#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h75 n THR 52 N 0.00 0.29 -4.65 -5.08 -1.04 -1.26 -4.65 114.28 97.89 3h75 n THR 52 Ca 0.00 -0.07 -0.33 0.00 -2.04 0.00 0.00 64.05 61.61 3h75 n THR 52 Cb 0.00 -1.79 -0.12 0.00 -1.82 0.00 0.00 70.33 66.60 3h75 n THR 52 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3h75 s SER 53 N 0.87 4.45 -0.01 8.00 1.04 -1.26 -0.43 113.70 126.36 3h75 s SER 53 Ca 0.73 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 57.06 3h75 s SER 53 Cb -0.57 -1.04 0.00 0.00 0.10 0.00 0.00 66.02 64.52 3h75 s SER 53 CO 0.39 0.33 -0.03 -0.69 0.98 0.00 0.00 173.24 174.22 3h75 s VAL 54 N -0.85 0.30 -0.13 5.02 1.01 0.50 -1.56 120.40 124.69 3h75 s VAL 54 Ca 0.14 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.02 3h75 s VAL 54 Cb -0.11 -0.28 0.00 0.00 0.00 0.00 0.00 36.38 35.99 3h75 s VAL 54 CO 0.03 0.10 -0.21 -0.69 0.00 0.00 0.00 175.10 174.34 3h75 s VAL 55 N 0.16 2.26 -0.15 2.92 1.01 -0.48 -1.33 120.40 124.78 3h75 s VAL 55 Ca -0.01 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 3h75 s VAL 55 Cb -0.04 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 3h75 s VAL 55 CO -0.00 0.54 -0.11 0.12 0.00 0.00 0.00 175.10 175.64 3h75 s PHE 56 N 0.64 2.84 -0.65 5.22 5.36 0.21 -4.28 117.98 127.33 3h75 s PHE 56 Ca -0.10 -0.72 -0.19 0.00 -0.96 0.00 0.00 56.93 54.96 3h75 s PHE 56 Cb -0.16 -1.89 0.11 0.00 -0.34 0.00 0.00 43.02 40.74 3h75 s PHE 56 CO 0.02 -0.28 0.76 -0.51 -1.46 0.00 0.00 175.22 173.75 3h75 s LEU 57 N 0.57 5.43 -0.13 6.12 1.43 -1.26 -1.10 118.68 129.73 3h75 s LEU 57 Ca -0.07 -1.58 -0.29 0.00 -1.03 0.00 0.00 54.13 51.16 3h75 s LEU 57 Cb -0.15 -2.31 -0.01 0.00 0.03 0.00 0.00 46.19 43.75 3h75 s LEU 57 CO 0.03 -1.08 0.99 0.21 0.23 0.00 0.00 176.35 176.73 3h75 s ASN 58 N 3.52 7.18 0.35 2.29 3.84 0.02 -4.23 114.94 127.92 3h75 s ASN 58 Ca 0.14 1.46 0.26 0.00 0.21 0.00 0.00 52.86 54.93 3h75 s ASN 58 Cb -0.21 -2.54 0.76 0.00 -0.55 0.00 0.00 41.25 38.71 3h75 s ASN 58 CO 0.04 -0.48 1.74 1.55 -2.79 0.00 0.00 177.10 177.16 3h75 h PRO 59 N 7.18 0.00 0.00 0.43 0.13 -1.96 0.11 132.00 137.90 3h75 h PRO 59 Ca -0.29 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.72 3h75 h PRO 59 Cb 1.13 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.30 3h75 h PRO 59 CO 0.87 0.00 0.09 0.41 -0.23 0.00 0.00 178.00 179.14 3h75 n GLY 60 N 0.85 -0.55 3.86 1.56 0.00 -1.26 -2.33 105.19 107.32 3h75 n GLY 60 Ca 0.04 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.96 3h75 n GLY 60 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3h75 s ASN 61 N -2.30 6.62 0.00 1.61 0.01 -1.26 -1.62 114.94 118.00 3h75 s ASN 61 Ca 0.20 1.20 0.18 0.00 -0.71 0.00 0.00 52.86 53.74 3h75 s ASN 61 Cb -0.01 -2.35 1.03 0.00 0.41 0.00 0.00 41.25 40.33 3h75 s ASN 61 CO 0.14 -0.34 1.47 -1.54 -1.51 0.00 0.00 177.10 175.33 3h75 n SER 62 N -0.97 0.00 0.00 -1.22 3.41 -1.26 -1.55 113.62 112.03 3h75 n SER 62 Ca 0.03 -0.44 0.00 0.00 -0.26 0.00 0.00 58.87 58.20 3h75 n SER 62 Cb 0.54 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 3h75 n SER 62 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3h75 n THR 63 N -1.06 0.55 -2.63 6.66 -2.24 -1.26 -4.90 114.28 109.41 3h75 n THR 63 Ca 0.12 -0.71 -0.43 0.00 -2.27 0.00 0.00 64.05 60.76 3h75 n THR 63 Cb 0.08 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.06 3h75 n THR 63 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3h75 s GLU 64 N -0.55 3.95 0.20 -0.78 2.12 -0.59 -4.95 118.70 118.09 3h75 s GLU 64 Ca 0.00 0.89 -0.21 0.00 0.36 0.00 0.00 54.97 56.01 3h75 s GLU 64 Cb 0.00 -3.80 0.15 0.00 0.26 0.00 0.00 34.13 30.74 3h75 s GLU 64 CO 0.00 -1.07 1.56 1.15 -0.54 0.00 0.00 175.26 176.36 3h75 h THR 65 N 5.91 0.05 0.06 -1.70 2.02 -1.95 0.21 112.91 117.51 3h75 h THR 65 Ca -0.21 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 3h75 h THR 65 Cb 1.06 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3h75 h THR 65 CO 1.07 0.00 -0.03 0.15 0.37 0.00 0.00 175.52 177.08 3h75 h PHE 66 N -0.08 -0.07 0.00 3.16 3.57 -1.96 -1.12 116.94 120.43 3h75 h PHE 66 Ca 0.27 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.71 3h75 h PHE 66 Cb 0.56 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 3h75 h PHE 66 CO -0.81 -0.03 -0.27 -1.49 -2.23 0.00 0.00 178.31 173.47 3h75 h TRP 67 N -0.09 0.00 -0.15 0.41 4.06 -1.74 -0.71 115.95 117.73 3h75 h TRP 67 Ca -0.01 0.00 -0.22 0.00 2.06 0.00 0.00 58.89 60.72 3h75 h TRP 67 Cb 0.07 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.24 3h75 h TRP 67 CO -0.07 0.27 -0.78 0.28 -3.56 0.00 0.00 178.44 174.58 3h75 h VAL 68 N 0.00 1.28 -0.45 1.49 2.07 -0.77 -1.81 116.25 118.06 3h75 h VAL 68 Ca -0.00 -1.98 -0.06 0.00 0.82 0.00 0.00 66.70 65.48 3h75 h VAL 68 Cb 0.62 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.35 3h75 h VAL 68 CO 0.04 0.63 0.04 0.28 0.02 0.00 0.00 177.57 178.57 3h75 h SER 69 N 0.53 0.68 -0.30 0.57 0.02 -0.68 0.13 113.55 114.50 3h75 h SER 69 Ca -0.05 -0.14 -0.02 0.00 -0.84 0.00 0.00 61.79 60.74 3h75 h SER 69 Cb 1.41 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 3h75 h SER 69 CO 0.16 0.73 0.11 0.22 -1.14 0.00 0.00 176.83 176.91 3h75 h TYR 70 N 0.68 0.47 -0.34 3.45 3.20 -1.05 -1.74 116.97 121.65 3h75 h TYR 70 Ca 0.14 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 3h75 h TYR 70 Cb 0.37 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 3h75 h TYR 70 CO 0.02 0.47 0.13 0.77 -1.64 0.00 0.00 178.16 177.91 3h75 h SER 71 N 0.34 0.47 -0.68 -2.11 0.02 -0.79 -3.05 113.55 107.75 3h75 h SER 71 Ca 0.10 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 3h75 h SER 71 Cb 0.21 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.59 3h75 h SER 71 CO -0.01 0.51 0.35 1.56 -1.14 0.00 0.00 176.83 178.10 3h75 h GLN 72 N 0.40 0.98 -1.10 3.45 1.08 -0.63 0.20 115.11 119.49 3h75 h GLN 72 Ca 0.11 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3h75 h GLN 72 Cb 0.19 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3h75 h GLN 72 CO -0.01 0.75 0.00 0.34 -0.95 0.00 0.00 178.83 178.96 3h75 n PHE 73 N -4.34 0.00 0.00 2.96 7.35 -0.67 -1.82 117.46 120.94 3h75 n PHE 73 Ca 0.07 -0.09 0.00 0.00 -0.76 0.00 0.00 57.45 56.67 3h75 n PHE 73 Cb 0.12 -0.10 0.00 0.00 0.35 0.00 0.00 39.48 39.86 3h75 n PHE 73 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 3h75 n GLN 75 N 0.63 0.00 -0.20 -4.13 6.02 0.06 -1.87 117.38 117.89 3h75 n GLN 75 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 56.91 3h75 n GLN 75 Cb 0.12 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.40 3h75 n GLN 75 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3h75 h ALA 76 N 0.00 0.76 -0.55 -1.58 0.00 -1.62 -1.11 119.26 115.16 3h75 h ALA 76 Ca 0.00 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 3h75 h ALA 76 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3h75 h ALA 76 CO 0.00 0.43 0.02 0.00 0.00 0.00 0.00 179.25 179.69 3h75 h ALA 77 N 1.04 0.74 -0.70 0.00 0.00 -1.65 -2.27 119.26 116.42 3h75 h ALA 77 Ca 0.18 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3h75 h ALA 77 Cb 0.30 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3h75 h ALA 77 CO -0.00 0.55 0.40 0.00 0.00 0.00 0.00 179.25 180.19 3h75 h ALA 78 N 0.96 0.89 -0.39 0.00 0.00 -1.76 0.52 119.26 119.48 3h75 h ALA 78 Ca 0.16 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3h75 h ALA 78 Cb 0.51 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3h75 h ALA 78 CO 0.02 0.39 0.08 0.00 0.00 0.00 0.00 179.25 179.75 3h75 h ARG 79 N 0.95 0.62 -0.11 0.00 3.08 -1.08 -0.54 114.38 117.31 3h75 h ARG 79 Ca 0.25 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 60.02 3h75 h ARG 79 Cb 0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3h75 h ARG 79 CO -0.04 0.66 -0.48 0.22 -1.07 0.00 0.00 179.97 179.26 3h75 h ASP 80 N 0.48 0.29 0.34 7.04 3.58 -1.18 -3.12 116.42 123.85 3h75 h ASP 80 Ca 0.12 -0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.43 3h75 h ASP 80 Cb 0.32 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.29 3h75 h ASP 80 CO 0.00 0.72 -0.30 0.18 -2.88 0.00 0.00 179.24 176.97 3h75 n LEU 81 N -3.97 0.80 -1.99 2.28 4.77 0.15 -4.56 117.00 114.48 3h75 n LEU 81 Ca -0.02 -0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.69 3h75 n LEU 81 Cb 0.53 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.48 3h75 n LEU 81 CO 0.43 0.16 0.08 0.61 -1.33 0.00 0.00 177.39 177.34 3h75 n GLY 82 N 1.38 0.11 3.78 -0.72 0.00 -0.45 -5.03 105.19 104.26 3h75 n GLY 82 Ca 0.11 -0.22 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 3h75 n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h75 s LEU 83 N -4.17 3.84 -0.53 0.99 1.43 -0.34 -4.40 118.68 115.50 3h75 s LEU 83 Ca 0.26 0.03 -0.19 0.00 -1.03 0.00 0.00 54.13 53.21 3h75 s LEU 83 Cb -0.11 -2.45 0.07 0.00 0.03 0.00 0.00 46.19 43.73 3h75 s LEU 83 CO 0.32 0.20 0.62 -0.62 0.23 0.00 0.00 176.35 177.09 3h75 s ASP 84 N -2.24 6.20 -0.09 2.29 2.15 0.43 -4.61 116.67 120.80 3h75 s ASP 84 Ca 0.28 -1.12 0.01 0.00 0.43 0.00 0.00 52.55 52.14 3h75 s ASP 84 Cb -0.12 -2.28 -0.03 0.00 -0.30 0.00 0.00 42.92 40.19 3h75 s ASP 84 CO 0.20 -0.92 -0.09 -0.22 -0.17 0.00 0.00 175.17 173.97 3h75 s LEU 85 N 2.51 2.99 -0.07 -1.34 2.96 -1.26 -0.37 118.68 124.09 3h75 s LEU 85 Ca 0.13 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 3h75 s LEU 85 Cb -0.21 -1.66 0.01 0.00 0.50 0.00 0.00 46.19 44.83 3h75 s LEU 85 CO 0.10 0.29 -0.11 -0.13 -1.32 0.00 0.00 176.35 175.17 3h75 s ARG 86 N -0.38 1.65 -0.18 1.98 0.52 -0.44 -4.99 118.95 117.10 3h75 s ARG 86 Ca 0.05 -0.38 -0.01 0.00 -0.52 0.00 0.00 