h0m h TYR 463 Ca 0.18 -0.15 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 3h0m h TYR 463 Cb 0.41 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 3h0m h TYR 463 CO 0.03 0.93 -0.02 1.25 -1.64 0.00 0.00 178.16 178.71 3h0m h LEU 464 N 0.90 0.88 -1.22 2.82 5.85 -0.85 -3.05 115.31 120.65 3h0m h LEU 464 Ca 0.18 -0.32 -0.06 0.00 0.84 0.00 0.00 57.88 58.52 3h0m h LEU 464 Cb 0.44 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3h0m h LEU 464 CO 0.01 0.99 -0.12 -0.25 -0.34 0.00 0.00 178.44 178.73 3h0m h TRP 465 N 0.76 0.42 0.00 1.25 2.91 -0.90 -2.68 115.95 117.71 3h0m h TRP 465 Ca 0.14 -0.06 -0.10 0.00 1.13 0.00 0.00 58.89 60.01 3h0m h TRP 465 Cb 0.54 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 29.06 3h0m h TRP 465 CO 0.04 0.51 -0.46 1.05 -1.03 0.00 0.00 178.44 178.55 3h0m h GLU 466 N 0.37 0.00 -0.29 2.65 4.11 -1.30 0.14 114.58 120.26 3h0m h GLU 466 Ca 0.07 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.49 3h0m h GLU 466 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3h0m h GLU 466 CO 0.02 0.46 0.14 1.96 0.07 0.00 0.00 179.01 181.66 3h0m h GLN 467 N 0.00 0.42 -0.26 1.06 1.08 -1.39 -2.66 115.11 113.36 3h0m h GLN 467 Ca -0.00 -0.06 -0.16 0.00 -1.45 0.00 0.00 58.65 56.97 3h0m h GLN 467 Cb 0.84 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.19 3h0m h GLN 467 CO 0.06 0.41 -0.48 0.87 -0.95 0.00 0.00 178.83 178.74 3h0m h LYS 468 N 0.33 0.70 -3.12 1.46 1.57 -1.33 -3.42 116.57 112.76 3h0m h LYS 468 Ca 0.10 -0.41 -0.54 0.00 -1.87 0.00 0.00 60.65 57.93 3h0m h LYS 468 Cb 0.13 0.03 -0.40 0.00 0.08 0.00 0.00 32.23 32.07 3h0m h LYS 468 CO -0.01 1.02 -0.77 0.12 -0.57 0.00 0.00 179.45 179.24 3h0m s PHE 469 N -4.17 0.82 -1.33 -1.35 5.36 0.48 -5.06 117.98 112.73 3h0m s PHE 469 Ca -0.09 -1.11 -0.14 0.00 -0.96 0.00 0.00 56.93 54.64 3h0m s PHE 469 Cb 0.11 -1.15 0.10 0.00 -0.34 0.00 0.00 43.02 41.74 3h0m s PHE 469 CO 0.86 -0.80 1.89 1.63 -1.46 0.00 0.00 175.22 177.33 3h0m n LYS 470 N 5.11 3.22 0.29 10.12 5.02 -1.02 -4.21 118.16 136.68 3h0m n LYS 470 Ca -0.05 -3.22 0.18 0.00 -2.02 0.00 0.00 58.31 53.21 3h0m n LYS 470 Cb 0.43 -3.20 0.80 0.00 -0.02 0.00 0.00 35.03 33.04 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 6.49 0.00 0.00 2.13 2.07 -1.91 -2.82 115.15 121.11 3h0m h HIS 471 Ca 0.45 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.97 3h0m h HIS 471 Cb 0.73 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.71 3h0m h HIS 471 CO 1.34 0.00 0.00 2.48 -3.07 0.00 0.00 177.93 178.68 3h0m n TYR 472 N -3.05 0.03 0.10 6.12 0.18 -1.26 -2.08 117.16 117.19 3h0m n TYR 472 Ca -0.00 0.01 0.07 0.00 1.88 0.00 0.00 57.90 59.86 3h0m n TYR 472 Cb 0.25 -0.52 -0.01 0.00 -0.38 0.00 0.00 39.34 38.69 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 -6.31 -3.48 5.08 -1.89 -3.44 114.58 104.54 3h0m h GLU 473 Ca 0.00 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.82 3h0m h GLU 473 Cb 0.29 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.48 3h0m h GLU 473 CO 0.00 0.13 1.14 0.15 -1.00 0.00 0.00 179.01 179.44 3h0m s LYS 474 N -3.18 3.14 -0.20 2.33 -0.14 -0.89 -4.97 119.74 115.84 3h0m s LYS 474 Ca -0.00 0.34 -0.02 0.00 -1.36 0.00 0.00 55.97 54.93 3h0m s LYS 474 Cb 0.09 -4.19 0.00 0.00 -1.68 0.00 0.00 37.83 32.05 3h0m s LYS 474 CO 0.78 -2.14 -0.10 0.42 -0.76 0.00 0.00 175.35 173.55 3h0m s ILE 475 N 6.59 2.86 0.87 2.17 1.01 -1.26 -5.06 121.20 128.38 3h0m s ILE 475 Ca 0.52 -0.67 -0.13 0.00 0.00 0.00 0.00 60.65 60.37 3h0m s ILE 475 Cb -0.11 -2.27 0.14 0.00 0.01 0.00 0.00 42.46 40.23 3h0m s ILE 475 CO 0.22 0.47 1.22 -2.16 0.00 0.00 0.00 174.94 174.69 3h0m s PRO 476 N 1.40 1.33 -1.39 2.79 0.04 -1.26 -4.29 135.00 133.62 3h0m s PRO 476 Ca 0.05 -0.24 -0.04 0.00 0.04 0.00 0.00 61.00 60.81 3h0m s PRO 476 Cb -0.14 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.46 3h0m s PRO 476 CO -0.07 -1.95 0.39 1.28 0.04 0.00 0.00 177.00 176.69 3h0m n LEU 477 N -3.47 -1.97 0.00 -3.56 4.77 -1.26 -4.90 117.00 106.62 3h0m n LEU 477 Ca 0.12 -1.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 3h0m n LEU 477 Cb 0.60 -2.10 0.00 0.00 -2.33 0.00 0.00 43.42 39.59 3h0m n LEU 477 CO 0.50 0.46 0.00 0.35 -1.33 0.00 0.00 177.39 177.38