55.73 54.86 3h75 s ARG 86 Cb -0.12 -1.40 -0.00 0.00 0.52 0.00 0.00 34.95 33.94 3h75 s ARG 86 CO 0.02 -0.01 -0.11 0.42 0.02 0.00 0.00 175.30 175.64 3h75 s ILE 87 N 0.78 2.92 -0.24 1.52 1.01 -1.26 -0.62 121.20 125.31 3h75 s ILE 87 Ca -0.13 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 59.81 3h75 s ILE 87 Cb -0.15 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 3h75 s ILE 87 CO 0.02 0.48 0.00 -0.76 0.00 0.00 0.00 174.94 174.69 3h75 s LEU 88 N 1.08 3.14 0.10 2.97 1.43 -0.26 -4.98 118.68 122.17 3h75 s LEU 88 Ca 0.00 -0.35 -0.24 0.00 -1.03 0.00 0.00 54.13 52.51 3h75 s LEU 88 Cb -0.15 -1.81 -0.07 0.00 0.03 0.00 0.00 46.19 44.19 3h75 s LEU 88 CO -0.03 -0.04 0.73 -0.31 0.23 0.00 0.00 176.35 176.93 3h75 s TYR 89 N 1.53 3.83 -0.64 0.29 2.02 -1.26 -0.80 117.35 122.32 3h75 s TYR 89 Ca 0.06 1.50 0.25 0.00 -0.37 0.00 0.00 57.07 58.50 3h75 s TYR 89 Cb -0.15 -2.73 0.48 0.00 -0.40 0.00 0.00 41.96 39.17 3h75 s TYR 89 CO -0.01 0.45 1.47 0.00 -1.57 0.00 0.00 175.55 175.89 3h75 h ALA 90 N 4.84 0.74 -6.03 3.71 0.00 -0.82 -3.48 119.26 118.23 3h75 h ALA 90 Ca -0.46 0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.03 3h75 h ALA 90 Cb 1.21 0.00 0.06 0.00 0.00 0.00 0.00 17.79 19.06 3h75 h ALA 90 CO 0.67 0.00 -0.76 0.39 0.00 0.00 0.00 179.25 179.55 3h75 n GLU 91 N -2.25 -6.18 -2.30 0.00 -0.58 -0.64 -2.74 120.64 105.95 3h75 n GLU 91 Ca 0.04 0.70 -0.21 0.00 -0.42 0.00 0.00 57.16 57.27 3h75 n GLU 91 Cb 0.45 -5.57 -0.02 0.00 -0.57 0.00 0.00 31.44 25.73 3h75 n GLU 91 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3h75 n ARG 92 N -4.58 -1.64 -3.85 3.49 5.12 -0.99 -4.81 116.66 109.40 3h75 n ARG 92 Ca -0.11 1.04 -0.30 0.00 -1.93 0.00 0.00 57.85 56.55 3h75 n ARG 92 Cb 0.60 -5.66 -0.15 0.00 -1.16 0.00 0.00 32.46 26.08 3h75 n ARG 92 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3h75 s ASP 93 N -2.14 4.07 0.55 0.55 -1.08 -1.11 -5.00 116.67 112.50 3h75 s ASP 93 Ca 0.00 -1.58 0.28 0.00 -0.52 0.00 0.00 52.55 50.73 3h75 s ASP 93 Cb 0.00 -1.10 1.46 0.00 -1.46 0.00 0.00 42.92 41.81 3h75 s ASP 93 CO 0.00 -0.35 1.94 -0.65 0.52 0.00 0.00 175.17 176.63 3h75 h PRO 94 N 7.95 0.00 0.00 4.34 0.11 -1.90 0.61 132.00 143.12 3h75 h PRO 94 Ca -0.13 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.96 3h75 h PRO 94 Cb 1.04 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 3h75 h PRO 94 CO 0.46 0.00 -0.10 1.96 -0.21 0.00 0.00 178.00 180.11 3h75 h GLN 95 N 0.00 0.00 -0.12 1.05 1.08 -1.94 -1.36 115.11 113.82 3h75 h GLN 95 Ca 0.28 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.34 3h75 h GLN 95 Cb 1.23 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.65 3h75 h GLN 95 CO -0.00 0.10 -0.55 -0.91 -0.95 0.00 0.00 178.83 176.51 3h75 h ASN 96 N 0.00 0.39 -0.47 1.46 2.35 -1.17 -1.70 115.58 116.45 3h75 h ASN 96 Ca -0.00 -0.21 -0.05 0.00 -0.55 0.00 0.00 56.30 55.49 3h75 h ASN 96 Cb 0.23 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 3h75 h ASN 96 CO 0.01 0.87 0.11 0.74 -1.65 0.00 0.00 177.43 177.51 3h75 h THR 97 N 0.27 1.24 -0.43 2.81 2.02 -1.33 -0.03 112.91 117.46 3h75 h THR 97 Ca 0.00 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 3h75 h THR 97 Cb 1.06 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 3h75 h THR 97 CO 0.09 0.30 0.19 0.25 0.37 0.00 0.00 175.52 176.72 3h75 h LEU 98 N 0.63 0.57 -0.85 2.58 5.85 -1.30 -1.60 115.31 121.19 3h75 h LEU 98 Ca 0.15 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 3h75 h LEU 98 Cb 0.34 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3h75 h LEU 98 CO 0.00 0.55 -0.04 -0.61 -0.34 0.00 0.00 178.44 178.01 3h75 h GLN 99 N 0.54 0.82 -0.70 1.25 5.75 -1.13 0.94 115.11 122.59 3h75 h GLN 99 Ca 0.14 -0.24 -0.04 0.00 -0.15 0.00 0.00 58.65 58.36 3h75 h GLN 99 Cb 0.15 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.58 3h75 h GLN 99 CO -0.02 0.84 0.27 1.96 -2.65 0.00 0.00 178.83 179.24 3h75 h GLN 100 N 0.75 1.05 -0.10 1.69 4.20 -0.73 -1.23 115.11 120.74 3h75 h GLN 100 Ca 0.14 -0.19 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 3h75 h GLN 100 Cb 0.51 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 3h75 h GLN 100 CO 0.03 0.87 -0.13 0.00 -0.67 0.00 0.00 178.83 178.93 3h75 h ALA 101 N 1.12 0.16 -0.49 3.87 0.00 -0.98 -2.04 119.26 120.89 3h75 h ALA 101 Ca 0.23 -0.32 0.09 0.00 0.00 0.00 0.00 54.91 54.91 3h75 h ALA 101 Cb 0.22 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.91 3h75 h ALA 101 CO -0.02 0.03 0.05 -0.09 0.00 0.00 0.00 179.25 179.22 3h75 h ARG 102 N -0.14 0.17 0.00 0.00 2.43 -0.66 -1.08 114.38 115.10 3h75 h ARG 102 Ca 0.01 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 3h75 h ARG 102 Cb 0.68 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 3h75 h ARG 102 CO 0.03 0.11 -0.39 0.93 -1.51 0.00 0.00 179.97 179.14 3h75 h GLU 103 N 0.17 0.00 -0.43 0.20 5.08 -1.25 -2.88 114.58 115.47 3h75 h GLU 103 Ca 0.25 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.50 3h75 h GLU 103 Cb 0.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3h75 h GLU 103 CO -0.37 0.39 -0.15 -0.07 -1.00 0.00 0.00 179.01 177.82 3h75 h LEU 104 N 0.00 0.87 -1.25 1.33 3.38 -0.48 -1.81 115.31 117.36 3h75 h LEU 104 Ca -0.00 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.51 3h75 h LEU 104 Cb 0.91 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 3h75 h LEU 104 CO 0.05 1.05 -0.36 -0.26 0.09 0.00 0.00 178.44 179.01 3h75 h PHE 105 N 0.68 0.02 0.00 1.13 0.04 -1.17 -2.90 116.94 114.74 3h75 h PHE 105 Ca 0.10 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.87 3h75 h PHE 105 Cb 0.69 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.84 3h75 h PHE 105 CO 0.05 0.38 -0.49 1.04 -0.60 0.00 0.00 178.31 178.69 3h75 n GLN 106 N -4.10 0.27 -2.56 1.51 6.02 -1.10 -4.93 117.38 112.49 3h75 n GLN 106 Ca -0.02 0.11 -0.23 0.00 -0.01 0.00 0.00 57.00 56.85 3h75 n GLN 106 Cb 0.40 -1.70 0.09 0.00 1.02 0.00 0.00 30.24 30.05 3h75 n GLN 106 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3h75 s GLY 107 N -3.61 1.77 0.68 1.08 0.00 -0.69 -5.09 107.32 101.45 3h75 s GLY 107 Ca 0.07 -1.58 0.01 0.00 0.00 0.00 0.00 44.72 43.22 3h75 s GLY 107 CO 0.69 -1.08 0.94 0.50 0.00 0.00 0.00 173.10 174.15 3h75 s ARG 108 N -5.08 1.86 -1.22 2.90 0.52 -1.26 -4.56 118.95 112.10 3h75 s ARG 108 Ca 0.64 -1.14 -0.14 0.00 -0.52 0.00 0.00 55.73 54.56 3h75 s ARG 108 Cb -0.07 -2.39 -0.00 0.00 0.52 0.00 0.00 34.95 33.01 3h75 s ARG 108 CO 0.43 -1.28 0.69 -0.25 0.02 0.00 0.00 175.30 174.90 3h75 n ASP 109 N -2.70 -3.67 -4.79 0.23 8.00 -1.26 -4.92 116.55 107.44 3h75 n ASP 109 Ca 0.14 -1.01 -0.34 0.00 0.71 0.00 0.00 54.79 54.29 3h75 n ASP 109 Cb 0.61 -3.29 -0.02 0.00 -0.02 0.00 0.00 41.12 38.39 3h75 n ASP 109 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3h75 s LYS 110 N -6.18 3.69 0.75 -1.24 1.02 -1.26 -5.03 119.74 111.50 3h75 s LYS 110 Ca 0.32 1.44 -0.11 0.00 0.02 0.00 0.00 55.97 57.63 3h75 s LYS 110 Cb -0.12 -2.08 0.04 0.00 -0.52 0.00 0.00 37.83 35.15 3h75 s LYS 110 CO 0.87 -0.53 1.08 -1.25 -0.92 0.00 0.00 175.35 174.60 3h75 s PRO 111 N -3.22 2.47 0.15 -1.68 0.04 -1.26 -4.96 135.00 126.53 3h75 s PRO 111 Ca 0.68 0.70 -0.10 0.00 0.04 0.00 0.00 61.00 62.33 3h75 s PRO 111 Cb -0.19 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 3h75 s PRO 111 CO 0.22 -1.37 1.47 -0.44 0.04 0.00 0.00 177.00 176.93 3h75 h ASP 112 N -0.91 0.96 -4.32 6.66 3.32 -1.75 -3.44 116.42 116.94 3h75 h ASP 112 Ca -0.46 -0.45 -0.48 0.00 0.02 0.00 0.00 57.03 55.66 3h75 h ASP 112 Cb 1.25 -0.27 -0.24 0.00 0.22 0.00 0.00 39.33 40.29 3h75 h ASP 112 CO 0.59 1.24 -0.80 -0.31 -1.72 0.00 0.00 179.24 178.24 3h75 s TYR 113 N -4.32 1.42 0.43 4.55 2.02 -0.60 -1.55 117.35 119.30 3h75 s TYR 113 Ca -0.11 -0.39 0.04 0.00 -0.37 0.00 0.00 57.07 56.24 3h75 s TYR 113 Cb 0.11 -0.82 -0.04 0.00 -0.40 0.00 0.00 41.96 40.81 3h75 s TYR 113 CO 0.88 0.08 0.04 -1.17 -1.57 0.00 0.00 175.55 173.81 3h75 s LEU 114 N -1.39 2.34 0.00 -1.29 0.20 0.05 -1.38 118.68 117.21 3h75 s LEU 114 Ca 0.03 -1.55 0.00 0.00 0.69 0.00 0.00 54.13 53.30 3h75 s LEU 114 Cb -0.09 -0.57 0.00 0.00 -0.43 0.00 0.00 46.19 45.10 3h75 s LEU 114 CO 0.02 -0.74 0.00 0.00 -0.29 0.00 0.00 176.35 175.34 3h75 n LEU 116 N -1.02 0.00 -4.79 -0.68 -0.00 -0.65 -1.29 117.00 108.57 3h75 n LEU 116 Ca -0.10 0.00 -0.38 0.00 -0.00 0.00 0.00 56.01 55.53 3h75 n LEU 116 Cb 0.66 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 44.02 3h75 n LEU 116 CO 0.41 0.00 0.42 -0.69 -0.00 0.00 0.00 177.39 177.53 3h75 s VAL 117 N -2.00 4.49 0.34 1.47 1.01 -1.26 -0.97 120.40 123.48 3h75 s VAL 117 Ca 0.00 1.49 -0.26 0.00 0.00 0.00 0.00 61.98 63.21 3h75 s VAL 117 Cb 0.00 -4.01 -0.09 0.00 0.00 0.00 0.00 36.38 32.27 3h75 s VAL 117 CO 0.00 0.44 1.01 0.21 0.00 0.00 0.00 175.10 176.76 3h75 s ASN 118 N -1.29 7.15 0.09 3.32 2.47 -0.99 -4.78 114.94 120.92 3h75 s ASN 118 Ca 0.37 1.99 -0.18 0.00 0.42 0.00 0.00 52.86 55.45 3h75 s ASN 118 Cb -0.21 -2.59 0.04 0.00 -1.45 0.00 0.00 41.25 37.04 3h75 s ASN 118 CO 0.23 -0.21 0.44 -0.70 -3.72 0.00 0.00 177.10 173.14 3h75 s GLU 119 N -2.03 1.03 0.00 0.43 2.12 -1.26 -4.70 118.70 114.29 3h75 s GLU 119 Ca 0.51 -0.51 0.28 0.00 0.36 0.00 0.00 54.97 55.61 3h75 s GLU 119 Cb -0.23 0.46 1.29 0.00 0.26 0.00 0.00 34.13 35.92 3h75 s GLU 119 CO 0.29 -0.39 1.94 0.00 -0.54 0.00 0.00 175.26 176.55 3h75 n GLN 120 N 0.09 0.15 -0.02 4.30 10.64 -1.26 -3.64 117.38 127.63 3h75 n GLN 120 Ca -0.17 0.02 -0.04 0.00 -1.83 0.00 0.00 57.00 54.98 3h75 n GLN 120 Cb 0.62 -1.50 -0.02 0.00 -0.86 0.00 0.00 30.24 28.48 3h75 n GLN 120 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3h75 n TYR 121 N -1.42 0.00 0.07 2.61 4.01 -1.26 -4.75 117.16 116.42 3h75 n TYR 121 Ca 0.09 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.61 3h75 n TYR 121 Cb 0.29 -0.14 -0.15 0.00 -0.31 0.00 0.00 39.34 39.03 3h75 n TYR 121 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3h75 h VAL 122 N -0.08 1.10 -0.55 -0.72 2.07 -1.95 -3.35 116.25 112.77 3h75 h VAL 122 Ca -0.09 -2.52 0.08 0.00 0.82 0.00 0.00 66.70 64.99 3h75 h VAL 122 Cb 1.11 2.86 -0.07 0.00 -1.52 0.00 0.00 31.29 33.67 3h75 h VAL 122 CO -0.04 0.79 0.18 0.00 0.02 0.00 0.00 177.57 178.52 3h75 h ALA 123 N 0.07 0.67 -0.91 1.67 0.00 -1.87 -1.49 119.26 117.41 3h75 h ALA 123 Ca -0.29 0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.72 3h75 h ALA 123 Cb 1.98 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.79 3h75 h ALA 123 CO 0.17 -0.23 0.60 -1.35 0.00 0.00 0.00 179.25 178.43 3h75 h PRO 124 N 0.35 1.15 -0.61 0.00 0.11 -1.76 -0.85 132.00 130.39 3h75 h PRO 124 Ca 0.27 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.23 3h75 h PRO 124 Cb 0.33 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 3h75 h PRO 124 CO -0.29 0.76 0.07 1.96 -0.21 0.00 0.00 178.00 180.29 3h75 h GLN 125 N 1.18 1.02 -0.30 1.05 4.20 -1.52 -2.01 115.11 118.73 3h75 h GLN 125 Ca 0.35 -0.28 -0.10 0.00 0.06 0.00 0.00 58.65 58.69 3h75 h GLN 125 Cb -0.05 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 3h75 h GLN 125 CO -0.10 0.96 -0.23 0.82 -0.67 0.00 0.00 178.83 179.60 3h75 h ILE 126 N 0.95 1.27 -0.49 2.54 2.04 -0.77 -1.14 117.51 121.91 3h75 h ILE 126 Ca 0.19 -1.27 -0.03 0.00 1.00 0.00 0.00 64.86 64.75 3h75 h ILE 126 Cb 0.45 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 3h75 h ILE 126 CO 0.02 0.41 0.20 -0.07 0.00 0.00 0.00 178.15 178.71 3h75 h LEU 127 N 0.51 0.68 -0.76 1.44 3.38 -0.77 -0.81 115.31 118.98 3h75 h LEU 127 Ca 0.08 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 3h75 h LEU 127 Cb 0.67 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3h75 h LEU 127 CO 0.05 0.66 -0.33 0.03 0.09 0.00 0.00 178.44 178.94 3h75 h ARG 128 N 0.66 0.56 0.00 1.13 3.08 -1.15 -3.00 114.38 115.65 3h75 h ARG 128 Ca 0.16 -0.25 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 3h75 h ARG 128 Cb 0.19 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 3h75 h ARG 128 CO -0.01 0.82 -0.46 -0.07 -1.07 0.00 0.00 179.97 179.17 3h75 h LEU 129 N 0.48 0.00 -1.07 3.04 4.07 -0.96 -3.12 115.31 117.76 3h75 h LEU 129 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.02 3h75 h LEU 129 Cb 0.80 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.54 3h75 h LEU 129 CO 0.07 0.46 0.00 0.77 -1.08 0.00 0.00 178.44 178.66 3h75 h SER 130 N 0.00 0.00 -1.72 -0.43 4.64 -1.00 -3.45 113.55 111.59 3h75 h SER 130 Ca -0.00 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.63 3h75 h SER 130 Cb 1.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.11 3h75 h SER 130 CO 0.06 0.00 1.04 0.00 -0.87 0.00 0.00 176.83 177.06 3h75 n GLN 131 N -3.02 1.60 -0.93 4.77 6.02 -1.18 -0.70 117.38 123.93 3h75 n GLN 131 Ca 0.02 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.58 3h75 n GLN 131 Cb 0.35 -2.37 0.00 0.00 1.02 0.00 0.00 30.24 29.24 3h75 n GLN 131 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h75 n GLY 132 N 4.49 0.59 0.18 1.08 0.00 -1.26 -4.92 105.19 105.36 3h75 n GLY 132 Ca 0.26 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.39 3h75 n GLY 132 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h75 h SER 133 N 0.00 0.00 0.00 1.61 4.64 -1.22 -3.47 113.55 115.11 3h75 h SER 133 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h75 h SER 133 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3h75 h SER 133 CO 0.00 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 3h75 n GLY 134 N 1.14 1.39 3.77 -0.77 0.00 -1.26 -5.01 105.19 104.45 3h75 n GLY 134 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 3h75 n GLY 134 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h75 s ILE 135 N -3.55 5.04 0.08 -0.61 1.01 -1.26 -5.00 121.20 116.92 3h75 s ILE 135 Ca 0.00 1.02 -0.26 0.00 0.00 0.00 0.00 60.65 61.42 3h75 s ILE 135 Cb 0.00 -3.83 -0.06 0.00 0.01 0.00 0.00 42.46 38.58 3h75 s ILE 135 CO 0.00 0.43 0.79 -0.54 0.00 0.00 0.00 174.94 175.62 3h75 s LYS 136 N -0.13 4.54 0.02 2.79 1.02 -0.59 -4.77 119.74 122.61 3h75 s LYS 136 Ca 0.27 1.13 0.01 0.00 0.02 0.00 0.00 55.97 57.40 3h75 s LYS 136 Cb -0.17 -3.34 -0.04 0.00 -0.52 0.00 0.00 37.83 33.76 3h75 s LYS 136 CO 0.13 0.34 0.06 -0.51 -0.92 0.00 0.00 175.35 174.46 3h75 s LEU 137 N -0.30 3.78 -0.11 3.17 1.43 -0.71 -0.77 118.68 125.16 3h75 s LEU 137 Ca 0.39 0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.54 3h75 s LEU 137 Cb -0.21 -2.27 0.04 0.00 0.03 0.00 0.00 46.19 43.78 3h75 s LEU 137 CO 0.24 0.25 0.02 0.12 0.23 0.00 0.00 176.35 177.21 3h75 s PHE 138 N -1.22 0.73 -0.21 0.29 5.36 -0.41 -1.66 117.98 120.86 3h75 s PHE 138 Ca 0.24 -0.36 -0.13 0.00 -0.96 0.00 0.00 56.93 55.72 3h75 s PHE 138 Cb -0.12 -0.85 -0.05 0.00 -0.34 0.00 0.00 43.02 41.66 3h75 s PHE 138 CO 0.15 -0.41 0.27 0.42 -1.46 0.00 0.00 175.22 174.19 3h75 s ILE 139 N 1.95 5.29 0.35 3.12 -1.09 -0.26 -1.63 121.20 128.93 3h75 s ILE 139 Ca 0.03 0.44 0.07 0.00 -2.23 0.00 0.00 60.65 58.96 3h75 s ILE 139 Cb -0.14 -3.61 -0.07 0.00 -1.58 0.00 0.00 42.46 37.07 3h75 s ILE 139 CO -0.06 0.32 -0.03 0.68 -1.23 0.00 0.00 174.94 174.62 3h75 s VAL 140 N 1.01 1.86 0.00 2.92 -7.23 -0.14 -4.11 120.40 114.71 3h75 s VAL 140 Ca 0.13 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 3h75 s VAL 140 Cb -0.14 -2.73 0.00 0.00 0.56 0.00 0.00 36.38 34.07 3h75 s VAL 140 CO 0.05 -0.13 0.00 0.59 -0.31 0.00 0.00 175.10 175.30 3h75 n ASN 141 N -0.78 0.00 -3.99 4.85 4.13 -1.26 -2.33 115.26 115.87 3h75 n ASN 141 Ca -0.05 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.13 3h75 n ASN 141 Cb 0.65 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.78 3h75 n ASN 141 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 3h75 s SER 142 N 0.00 0.27 0.57 6.41 1.04 -1.26 -3.99 113.70 116.74 3h75 s SER 142 Ca 0.00 -0.56 -0.20 0.00 0.48 0.00 0.00 55.95 55.66 3h75 s SER 142 Cb 0.00 0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.19 3h75 s SER 142 CO 0.00 -0.34 1.21 -2.65 0.98 0.00 0.00 173.24 172.44 3h75 n PRO 143 N 1.40 1.32 -2.61 4.02 -0.02 -1.26 -4.67 135.00 133.18 3h75 n PRO 143 Ca -0.23 0.50 -0.39 0.00 -2.02 0.00 0.00 63.50 61.36 3h75 n PRO 143 Cb 0.56 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.58 3h75 n PRO 143 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3h75 s LEU 144 N -3.00 4.49 0.63 2.45 1.43 -1.26 -5.01 118.68 118.42 3h75 s LEU 144 Ca 0.75 2.08 -0.05 0.00 -1.03 0.00 0.00 54.13 55.87 3h75 s LEU 144 Cb -0.42 -3.76 0.03 0.00 0.03 0.00 0.00 46.19 42.08 3h75 s LEU 144 CO 0.47 -0.09 0.92 0.42 0.23 0.00 0.00 176.35 178.30 3h75 s THR 145 N -1.30 2.94 0.31 5.49 -4.23 -1.26 -4.91 115.64 112.67 3h75 s THR 145 Ca 0.46 -0.23 0.01 0.00 -1.18 0.00 0.00 61.69 60.76 3h75 s THR 145 Cb -0.27 -3.20 0.28 0.00 1.34 0.00 0.00 72.50 70.65 3h75 s THR 145 CO 0.34 -0.20 1.92 -0.07 -0.54 0.00 0.00 174.62 176.07 3h75 h LEU 146 N -0.30 0.88 -0.37 4.79 3.38 -1.96 -1.09 115.31 120.64 3h75 h LEU 146 Ca -0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 3h75 h LEU 146 Cb 1.29 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 3h75 h LEU 146 CO 0.59 0.57 0.19 0.44 0.09 0.00 0.00 178.44 180.33 3h75 h ASP 147 N 1.00 0.47 -0.10 -0.43 3.32 -2.03 -2.47 116.42 116.19 3h75 h ASP 147 Ca 0.38 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 57.26 3h75 h ASP 147 Cb 0.19 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3h75 h ASP 147 CO -0.14 0.44 -0.10 1.56 -1.72 0.00 0.00 179.24 179.29 3h75 h GLN 148 N 0.47 0.41 -5.81 3.56 4.20 -1.74 -3.54 115.11 112.66 3h75 h GLN 148 Ca 0.13 -0.10 -0.60 0.00 0.06 0.00 0.00 58.65 58.14 3h75 h GLN 148 Cb 0.09 -0.05 -0.10 0.00 0.30 0.00 0.00 27.48 27.72 3h75 h GLN 148 CO -0.02 0.52 0.44 1.03 -0.67 0.00 0.00 178.83 180.13 3h75 s ARG 149 N -4.78 4.02 0.24 1.46 1.81 -0.49 -4.99 118.95 116.22 3h75 s ARG 149 Ca -0.07 0.70 -0.30 0.00 -1.72 0.00 0.00 55.73 54.34 3h75 s ARG 149 Cb 0.15 -3.71 -0.10 0.00 -0.45 0.00 0.00 34.95 30.85 3h75 s ARG 149 CO 0.76 -0.66 1.37 -0.46 -0.68 0.00 0.00 175.30 175.64 3h75 s TRP 150 N 2.97 3.12 -0.04 -0.53 -0.00 -1.26 -4.96 118.94 118.24 3h75 s TRP 150 Ca 0.34 1.14 -0.01 0.00 -0.00 0.00 0.00 56.10 57.57 3h75 s TRP 150 Cb -0.14 -3.72 0.03 0.00 -0.00 0.00 0.00 33.47 29.64 3h75 s TRP 150 CO 0.12 -2.26 0.05 0.42 -0.00 0.00 0.00 176.95 175.27 3h75 s ILE 151 N -0.07 -0.06 0.46 5.86 1.01 -1.26 -1.74 121.20 125.41 3h75 s ILE 151 Ca 0.57 0.35 0.03 0.00 0.00 0.00 0.00 60.65 61.60 3h75 s ILE 151 Cb -0.39 -0.17 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 3h75 s ILE 151 CO 0.42 0.17 0.05 -0.83 0.00 0.00 0.00 174.94 174.75 3h75 s GLY 152 N 1.90 2.82 0.00 6.18 0.00 -0.66 -4.94 107.32 112.62 3h75 s GLY 152 Ca 0.02 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 43.89 3h75 s GLY 152 CO -0.03 -2.05 0.00 -1.14 0.00 0.00 0.00 173.10 169.88 3h75 n SER 153 N -1.25 0.00 0.00 1.64 3.41 0.31 -1.10 113.62 116.63 3h75 n SER 153 Ca -0.13 -0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.17 3h75 n SER 153 Cb 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 3h75 n SER 153 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3h75 n VAL 155 N 0.00 0.00 -1.32 -3.33 0.24 -0.49 -0.83 118.33 112.60 3h75 n VAL 155 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3h75 n VAL 155 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3h75 n VAL 155 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h75 n GLY 156 N -0.10 2.24 2.55 7.63 0.00 -1.26 -0.36 105.19 115.90 3h75 n GLY 156 Ca 0.00 -1.93 -0.25 0.00 0.00 0.00 0.00 46.02 43.84 3h75 n GLY 156 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h75 n ASP 157 N 0.00 3.15 -0.32 1.61 5.75 -1.17 -4.56 116.55 121.00 3h75 n ASP 157 Ca 0.00 -3.38 -0.01 0.00 -0.01 0.00 0.00 54.79 51.39 3h75 n ASP 157 Cb 0.00 -0.62 0.12 0.00 -1.03 0.00 0.00 41.12 39.59 3h75 n ASP 157 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3h75 h ASP 158 N 3.53 0.94 -0.53 -1.12 3.32 -1.92 -2.45 116.42 118.18 3h75 h ASP 158 Ca 0.14 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3h75 h ASP 158 Cb 0.67 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 3h75 h ASP 158 CO 0.73 0.64 0.34 -0.08 -1.72 0.00 0.00 179.24 179.16 3h75 h GLU 159 N 1.10 0.71 -0.95 3.56 4.81 -1.91 -1.65 114.58 120.24 3h75 h GLU 159 Ca 0.36 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.55 3h75 h GLU 159 Cb 0.02 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.20 3h75 h GLU 159 CO -0.12 0.48 0.63 1.49 -0.73 0.00 0.00 179.01 180.76 3h75 h GLU 160 N 0.72 1.24 -0.60 1.92 4.57 -1.79 -1.17 114.58 119.48 3h75 h GLU 160 Ca 0.19 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 3h75 h GLU 160 Cb -0.06 -0.28 -0.03 0.00 -0.16 0.00 0.00 28.75 28.22 3h75 h GLU 160 CO -0.04 0.82 0.35 0.00 -1.18 0.00 0.00 179.01 178.96 3h75 h ALA 161 N 1.35 0.76 -0.63 2.92 0.00 -0.94 0.23 119.26 122.96 3h75 h ALA 161 Ca 0.35 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 3h75 h ALA 161 Cb -0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 3h75 h ALA 161 CO -0.08 0.25 0.07 0.78 0.00 0.00 0.00 179.25 180.27 3h75 h GLY 162 N 0.81 1.16 0.69 0.00 0.00 -0.83 -3.14 103.07 101.76 3h75 h GLY 162 Ca 0.21 -0.80 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 3h75 h GLY 162 CO -0.04 0.74 -0.08 -1.82 0.00 0.00 0.00 176.54 175.34 3h75 h TYR 163 N 0.98 -0.20 0.00 5.60 3.20 -0.91 -3.25 116.97 122.39 3h75 h TYR 163 Ca 0.19 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.05 3h75 h TYR 163 Cb 0.48 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.82 3h75 h TYR 163 CO 0.04 0.11 0.00 0.54 -1.64 0.00 0.00 178.16 177.21 3h75 n ARG 164 N -5.05 0.03 0.00 1.82 5.12 0.79 -2.30 116.66 117.08 3h75 n ARG 164 Ca -0.09 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 3h75 n ARG 164 Cb 0.22 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.03 3h75 n ARG 164 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 3h75 n LEU 166 N 1.88 0.00 -0.31 0.55 7.94 -1.23 -0.47 117.00 125.36 3h75 n LEU 166 Ca 0.00 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.87 3h75 n LEU 166 Cb 0.02 0.00 0.09 0.00 0.53 0.00 0.00 43.42 44.06 3h75 n LEU 166 CO 0.00 0.00 1.22 0.11 -1.11 0.00 0.00 177.39 177.61 3h75 h LYS 167 N 0.00 1.06 -0.41 1.96 1.57 -1.78 -0.18 116.57 118.80 3h75 h LYS 167 Ca 0.00 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 3h75 h LYS 167 Cb 0.00 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 3h75 h LYS 167 CO 0.00 0.70 -0.02 0.93 -0.57 0.00 0.00 179.45 180.49 3h75 h GLU 168 N 1.10 0.74 -0.53 3.15 4.39 -1.05 -1.04 114.58 121.33 3h75 h GLU 168 Ca 0.32 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 3h75 h GLU 168 Cb -0.06 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 3h75 h GLU 168 CO -0.09 0.83 0.30 -0.07 -1.16 0.00 0.00 179.01 178.83 3h75 h LEU 169 N 0.57 0.65 -0.88 1.33 3.38 -1.69 -1.22 115.31 117.45 3h75 h LEU 169 Ca 0.11 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3h75 h LEU 169 Cb 0.51 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3h75 h LEU 169 CO 0.03 0.54 0.35 -0.07 0.09 0.00 0.00 178.44 179.38 3h75 h LEU 170 N 0.71 1.06 -0.40 1.67 3.38 -0.91 -0.88 115.31 119.96 3h75 h LEU 170 Ca 0.19 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3h75 h LEU 170 Cb 0.03 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3h75 h LEU 170 CO -0.03 0.92 0.16 -0.74 0.09 0.00 0.00 178.44 178.84 3h75 h HIS 171 N 1.14 0.60 -0.12 1.13 2.76 -0.69 -2.60 115.15 117.37 3h75 h HIS 171 Ca 0.27 -0.04 -0.12 0.00 -2.20 0.00 0.00 60.37 58.27 3h75 h HIS 171 Cb 0.16 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.93 3h75 h HIS 171 CO 0.02 0.53 -0.46 0.87 -1.30 0.00 0.00 177.93 177.59 3h75 h LYS 172 N 0.50 0.29 -0.56 5.26 1.57 -0.97 -2.94 116.57 119.72 3h75 h LYS 172 Ca 0.13 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 3h75 h LYS 172 Cb 0.18 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 3h75 h LYS 172 CO -0.01 0.70 0.10 1.25 -0.57 0.00 0.00 179.45 180.92 3h75 h LEU 173 N 0.24 0.84 0.00 2.94 5.85 -1.03 -3.49 115.31 120.66 3h75 h LEU 173 Ca 0.02 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.60 3h75 h LEU 173 Cb 0.91 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 3h75 h LEU 173 CO 0.07 0.84 -0.05 0.61 -0.34 0.00 0.00 178.44 179.58 3h75 n GLY 174 N -0.75 -1.78 3.45 3.75 0.00 -0.99 -4.93 105.19 103.93 3h75 n GLY 174 Ca 0.04 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 3h75 n GLY 174 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h75 n PRO 175 N -1.08 -0.47 0.00 1.61 -0.02 -1.26 -4.85 135.00 128.93 3h75 n PRO 175 Ca 0.00 -0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 3h75 n PRO 175 Cb 0.06 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3h75 n PRO 175 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 3h75 n VAL 176 N -3.80 0.00 0.00 -1.45 3.14 -1.26 -5.17 118.33 109.78 3h75 n VAL 176 Ca 0.07 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.45 3h75 n VAL 176 Cb 0.54 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.32 3h75 n VAL 176 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 3h75 n PRO 177 N 0.00 2.05 -1.45 1.45 -0.02 -1.26 -4.67 135.00 131.10 3h75 n PRO 177 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3h75 n PRO 177 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3h75 n PRO 177 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h75 n ALA 178 N -1.72 -2.07 0.00 3.55 0.00 -1.26 -4.41 120.51 114.59 3h75 n ALA 178 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h75 n ALA 178 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3h75 n ALA 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h75 n GLY 179 N -0.76 2.89 3.82 0.00 0.00 -1.26 -5.02 105.19 104.86 3h75 n GLY 179 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3h75 n GLY 179 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h75 s HIS 180 N -2.05 3.54 0.58 1.61 3.76 -1.26 -5.09 115.29 116.37 3h75 s HIS 180 Ca 0.00 0.50 -0.01 0.00 -0.15 0.00 0.00 55.06 55.40 3h75 s HIS 180 Cb 0.00 -2.06 0.04 0.00 1.11 0.00 0.00 32.58 31.67 3h75 s HIS 180 CO 0.00 0.56 0.83 0.20 -0.85 0.00 0.00 174.74 175.48 3h75 s GLY 181 N -0.49 1.76 -0.34 -2.22 0.00 -1.26 -4.66 107.32 100.11 3h75 s GLY 181 Ca 0.13 -1.18 0.01 0.00 0.00 0.00 0.00 44.72 43.69 3h75 s GLY 181 CO 0.03 -0.87 0.07 -0.42 0.00 0.00 0.00 173.10 171.90 3h75 s ILE 182 N -2.88 2.61 0.15 0.90 1.01 -0.15 -4.99 121.20 117.85 3h75 s ILE 182 Ca 0.57 -2.07 -0.30 0.00 0.00 0.00 0.00 60.65 58.85 3h75 s ILE 182 Cb -0.10 -2.79 -0.07 0.00 0.01 0.00 0.00 42.46 39.51 3h75 s ILE 182 CO 0.40 -0.50 1.03 -1.61 0.00 0.00 0.00 174.94 174.27 3h75 s GLU 183 N 1.03 4.65 0.03 2.79 2.02 -1.26 -0.58 118.70 127.38 3h75 s GLU 183 Ca 0.06 1.59 0.05 0.00 0.02 0.00 0.00 54.97 56.69 3h75 s GLU 183 Cb -0.20 -3.33 -0.02 0.00 0.10 0.00 0.00 34.13 30.68 3h75 s GLU 183 CO -0.06 0.15 -0.16 -1.17 0.02 0.00 0.00 175.26 174.04 3h75 s LEU 184 N -0.19 2.14 0.01 1.80 2.96 -0.35 -1.07 118.68 123.98 3h75 s LEU 184 Ca 0.48 -0.43 0.08 0.00 -0.22 0.00 0.00 54.13 54.04 3h75 s LEU 184 Cb -0.26 -0.75 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 3h75 s LEU 184 CO 0.32 0.10 -0.25 -0.76 -1.32 0.00 0.00 176.35 174.45 3h75 s LEU 185 N -0.97 2.19 -0.04 -0.68 1.43 -0.62 -0.92 118.68 119.07 3h75 s LEU 185 Ca 0.04 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 3h75 s LEU 185 Cb -0.08 -1.35 0.00 0.00 0.03 0.00 0.00 46.19 44.80 3h75 s LEU 185 CO 0.01 0.29 -0.14 0.00 0.23 0.00 0.00 176.35 176.74 3h75 s ALA 186 N -0.73 1.30 -0.26 4.21 0.00 -0.54 -1.35 121.76 124.39 3h75 s ALA 186 Ca 0.11 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.53 3h75 s ALA 186 Cb -0.10 -0.47 0.04 0.00 0.00 0.00 0.00 23.12 22.59 3h75 s ALA 186 CO 0.01 0.21 -0.08 -0.06 0.00 0.00 0.00 175.76 175.84 3h75 s PHE 187 N 0.19 3.15 0.51 0.00 0.08 0.18 -0.93 117.98 121.16 3h75 s PHE 187 Ca -0.06 -1.91 0.09 0.00 0.12 0.00 0.00 56.93 55.17 3h75 s PHE 187 Cb -0.12 -2.01 0.05 0.00 -0.57 0.00 0.00 43.02 40.38 3h75 s PHE 187 CO 0.02 -0.81 0.65 0.45 -0.10 0.00 0.00 175.22 175.43 3h75 s SER 188 N 1.23 5.20 0.00 1.36 0.15 0.41 -0.45 113.70 121.60 3h75 s SER 188 Ca -0.04 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 55.85 3h75 s SER 188 Cb -0.18 -0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 3h75 s SER 188 CO -0.05 -1.09 0.00 0.61 1.20 0.00 0.00 173.24 173.91 3h75 n GLY 189 N -2.02 1.07 3.64 9.45 0.00 -1.26 -0.41 105.19 115.66 3h75 n GLY 189 Ca 0.11 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 3h75 n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h75 s LEU 190 N 0.00 3.99 0.30 0.99 1.43 -1.26 -2.78 118.68 121.34 3h75 s LEU 190 Ca 0.00 1.32 0.06 0.00 -1.03 0.00 0.00 54.13 54.48 3h75 s LEU 190 Cb 0.00 -3.54 0.78 0.00 0.03 0.00 0.00 46.19 43.46 3h75 s LEU 190 CO 0.00 -0.93 1.72 0.50 0.23 0.00 0.00 176.35 177.87 3h75 h LYS 191 N 8.66 0.48 0.00 1.70 3.64 -1.95 -1.55 116.57 127.55 3h75 h LYS 191 Ca -0.25 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3h75 h LYS 191 Cb 1.09 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3h75 h LYS 191 CO 1.01 0.32 0.00 1.33 -2.27 0.00 0.00 179.45 179.84 3h75 n VAL 192 N -4.96 0.17 -3.39 2.00 0.24 -1.26 -4.56 118.33 106.56 3h75 n VAL 192 Ca 0.24 0.04 -0.35 0.00 -2.04 0.00 0.00 64.34 62.23 3h75 n VAL 192 Cb 0.68 -0.63 -0.06 0.00 -1.47 0.00 0.00 33.84 32.36 3h75 n VAL 192 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3h75 s THR 193 N -2.46 4.89 0.38 3.34 -4.23 -0.59 -4.65 115.64 112.34 3h75 s THR 193 Ca 0.26 0.75 0.07 0.00 -1.18 0.00 0.00 61.69 61.60 3h75 s THR 193 Cb 0.17 -3.72 0.20 0.00 1.34 0.00 0.00 72.50 70.49 3h75 s THR 193 CO 0.36 0.23 1.96 1.55 -0.54 0.00 0.00 174.62 178.18 3h75 h PRO 194 N 3.52 0.43 -0.64 3.99 0.13 -1.88 -0.88 132.00 136.67 3h75 h PRO 194 Ca -0.49 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 3h75 h PRO 194 Cb 1.19 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 3h75 h PRO 194 CO 0.66 0.41 0.42 0.00 -0.23 0.00 0.00 178.00 179.26 3h75 h ALA 195 N 1.64 0.81 -0.10 -0.56 0.00 -1.92 0.30 119.26 119.43 3h75 h ALA 195 Ca 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3h75 h ALA 195 Cb 0.19 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3h75 h ALA 195 CO -0.00 0.25 -0.07 0.00 0.00 0.00 0.00 179.25 179.43 3h75 h ALA 196 N 1.23 0.14 -0.33 0.00 0.00 -1.69 -2.07 119.26 116.54 3h75 h ALA 196 Ca 0.23 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3h75 h ALA 196 Cb -0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3h75 h ALA 196 CO -0.05 -0.05 0.18 1.96 0.00 0.00 0.00 179.25 181.29 3h75 h GLN 197 N -0.16 0.35 -0.47 0.00 4.20 -0.86 -0.54 115.11 117.64 3h75 h GLN 197 Ca 0.02 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3h75 h GLN 197 Cb 0.56 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 3h75 h GLN 197 CO 0.02 0.23 0.01 -0.07 -0.67 0.00 0.00 178.83 178.35 3h75 h LEU 198 N 0.36 0.80 -0.82 1.46 3.38 -0.45 -0.04 115.31 120.01 3h75 h LEU 198 Ca 0.14 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 3h75 h LEU 198 Cb 0.03 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3h75 h LEU 198 CO -0.08 0.91 -0.05 0.03 0.09 0.00 0.00 178.44 179.33 3h75 h ARG 199 N 0.67 0.83 -0.43 1.13 3.08 -1.22 -2.10 114.38 116.35 3h75 h ARG 199 Ca 0.13 -0.26 -0.10 0.00 0.07 0.00 0.00 59.98 59.83 3h75 h ARG 199 Cb 0.49 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3h75 h ARG 199 CO 0.02 0.87 -0.14 1.49 -1.07 0.00 0.00 179.97 181.14 3h75 h GLU 200 N 0.76 0.79 -0.84 0.04 4.81 -0.89 -1.54 114.58 117.72 3h75 h GLU 200 Ca 0.14 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.10 3h75 h GLU 200 Cb 0.54 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 3h75 h GLU 200 CO 0.03 0.89 0.55 -0.09 -0.73 0.00 0.00 179.01 179.66 3h75 h ARG 201 N 0.71 1.08 -0.57 1.92 9.65 -0.58 0.16 114.38 126.75 3h75 h ARG 201 Ca 0.11 -0.07 -0.03 0.00 -1.10 0.00 0.00 59.98 58.90 3h75 h ARG 201 Cb 0.64 -0.24 -0.03 0.00 -1.39 0.00 0.00 29.97 28.95 3h75 h ARG 201 CO 0.04 0.72 0.26 0.78 2.80 0.00 0.00 179.97 184.57 3h75 h GLY 202 N 1.12 0.90 0.92 2.80 0.00 -0.96 -1.19 103.07 106.65 3h75 h GLY 202 Ca 0.32 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 47.19 3h75 h GLY 202 CO -0.08 0.44 0.20 -2.00 0.00 0.00 0.00 176.54 175.10 3h75 h LEU 203 N 0.78 0.33 -1.25 3.11 5.85 -0.43 -1.96 115.31 121.73 3h75 h LEU 203 Ca 0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.92 3h75 h LEU 203 Cb 0.15 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 3h75 h LEU 203 CO -0.02 0.24 0.46 0.03 -0.34 0.00 0.00 178.44 178.81 3h75 h ARG 204 N 0.42 0.97 -0.57 1.25 2.47 -0.34 -0.04 114.38 118.53 3h75 h ARG 204 Ca 0.14 -0.07 -0.06 0.00 -1.26 0.00 0.00 59.98 58.73 3h75 h ARG 204 Cb 0.00 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.09 3h75 h ARG 204 CO -0.06 0.65 0.10 0.00 0.56 0.00 0.00 179.97 181.22 3h75 h ARG 205 N 0.99 0.93 -0.51 0.04 3.08 -0.76 -1.62 114.38 116.53 3h75 h ARG 205 Ca 0.26 -0.25 -0.10 0.00 0.07 0.00 0.00 59.98 59.96 3h75 h ARG 205 Cb -0.09 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 3h75 h ARG 205 CO -0.05 0.89 -0.10 0.00 -1.07 0.00 0.00 179.97 179.64 3h75 h ALA 206 N 1.00 0.86 -0.35 0.04 0.00 -0.67 -2.76 119.26 117.39 3h75 h ALA 206 Ca 0.17 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 3h75 h ALA 206 Cb 0.40 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3h75 h ALA 206 CO 0.01 0.65 -0.03 -0.07 0.00 0.00 0.00 179.25 179.81 3h75 h LEU 207 N 0.85 0.53 -1.51 0.00 3.38 -0.79 -2.15 115.31 115.61 3h75 h LEU 207 Ca 0.14 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3h75 h LEU 207 Cb 0.63 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3h75 h LEU 207 CO 0.04 0.62 -0.21 0.00 0.09 0.00 0.00 178.44 178.98 3h75 h ALA 208 N 1.45 1.20 0.00 1.53 0.00 -1.02 -2.45 119.26 119.98 3h75 h ALA 208 Ca 0.11 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3h75 h ALA 208 Cb 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3h75 h ALA 208 CO 0.02 0.26 -0.46 0.39 0.00 0.00 0.00 179.25 179.46 3h75 n GLU 209 N -3.64 0.07 -3.44 0.00 1.02 -0.85 -4.52 120.64 109.28 3h75 n GLU 209 Ca -0.01 0.02 -0.26 0.00 -0.02 0.00 0.00 57.16 56.89 3h75 n GLU 209 Cb 0.34 -1.55 -0.09 0.00 -0.02 0.00 0.00 31.44 30.12 3h75 n GLU 209 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3h75 n HIS 210 N -1.66 0.68 0.28 -0.32 8.25 -0.92 -4.96 115.22 116.57 3h75 n HIS 210 Ca 0.05 -3.69 0.17 0.00 -0.26 0.00 0.00 57.72 53.99 3h75 n HIS 210 Cb 0.36 -0.19 0.89 0.00 1.12 0.00 0.00 29.99 32.17 3h75 n HIS 210 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3h75 h PRO 211 N 4.94 0.00 0.00 -0.41 0.13 -1.79 -0.73 132.00 134.13 3h75 h PRO 211 Ca 0.18 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.28 3h75 h PRO 211 Cb 0.84 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 3h75 h PRO 211 CO 0.53 0.00 -0.15 0.37 -0.23 0.00 0.00 178.00 178.51 3h75 h GLN 212 N 0.00 0.00 -6.19 0.86 4.15 -1.93 -3.42 115.11 108.58 3h75 h GLN 212 Ca 0.00 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.86 3h75 h GLN 212 Cb 0.21 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.86 3h75 h GLN 212 CO 0.00 0.15 0.41 0.08 -1.93 0.00 0.00 178.83 177.55 3h75 s VAL 213 N -3.71 4.86 -0.35 2.39 1.01 -0.28 -0.98 120.40 123.34 3h75 s VAL 213 Ca 0.00 1.87 -0.02 0.00 0.00 0.00 0.00 61.98 63.83 3h75 s VAL 213 Cb 0.10 -4.24 0.08 0.00 0.00 0.00 0.00 36.38 32.32 3h75 s VAL 213 CO 0.61 0.08 0.10 -1.00 0.00 0.00 0.00 175.10 174.89 3h75 s HIS 214 N 1.64 3.45 -0.47 5.22 3.76 0.25 -4.91 115.29 124.24 3h75 s HIS 214 Ca 0.45 -2.18 -0.28 0.00 -0.15 0.00 0.00 55.06 52.91 3h75 s HIS 214 Cb -0.18 -2.69 -0.00 0.00 1.11 0.00 0.00 32.58 30.81 3h75 s HIS 214 CO 0.19 -0.89 1.61 -1.17 -0.85 0.00 0.00 174.74 173.64 3h75 s LEU 215 N 1.18 3.46 0.16 0.89 2.96 -1.26 -1.21 118.68 124.86 3h75 s LEU 215 Ca 0.02 0.73 0.01 0.00 -0.22 0.00 0.00 54.13 54.68 3h75 s LEU 215 Cb -0.21 -3.21 -0.02 0.00 0.50 0.00 0.00 46.19 43.26 3h75 s LEU 215 CO -0.03 -1.77 1.37 0.03 -1.32 0.00 0.00 176.35 174.63 3h75 h ARG 216 N 12.28 0.23 -1.59 1.98 2.47 -1.42 -3.47 114.38 124.86 3h75 h ARG 216 Ca -0.29 -0.25 0.06 0.00 -1.26 0.00 0.00 59.98 58.24 3h75 h ARG 216 Cb 1.13 0.07 -0.26 0.00 -1.65 0.00 0.00 29.97 29.26 3h75 h ARG 216 CO 1.12 0.97 0.47 -1.14 0.56 0.00 0.00 179.97 181.95 3h75 s GLN 217 N -3.23 0.50 -0.16 0.04 2.00 -1.25 -5.09 119.66 112.47 3h75 s GLN 217 Ca -0.03 0.58 0.02 0.00 -2.00 0.00 0.00 55.36 53.92 3h75 s GLN 217 Cb 0.10 0.24 0.02 0.00 0.80 0.00 0.00 33.01 34.17 3h75 s GLN 217 CO 0.83 -0.06 -0.20 -1.17 -0.50 0.00 0.00 175.29 174.19 3h75 s LEU 218 N 0.19 2.06 0.31 3.68 0.20 -1.26 -1.47 118.68 122.39 3h75 s LEU 218 Ca 0.03 -0.60 0.10 0.00 0.69 0.00 0.00 54.13 54.35 3h75 s LEU 218 Cb -0.05 -1.42 -0.06 0.00 -0.43 0.00 0.00 46.19 44.24 3h75 s LEU 218 CO -0.06 0.03 -0.11 0.68 -0.29 0.00 0.00 176.35 176.60 3h75 s VAL 219 N 1.08 2.50 -0.44 1.68 -7.23 -0.11 -4.98 120.40 112.89 3h75 s VAL 219 Ca -0.01 -2.22 -0.12 0.00 -1.81 0.00 0.00 61.98 57.82 3h75 s VAL 219 Cb -0.14 -2.56 0.08 0.00 0.56 0.00 0.00 36.38 34.32 3h75 s VAL 219 CO -0.07 -0.29 0.32 -0.31 -0.31 0.00 0.00 175.10 174.44 3h75 s TYR 220 N -2.53 3.30 -2.11 2.82 2.02 -1.26 -0.44 117.35 119.15 3h75 s TYR 220 Ca 0.32 -1.29 0.29 0.00 -0.37 0.00 0.00 57.07 56.03 3h75 s TYR 220 Cb -0.02 -3.06 1.34 0.00 -0.40 0.00 0.00 41.96 39.82 3h75 s TYR 220 CO 0.17 -0.83 1.91 0.41 -1.57 0.00 0.00 175.55 175.63 3h75 n GLY 221 N 5.04 -0.56 2.87 0.71 0.00 0.45 -4.93 105.19 108.76 3h75 n GLY 221 Ca -0.11 -0.33 -0.20 0.00 0.00 0.00 0.00 46.02 45.39 3h75 n GLY 221 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h75 n GLU 222 N -0.49 -3.32 -0.79 1.61 1.02 -1.12 -1.05 120.64 116.50 3h75 n GLU 222 Ca 0.19 0.73 0.00 0.00 -0.02 0.00 0.00 57.16 58.06 3h75 n GLU 222 Cb 0.26 -5.46 0.00 0.00 -0.02 0.00 0.00 31.44 26.22 3h75 n GLU 222 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 3h75 n TRP 223 N -4.00 0.00 -3.36 -0.32 5.03 -1.26 -4.62 117.44 108.91 3h75 n TRP 223 Ca -0.12 0.00 -0.38 0.00 3.03 0.00 0.00 57.50 60.03 3h75 n TRP 223 Cb 0.61 -1.03 -0.07 0.00 -1.03 0.00 0.00 31.31 29.78 3h75 n TRP 223 CO 0.00 0.00 0.00 1.21 -0.03 0.00 0.00 177.69 178.87 3h75 s ASN 224 N -2.26 6.49 0.05 -0.99 3.84 -0.22 -4.77 114.94 117.09 3h75 s ASN 224 Ca 0.00 0.58 -0.25 0.00 0.21 0.00 0.00 52.86 53.39 3h75 s ASN 224 Cb 0.00 -2.25 -0.17 0.00 -0.55 0.00 0.00 41.25 38.29 3h75 s ASN 224 CO 0.00 -0.08 1.56 -0.09 -2.79 0.00 0.00 177.10 175.70 3h75 h ARG 225 N 7.27 -0.21 -0.19 0.43 2.43 -1.85 -1.82 114.38 120.44 3h75 h ARG 225 Ca -0.36 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 58.75 3h75 h ARG 225 Cb 1.16 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 3h75 h ARG 225 CO 0.73 -0.03 -0.20 1.05 -1.51 0.00 0.00 179.97 180.01 3h75 h GLU 226 N -0.36 0.34 -0.18 0.20 4.11 -1.95 0.06 114.58 116.80 3h75 h GLU 226 Ca -0.02 -0.10 -0.03 0.00 0.07 0.00 0.00 59.36 59.27 3h75 h GLU 226 Cb 0.28 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3h75 h GLU 226 CO 0.04 0.53 -0.01 -0.09 0.07 0.00 0.00 179.01 179.55 3h75 h ARG 227 N 0.31 0.32 -0.62 1.06 2.43 -1.85 -0.71 114.38 115.32 3h75 h ARG 227 Ca 0.05 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 3h75 h ARG 227 Cb 0.53 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 3h75 h ARG 227 CO 0.04 0.54 0.25 0.00 -1.51 0.00 0.00 179.97 179.29 3h75 h ALA 228 N 0.76 1.28 -0.29 2.80 0.00 -1.13 -0.65 119.26 122.04 3h75 h ALA 228 Ca 0.05 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.82 3h75 h ALA 228 Cb 0.41 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3h75 h ALA 228 CO 0.01 0.54 0.15 -0.92 0.00 0.00 0.00 179.25 179.03 3h75 h TYR 229 N 0.89 0.28 -0.50 0.00 3.20 -0.68 0.22 116.97 120.39 3h75 h TYR 229 Ca 0.21 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 3h75 h TYR 229 Cb 0.16 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 3h75 h TYR 229 CO 0.01 0.16 0.11 0.00 -1.64 0.00 0.00 178.16 176.80 3h75 h ARG 230 N 0.32 0.81 -0.71 1.82 2.47 -0.59 -1.77 114.38 116.73 3h75 h ARG 230 Ca 0.12 -0.20 -0.07 0.00 -1.26 0.00 0.00 59.98 58.57 3h75 h ARG 230 Cb 0.02 -0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 28.21 3h75 h ARG 230 CO -0.07 0.79 0.18 1.96 0.56 0.00 0.00 179.97 183.39 3h75 h GLN 231 N 0.69 1.13 -0.46 0.04 4.20 -0.83 -2.94 115.11 116.93 3h75 h GLN 231 Ca 0.16 -0.27 -0.07 0.00 0.06 0.00 0.00 58.65 58.52 3h75 h GLN 231 Cb 0.35 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 3h75 h GLN 231 CO 0.00 0.99 -0.02 0.00 -0.67 0.00 0.00 178.83 179.14 3h75 h ALA 232 N 1.09 1.10 -0.88 3.87 0.00 -0.35 -0.58 119.26 123.50 3h75 h ALA 232 Ca 0.22 -0.27 0.09 0.00 0.00 0.00 0.00 54.91 54.96 3h75 h ALA 232 Cb 0.36 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 3h75 h ALA 232 CO 0.00 0.57 0.53 1.96 0.00 0.00 0.00 179.25 182.31 3h75 h GLN 233 N 0.72 0.87 0.03 0.00 4.20 -1.14 -0.01 115.11 119.78 3h75 h GLN 233 Ca 0.14 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 3h75 h GLN 233 Cb 0.47 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3h75 h GLN 233 CO 0.02 0.57 -0.02 1.96 -0.67 0.00 0.00 178.83 180.70 3h75 h GLN 234 N 0.89 -0.04 -0.71 1.46 4.20 -1.47 -3.29 115.11 116.16 3h75 h GLN 234 Ca 0.42 0.00 0.02 0.00 0.06 0.00 0.00 58.65 59.15 3h75 h GLN 234 Cb 0.34 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.09 3h75 h GLN 234 CO -0.23 0.64 0.46 -0.07 -0.67 0.00 0.00 178.83 178.95 3h75 h LEU 235 N -0.89 0.76 -1.52 1.46 3.38 -0.95 -1.07 115.31 116.48 3h75 h LEU 235 Ca -0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3h75 h LEU 235 Cb 0.70 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 3h75 h LEU 235 CO 0.01 0.54 -0.09 -0.07 0.09 0.00 0.00 178.44 178.92 3h75 h LEU 236 N 0.91 0.00 0.21 1.67 3.38 -1.16 0.12 115.31 120.43 3h75 h LEU 236 Ca 0.27 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.91 3h75 h LEU 236 Cb -0.04 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.74 3h75 h LEU 236 CO -0.09 0.09 -1.59 0.50 0.09 0.00 0.00 178.44 177.44 3h75 h LYS 237 N 0.00 0.45 -0.22 1.13 3.64 -1.50 -3.24 116.57 116.83 3h75 h LYS 237 Ca -0.00 -0.77 -0.13 0.00 -1.27 0.00 0.00 60.65 58.48 3h75 h LYS 237 Cb 0.53 0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 3h75 h LYS 237 CO 0.01 1.37 -0.42 -0.09 -2.27 0.00 0.00 179.45 178.05 3h75 h ARG 238 N 0.09 0.53 -2.37 1.90 9.65 -0.90 -3.35 114.38 119.93 3h75 h ARG 238 Ca -0.30 -0.27 -0.60 0.00 -1.10 0.00 0.00 59.98 57.71 3h75 h ARG 238 Cb 2.10 0.01 -0.42 0.00 -1.39 0.00 0.00 29.97 30.27 3h75 h ARG 238 CO 0.21 0.85 -0.63 0.66 2.80 0.00 0.00 179.97 183.87 3h75 n TYR 239 N -4.02 3.21 0.29 2.20 4.01 0.38 -4.93 117.16 118.30 3h75 n TYR 239 Ca -0.02 -4.13 0.17 0.00 -0.16 0.00 0.00 57.90 53.76 3h75 n TYR 239 Cb 0.52 -0.54 0.85 0.00 -0.31 0.00 0.00 39.34 39.86 3h75 n TYR 239 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3h75 h PRO 240 N 4.44 0.00 0.00 -0.72 0.13 -1.70 -2.03 132.00 132.13 3h75 h PRO 240 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3h75 h PRO 240 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 3h75 h PRO 240 CO 0.78 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.18 3h75 n LYS 241 N -2.79 0.21 -1.64 0.86 5.02 -1.26 -4.86 118.16 113.71 3h75 n LYS 241 Ca -0.01 0.02 -0.48 0.00 -2.02 0.00 0.00 58.31 55.81 3h75 n LYS 241 Cb 0.14 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.60 3h75 n LYS 241 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3h75 n THR 242 N -1.39 0.01 0.00 -0.18 -1.04 -0.76 -4.33 114.28 106.59 3h75 n THR 242 Ca 0.10 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 3h75 n THR 242 Cb 0.28 -1.27 0.00 0.00 -1.82 0.00 0.00 70.33 67.51 3h75 n THR 242 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h75 n GLN 243 N 3.15 1.73 -4.65 -2.82 6.02 -0.23 -4.90 117.38 115.69 3h75 n GLN 243 Ca 0.18 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.94 3h75 n GLN 243 Cb 0.25 -0.88 -0.15 0.00 1.02 0.00 0.00 30.24 30.48 3h75 n GLN 243 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3h75 s LEU 244 N -2.75 1.99 -0.21 1.08 1.43 -1.05 -1.19 118.68 117.98 3h75 s LEU 244 Ca 0.00 -0.26 -0.01 0.00 -1.03 0.00 0.00 54.13 52.83 3h75 s LEU 244 Cb 0.00 -0.74 0.06 0.00 0.03 0.00 0.00 46.19 45.54 3h75 s LEU 244 CO 0.00 0.16 -0.00 -0.69 0.23 0.00 0.00 176.35 176.05 3h75 s VAL 245 N -0.24 0.98 -0.16 -1.59 1.01 0.47 -1.58 120.40 119.28 3h75 s VAL 245 Ca 0.04 -0.86 -0.16 0.00 0.00 0.00 0.00 61.98 61.00 3h75 s VAL 245 Cb -0.06 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 3h75 s VAL 245 CO -0.00 -0.16 0.39 0.86 0.00 0.00 0.00 175.10 176.18 3h75 s TRP 246 N 1.65 3.45 -0.04 5.22 -0.00 -0.46 -1.75 118.94 127.02 3h75 s TRP 246 Ca -0.03 0.70 0.04 0.00 -0.00 0.00 0.00 56.10 56.80 3h75 s TRP 246 Cb -0.18 -2.47 -0.00 0.00 -0.00 0.00 0.00 33.47 30.82 3h75 s TRP 246 CO -0.07 0.14 -0.15 -1.12 -0.00 0.00 0.00 176.95 175.75 3h75 s SER 247 N 0.70 1.87 0.04 5.86 0.01 -1.11 -0.65 113.70 120.42 3h75 s SER 247 Ca 0.20 -0.30 0.17 0.00 1.31 0.00 0.00 55.95 57.33 3h75 s SER 247 Cb -0.14 -0.52 0.71 0.00 0.21 0.00 0.00 66.02 66.28 3h75 s SER 247 CO 0.07 0.12 1.53 0.00 0.41 0.00 0.00 173.24 175.38 3h75 n ALA 248 N 3.20 1.70 -3.29 1.44 0.00 0.40 -4.12 120.51 119.84 3h75 n ALA 248 Ca -0.18 -0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.14 3h75 n ALA 248 Cb 0.53 -1.27 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 3h75 n ALA 248 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h75 s ASN 249 N -3.22 -0.16 0.19 0.00 4.22 -1.26 -4.32 114.94 110.39 3h75 s ASN 249 Ca 0.07 -0.74 0.00 0.00 -2.14 0.00 0.00 52.86 50.05 3h75 s ASN 249 Cb 0.10 0.60 0.09 0.00 1.28 0.00 0.00 41.25 43.31 3h75 s ASN 249 CO 0.30 -1.13 1.45 -2.24 -2.04 0.00 0.00 177.10 173.45 3h75 h ASP 250 N 2.22 0.42 0.00 3.54 2.03 -0.60 -2.98 116.42 121.05 3h75 h ASP 250 Ca -0.26 -0.27 0.00 0.00 -0.73 0.00 0.00 57.03 55.77 3h75 h ASP 250 Cb 1.25 -0.12 0.00 0.00 -0.83 0.00 0.00 39.33 39.63 3h75 h ASP 250 CO 0.35 1.00 0.00 -0.62 -1.03 0.00 0.00 179.24 178.94 3h75 n GLU 251 N -3.83 0.00 0.00 4.15 -0.58 -1.26 -0.98 120.64 118.14 3h75 n GLU 251 Ca -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 3h75 n GLU 251 Cb 0.70 -0.91 0.00 0.00 -0.57 0.00 0.00 31.44 30.66 3h75 n GLU 251 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h75 n ALA 253 N 0.16 0.00 -0.08 0.62 0.00 -1.13 -1.84 120.51 118.24 3h75 n ALA 253 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 3h75 n ALA 253 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.75 3h75 n ALA 253 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3h75 h LEU 254 N 0.00 0.63 -0.19 0.00 3.38 -1.37 -2.61 115.31 115.15 3h75 h LEU 254 Ca 0.00 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 3h75 h LEU 254 Cb 0.00 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 3h75 h LEU 254 CO 0.00 0.54 -0.09 1.23 0.09 0.00 0.00 178.44 180.21 3h75 h GLY 255 N 0.82 0.43 -2.80 0.83 0.00 -1.58 -2.60 103.07 98.18 3h75 h GLY 255 Ca 0.17 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.11 3h75 h GLY 255 CO -0.02 0.36 0.00 0.00 0.00 0.00 0.00 176.54 176.87 3h75 n ALA 256 N -2.39 1.89 0.00 3.60 0.00 -0.99 -2.45 120.51 120.17 3h75 n ALA 256 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3h75 n ALA 256 Cb 0.32 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.42 3h75 n ALA 256 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3h75 n GLN 258 N 1.33 0.00 -0.34 0.00 7.27 -0.98 -1.13 117.38 123.54 3h75 n GLN 258 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 3h75 n GLN 258 Cb 0.12 0.00 0.15 0.00 2.41 0.00 0.00 30.24 32.92 3h75 n GLN 258 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3h75 h ALA 259 N 0.00 1.34 -0.29 1.69 0.00 -1.78 -1.97 119.26 118.25 3h75 h ALA 259 Ca 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3h75 h ALA 259 Cb 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3h75 h ALA 259 CO 0.00 0.60 0.14 0.00 0.00 0.00 0.00 179.25 179.98 3h75 h ALA 260 N 1.42 0.37 -0.96 0.00 0.00 -1.41 -2.78 119.26 115.91 3h75 h ALA 260 Ca 0.35 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.18 3h75 h ALA 260 Cb -0.11 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 3h75 h ALA 260 CO -0.09 -0.06 0.63 0.00 0.00 0.00 0.00 179.25 179.74 3h75 h ARG 261 N 0.33 1.26 0.00 0.00 3.08 -1.60 -1.26 114.38 116.19 3h75 h ARG 261 Ca 0.10 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 3h75 h ARG 261 Cb 0.13 -0.28 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 3h75 h ARG 261 CO -0.01 0.84 -0.05 0.93 -1.07 0.00 0.00 179.97 180.60 3h75 h GLU 262 N 1.30 0.00 -0.02 0.04 5.08 -1.12 -1.89 114.58 117.97 3h75 h GLU 262 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 3h75 h GLU 262 Cb -0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.10 3h75 h GLU 262 CO -0.08 0.05 -0.13 1.28 -1.00 0.00 0.00 179.01 179.13 3h75 n LEU 263 N -3.35 2.09 0.00 1.33 4.77 -0.68 -4.94 117.00 116.21 3h75 n LEU 263 Ca -0.02 -0.70 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 3h75 n LEU 263 Cb 0.19 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3h75 n LEU 263 CO 0.26 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 3h75 n GLY 264 N 1.31 0.49 3.82 -0.72 0.00 -0.71 -5.08 105.19 104.31 3h75 n GLY 264 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 3h75 n GLY 264 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h75 s ARG 265 N -0.90 2.73 -0.43 1.61 1.81 -0.56 -4.98 118.95 118.22 3h75 s ARG 265 Ca 0.00 0.87 0.03 0.00 -1.72 0.00 0.00 55.73 54.91 3h75 s ARG 265 Cb 0.00 -1.97 0.12 0.00 -0.45 0.00 0.00 34.95 32.65 3h75 s ARG 265 CO 0.00 -1.22 0.18 0.15 -0.68 0.00 0.00 175.30 173.73 3h75 s LYS 266 N -5.08 1.58 0.09 3.54 -0.14 -1.26 -4.10 119.74 114.37 3h75 s LYS 266 Ca 0.59 -2.15 -0.35 0.00 -1.36 0.00 0.00 55.97 52.69 3h75 s LYS 266 Cb -0.14 -2.97 -0.15 0.00 -1.68 0.00 0.00 37.83 32.89 3h75 s LYS 266 CO 0.55 -1.06 1.50 -2.30 -0.76 0.00 0.00 175.35 173.28 3h75 n PRO 267 N 3.67 1.68 0.00 -1.68 -0.02 -1.26 -0.98 135.00 136.41 3h75 n PRO 267 Ca 0.05 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3h75 n PRO 267 Cb 0.36 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3h75 n PRO 267 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h75 n GLY 268 N 3.14 2.62 0.75 -1.23 0.00 0.32 -4.45 105.19 106.35 3h75 n GLY 268 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.19 3h75 n GLY 268 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3h75 n THR 269 N -2.00 0.57 0.74 2.61 -1.04 -0.15 -4.87 114.28 110.14 3h75 n THR 269 Ca 0.00 0.22 0.08 0.00 -2.04 0.00 0.00 64.05 62.31 3h75 n THR 269 Cb 0.00 -1.42 -0.01 0.00 -1.82 0.00 0.00 70.33 67.07 3h75 n THR 269 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3h75 n ASP 270 N -3.05 1.55 -3.64 8.00 5.68 -0.85 -4.88 116.55 119.36 3h75 n ASP 270 Ca -0.02 -1.28 -0.16 0.00 -0.50 0.00 0.00 54.79 52.83 3h75 n ASP 270 Cb 0.06 0.54 -0.15 0.00 -1.14 0.00 0.00 41.12 40.43 3h75 n ASP 270 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 3h75 s LEU 271 N -2.16 -0.12 -0.15 -2.12 2.96 -1.20 -4.75 118.68 111.13 3h75 s LEU 271 Ca 0.13 0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 54.28 3h75 s LEU 271 Cb 0.13 0.37 -0.04 0.00 0.50 0.00 0.00 46.19 47.16 3h75 s LEU 271 CO 0.45 -0.26 0.06 -0.76 -1.32 0.00 0.00 176.35 174.52 3h75 s LEU 272 N 2.32 3.83 0.05 -0.68 1.43 -0.33 -0.52 118.68 124.78 3h75 s LEU 272 Ca 0.03 0.14 0.08 0.00 -1.03 0.00 0.00 54.13 53.35 3h75 s LEU 272 Cb -0.13 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 3h75 s LEU 272 CO -0.07 0.25 -0.19 -0.36 0.23 0.00 0.00 176.35 176.20 3h75 s PHE 273 N -0.09 2.52 0.19 0.29 0.08 -1.26 -0.40 117.98 119.31 3h75 s PHE 273 Ca 0.06 -0.28 0.09 0.00 0.12 0.00 0.00 56.93 56.93 3h75 s PHE 273 Cb -0.12 -1.44 -0.04 0.00 -0.57 0.00 0.00 43.02 40.84 3h75 s PHE 273 CO 0.01 0.24 -0.19 -1.54 -0.10 0.00 0.00 175.22 173.65 3h75 s SER 274 N -1.45 2.90 0.27 1.36 1.04 -0.72 -1.36 113.70 115.74 3h75 s SER 274 Ca 0.14 -0.91 -0.17 0.00 0.48 0.00 0.00 55.95 55.49 3h75 s SER 274 Cb -0.10 -0.19 0.01 0.00 0.10 0.00 0.00 66.02 65.84 3h75 s SER 274 CO 0.05 -0.02 0.62 -0.83 0.98 0.00 0.00 173.24 174.04 3h75 s GLY 275 N -2.87 0.19 -0.00 7.32 0.00 -0.13 -2.75 107.32 109.09 3h75 s GLY 275 Ca 0.19 -0.56 0.05 0.00 0.00 0.00 0.00 44.72 44.40 3h75 s GLY 275 CO 0.08 -0.33 -0.16 0.14 0.00 0.00 0.00 173.10 172.83 3h75 s VAL 276 N -3.94 1.28 0.00 1.40 1.01 -1.26 -0.87 120.40 118.02 3h75 s VAL 276 Ca 0.16 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3h75 s VAL 276 Cb -0.04 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.26 3h75 s VAL 276 CO 0.08 0.30 0.00 0.59 0.00 0.00 0.00 175.10 176.07 3h75 n ASN 277 N 2.52 0.00 -2.73 3.32 3.02 0.02 0.16 115.26 121.57 3h75 n ASN 277 Ca -0.15 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.37 3h75 n ASN 277 Cb 0.54 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 39.80 3h75 n ASN 277 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3h75 n SER 278 N 0.00 -0.18 -4.73 6.41 3.41 -1.26 -4.35 113.62 112.92 3h75 n SER 278 Ca 0.00 -2.26 -0.36 0.00 -0.26 0.00 0.00 58.87 56.00 3h75 n SER 278 Cb 0.00 0.21 0.07 0.00 -0.26 0.00 0.00 64.21 64.22 3h75 n SER 278 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3h75 s SER 279 N -2.26 4.63 0.23 4.04 1.04 -1.26 -4.73 113.70 115.38 3h75 s SER 279 Ca 0.19 2.49 -0.06 0.00 0.48 0.00 0.00 55.95 59.05 3h75 s SER 279 Cb 0.40 -2.60 0.40 0.00 0.10 0.00 0.00 66.02 64.32 3h75 s SER 279 CO -0.07 -1.98 1.71 -0.65 0.98 0.00 0.00 173.24 173.23 3h75 h PRO 280 N 0.38 0.34 -0.61 4.02 0.11 -1.96 -0.44 132.00 133.84 3h75 h PRO 280 Ca -0.50 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 3h75 h PRO 280 Cb 1.32 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 3h75 h PRO 280 CO 0.53 0.23 0.12 1.49 -0.21 0.00 0.00 178.00 180.15 3h75 h GLU 281 N 0.35 0.98 -0.48 1.05 4.81 -1.99 -1.57 114.58 117.73 3h75 h GLU 281 Ca 0.38 -0.23 -0.12 0.00 -0.13 0.00 0.00 59.36 59.25 3h75 h GLU 281 Cb 0.59 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 3h75 h GLU 281 CO -0.42 0.89 -0.18 0.00 -0.73 0.00 0.00 179.01 178.57 3h75 h ALA 282 N 1.19 0.67 -0.60 2.92 0.00 -1.63 -1.07 119.26 120.75 3h75 h ALA 282 Ca 0.19 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3h75 h ALA 282 Cb 0.38 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3h75 h ALA 282 CO 0.01 0.63 0.25 -0.07 0.00 0.00 0.00 179.25 180.06 3h75 h LEU 283 N 0.82 0.82 -0.72 0.00 3.38 -0.90 -0.69 115.31 118.01 3h75 h LEU 283 Ca 0.11 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 3h75 h LEU 283 Cb 0.75 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 3h75 h LEU 283 CO 0.06 0.76 0.17 -0.61 0.09 0.00 0.00 178.44 178.91 3h75 h GLN 284 N 0.83 1.15 -0.40 1.13 5.75 -1.15 -1.40 115.11 121.01 3h75 h GLN 284 Ca 0.20 -0.28 -0.06 0.00 -0.15 0.00 0.00 58.65 58.36 3h75 h GLN 284 Cb 0.19 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 3h75 h GLN 284 CO -0.02 1.01 -0.01 0.00 -2.65 0.00 0.00 178.83 177.15 3h75 h ALA 285 N 1.09 1.22 -0.29 3.38 0.00 -0.75 0.56 119.26 124.48 3h75 h ALA 285 Ca 0.22 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3h75 h ALA 285 Cb 0.38 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3h75 h ALA 285 CO 0.00 0.51 -0.04 1.25 0.00 0.00 0.00 179.25 180.97 3h75 h LEU 286 N 0.62 0.54 -0.96 0.00 5.85 -0.76 -0.50 115.31 120.10 3h75 h LEU 286 Ca 0.12 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 3h75 h LEU 286 Cb 0.41 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 3h75 h LEU 286 CO 0.02 0.76 0.55 0.40 -0.34 0.00 0.00 178.44 179.82 3h75 h ILE 287 N 0.31 1.26 0.00 4.05 2.04 -0.84 -1.77 117.51 122.56 3h75 h ILE 287 Ca 0.08 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.36 3h75 h ILE 287 Cb 0.51 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 3h75 h ILE 287 CO 0.02 0.27 0.00 0.47 0.00 0.00 0.00 178.15 178.92 3h75 n ASP 288 N -4.35 0.00 0.00 1.72 8.00 0.15 -4.90 116.55 117.17 3h75 n ASP 288 Ca 0.10 0.49 0.00 0.00 0.71 0.00 0.00 54.79 56.09 3h75 n ASP 288 Cb 0.07 -0.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 3h75 n ASP 288 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h75 n GLY 289 N 0.96 0.81 0.14 0.44 0.00 -0.56 -4.90 105.19 102.07 3h75 n GLY 289 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 3h75 n GLY 289 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h75 h LYS 290 N 2.57 0.33 -5.16 1.61 1.79 -1.35 -3.38 116.57 112.97 3h75 h LYS 290 Ca 0.00 -0.39 -0.62 0.00 -2.18 0.00 0.00 60.65 57.46 3h75 h LYS 290 Cb 0.00 0.12 -0.16 0.00 -1.58 0.00 0.00 32.23 30.61 3h75 h LYS 290 CO 0.00 1.10 -0.55 -1.17 -1.08 0.00 0.00 179.45 177.75 3h75 s LEU 291 N -7.53 3.89 0.01 2.94 2.96 -0.78 -2.82 118.68 117.35 3h75 s LEU 291 Ca -0.05 0.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.93 3h75 s LEU 291 Cb 0.09 -2.02 -0.26 0.00 0.50 0.00 0.00 46.19 44.50 3h75 s LEU 291 CO 0.86 0.10 0.86 0.28 -1.32 0.00 0.00 176.35 177.13 3h75 h SER 292 N 7.23 0.27 -3.61 3.68 0.02 -1.45 -3.37 113.55 116.31 3h75 h SER 292 Ca -0.38 -0.39 -0.30 0.00 -0.84 0.00 0.00 61.79 59.88 3h75 h SER 292 Cb 1.17 -0.09 -0.32 0.00 0.14 0.00 0.00 62.40 63.30 3h75 h SER 292 CO 0.67 1.33 -0.74 -0.69 -1.14 0.00 0.00 176.83 176.26 3h75 s VAL 293 N -2.62 0.10 -0.21 2.27 1.01 -0.99 -5.01 120.40 114.95 3h75 s VAL 293 Ca -0.07 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.92 3h75 s VAL 293 Cb 0.07 -0.17 0.07 0.00 0.00 0.00 0.00 36.38 36.36 3h75 s VAL 293 CO 0.84 0.09 0.09 -0.22 0.00 0.00 0.00 175.10 175.90 3h75 s LEU 294 N 0.63 0.66 -0.14 3.92 2.96 -1.26 -0.95 118.68 124.50 3h75 s LEU 294 Ca -0.06 -0.86 -0.25 0.00 -0.22 0.00 0.00 54.13 52.74 3h75 s LEU 294 Cb -0.09 -0.37 -0.02 0.00 0.50 0.00 0.00 46.19 46.21 3h75 s LEU 294 CO -0.01 -0.37 0.78 -1.61 -1.32 0.00 0.00 176.35 173.82 3h75 s GLU 295 N 2.05 4.33 0.12 1.98 0.41 -0.05 -1.43 118.70 126.10 3h75 s GLU 295 Ca 0.03 0.96 -0.04 0.00 -0.41 0.00 0.00 54.97 55.51 3h75 s GLU 295 Cb -0.16 -3.54 -0.03 0.00 -1.78 0.00 0.00 34.13 28.62 3h75 s GLU 295 CO -0.16 -0.21 0.12 0.00 -0.49 0.00 0.00 175.26 174.52 3h75 s ALA 296 N 1.75 0.41 0.00 5.21 0.00 -0.38 -0.80 121.76 127.95 3h75 s ALA 296 Ca 0.38 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.19 3h75 s ALA 296 Cb -0.17 0.70 0.00 0.00 0.00 0.00 0.00 23.12 23.65 3h75 s ALA 296 CO 0.14 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.80 3h75 n GLY 297 N -0.08 1.21 0.02 0.00 0.00 -1.26 -1.41 105.19 103.66 3h75 n GLY 297 Ca -0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.01 3h75 n GLY 297 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3h75 n HIS 298 N 0.00 0.14 0.42 1.61 1.44 -1.26 -2.45 115.22 115.12 3h75 n HIS 298 Ca 0.00 0.05 0.09 0.00 -2.01 0.00 0.00 57.72 55.85 3h75 n HIS 298 Cb 0.00 -0.59 0.37 0.00 0.12 0.00 0.00 29.99 29.89 3h75 n HIS 298 CO 0.00 0.00 0.00 1.97 -2.81 0.00 0.00 176.34 175.50 3h75 n PHE 299 N -1.63 0.33 0.88 -1.40 1.16 -1.26 -2.00 117.46 113.54 3h75 n PHE 299 Ca 0.03 0.13 0.12 0.00 -1.87 0.00 0.00 57.45 55.87 3h75 n PHE 299 Cb 0.19 -0.71 0.30 0.00 -1.61 0.00 0.00 39.48 37.64 3h75 n PHE 299 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 3h75 n THR 300 N -1.80 0.11 -0.30 1.97 -2.24 -1.03 -4.29 114.28 106.69 3h75 n THR 300 Ca 0.03 -0.08 0.07 0.00 -2.27 0.00 0.00 64.05 61.80 3h75 n THR 300 Cb 0.18 0.00 0.23 0.00 -2.10 0.00 0.00 70.33 68.64 3h75 n THR 300 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3h75 h LEU 301 N 0.00 0.54 -1.10 3.22 6.46 -1.61 -1.50 115.31 121.33 3h75 h LEU 301 Ca 0.00 0.09 0.03 0.00 -0.12 0.00 0.00 57.88 57.89 3h75 h LEU 301 Cb 0.57 0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.45 3h75 h LEU 301 CO 0.00 0.22 0.61 1.23 -0.62 0.00 0.00 178.44 179.88 3h75 h GLY 302 N 0.63 1.34 0.94 3.75 0.00 -1.82 -0.23 103.07 107.67 3h75 h GLY 302 Ca 0.47 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 3h75 h GLY 302 CO -0.36 0.40 0.06 -1.33 0.00 0.00 0.00 176.54 175.31 3h75 h GLY 303 N 1.17 0.72 1.35 4.60 0.00 -1.55 -1.95 103.07 107.42 3h75 h GLY 303 Ca 0.37 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 47.16 3h75 h GLY 303 CO -0.11 0.45 0.09 1.49 0.00 0.00 0.00 176.54 178.46 3h75 h TRP 304 N 0.52 0.84 -0.99 5.60 -0.00 -1.19 -2.21 115.95 118.51 3h75 h TRP 304 Ca 0.12 -0.09 0.00 0.00 -0.00 0.00 0.00 58.89 58.93 3h75 h TRP 304 Cb 0.37 -0.24 -0.05 0.00 -0.00 0.00 0.00 29.16 29.24 3h75 h TRP 304 CO 0.03 0.72 0.64 0.00 -0.00 0.00 0.00 178.44 179.83 3h75 h ALA 305 N 1.33 1.26 -0.06 1.49 0.00 -0.69 -1.60 119.26 120.98 3h75 h ALA 305 Ca 0.17 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3h75 h ALA 305 Cb 0.33 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3h75 h ALA 305 CO 0.00 0.67 -0.41 -0.07 0.00 0.00 0.00 179.25 179.45 3h75 h LEU 306 N 1.35 0.14 -0.37 0.00 3.38 -0.77 0.14 115.31 119.19 3h75 h LEU 306 Ca 0.36 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 3h75 h LEU 306 Cb -0.13 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3h75 h LEU 306 CO -0.07 0.54 0.06 0.58 0.09 0.00 0.00 178.44 179.64 3h75 h VAL 307 N 0.12 1.24 -0.56 1.22 2.07 -0.92 0.17 116.25 119.59 3h75 h VAL 307 Ca 0.01 -0.85 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 3h75 h VAL 307 Cb 0.77 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 3h75 h VAL 307 CO 0.06 0.29 0.23 0.00 0.02 0.00 0.00 177.57 178.16 3h75 h ALA 308 N 0.91 0.73 -0.35 1.67 0.00 -0.87 -1.53 119.26 119.81 3h75 h ALA 308 Ca 0.11 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 3h75 h ALA 308 Cb 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3h75 h ALA 308 CO 0.01 0.34 -0.33 -0.07 0.00 0.00 0.00 179.25 179.20 3h75 h LEU 309 N 0.77 0.80 -0.58 0.00 3.38 -0.82 0.16 115.31 119.02 3h75 h LEU 309 Ca 0.19 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.87 3h75 h LEU 309 Cb 0.20 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3h75 h LEU 309 CO -0.02 1.06 0.32 -0.74 0.09 0.00 0.00 178.44 179.15 3h75 h HIS 310 N 0.65 0.58 -0.19 1.13 2.76 -0.42 -1.31 115.15 118.34 3h75 h HIS 310 Ca 0.07 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.11 3h75 h HIS 310 Cb 0.86 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.64 3h75 h HIS 310 CO 0.05 0.29 -0.51 -0.44 -1.30 0.00 0.00 177.93 176.02 3h75 h ASP 311 N 0.61 0.59 -0.84 3.26 3.32 -0.99 -2.98 116.42 119.38 3h75 h ASP 311 Ca 0.25 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 3h75 h ASP 311 Cb 0.13 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 3h75 h ASP 311 CO -0.15 1.00 0.51 -0.78 -1.72 0.00 0.00 179.24 178.10 3h75 h ASP 312 N 0.42 1.01 0.27 6.45 3.58 -0.35 -0.15 116.42 127.66 3h75 h ASP 312 Ca 0.02 -0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.38 3h75 h ASP 312 Cb 1.04 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.83 3h75 h ASP 312 CO 0.10 0.77 -0.13 0.00 -2.88 0.00 0.00 179.24 177.10 3h75 h ALA 313 N 1.28 1.44 -0.01 -0.78 0.00 -1.15 -0.87 119.26 119.17 3h75 h ALA 313 Ca 0.30 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3h75 h ALA 313 Cb -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3h75 h ALA 313 CO -0.06 0.17 -0.08 1.28 0.00 0.00 0.00 179.25 180.56 3h75 n LEU 314 N -3.89 0.93 0.00 0.00 4.77 -0.50 -4.90 117.00 113.41 3h75 n LEU 314 Ca -0.02 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 3h75 n LEU 314 Cb 0.23 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3h75 n LEU 314 CO 0.32 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3h75 n GLY 315 N 1.20 0.79 2.77 -0.72 0.00 -0.33 -4.96 105.19 103.94 3h75 n GLY 315 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3h75 n GLY 315 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h75 n LEU 316 N 0.00 6.97 0.00 0.99 4.77 -0.19 -4.84 117.00 124.70 3h75 n LEU 316 Ca 0.00 -4.58 0.00 0.00 -0.03 0.00 0.00 56.01 51.40 3h75 n LEU 316 Cb 0.00 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 39.59 3h75 n LEU 316 CO 0.00 1.45 0.00 -0.90 -1.33 0.00 0.00 177.39 176.61 3h75 n ASP 317 N 3.95 0.00 0.00 -1.43 5.75 -1.26 -4.23 116.55 119.33 3h75 n ASP 317 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.24 3h75 n ASP 317 Cb 0.35 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 3h75 n ASP 317 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3h75 n ALA 318 N -3.00 0.00 -1.00 2.12 0.00 -1.26 -4.73 120.51 112.64 3h75 n ALA 318 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h75 n ALA 318 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3h75 n ALA 318 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h75 n ARG 319 N 0.00 3.10 0.00 0.00 3.00 -1.26 -3.60 116.66 117.90 3h75 n ARG 319 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 3h75 n ARG 319 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 3h75 n ARG 319 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 3h75 n ARG 320 N 0.00 0.00 0.00 5.56 0.00 -1.26 -3.56 116.66 117.40 3h75 n ARG 320 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.85 57.94 3h75 n ARG 320 Cb 0.00 0.00 0.46 0.00 -0.00 0.00 0.00 32.46 32.92 3h75 n ARG 320 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3h75 n LEU 321 N 0.00 0.00 0.00 2.89 4.77 -1.26 -4.88 117.00 118.52 3h75 n LEU 321 Ca 0.00 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 3h75 n LEU 321 Cb 0.00 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 3h75 n LEU 321 CO 0.00 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.56 3h75 n GLY 322 N 0.23 0.33 3.95 -0.72 0.00 -1.23 -4.63 105.19 103.11 3h75 n GLY 322 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 3h75 n GLY 322 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h75 s GLY 323 N -1.49 1.80 0.00 -0.02 0.00 -1.24 -3.90 107.32 102.48 3h75 s GLY 323 Ca 0.00 -1.46 0.28 0.00 0.00 0.00 0.00 44.72 43.54 3h75 s GLY 323 CO 0.00 -0.68 1.79 -1.55 0.00 0.00 0.00 173.10 172.66 3h75 n PRO 324 N -3.62 0.86 -3.81 2.90 -0.04 -1.26 -4.54 135.00 125.49 3h75 n PRO 324 Ca 0.17 -0.38 -0.34 0.00 -0.04 0.00 0.00 63.50 62.92 3h75 n PRO 324 Cb 0.59 -1.49 -0.11 0.00 -0.04 0.00 0.00 33.50 32.45 3h75 n PRO 324 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3h75 s ASP 325 N -2.39 4.88 0.21 3.54 1.01 -1.26 -0.53 116.67 122.12 3h75 s ASP 325 Ca 0.30 -2.98 -0.30 0.00 0.71 0.00 0.00 52.55 50.28 3h75 s ASP 325 Cb 0.20 -1.77 -0.08 0.00 1.01 0.00 0.00 42.92 42.28 3h75 s ASP 325 CO 0.46 -0.30 1.11 0.26 0.21 0.00 0.00 175.17 176.91 3h75 s TRP 326 N -0.24 3.58 -0.23 4.23 0.51 -0.01 -4.95 118.94 121.83 3h75 s TRP 326 Ca 0.18 1.62 0.02 0.00 -2.12 0.00 0.00 56.10 55.80 3h75 s TRP 326 Cb -0.22 -3.29 0.05 0.00 -0.81 0.00 0.00 33.47 29.21 3h75 s TRP 326 CO -0.02 -0.62 -0.12 -0.65 -0.51 0.00 0.00 176.95 175.03 3h75 s GLN 327 N -0.69 2.26 0.17 4.98 -0.21 -1.26 -1.40 119.66 123.51 3h75 s GLN 327 Ca 0.48 -1.14 0.09 0.00 0.02 0.00 0.00 55.36 54.82 3h75 s GLN 327 Cb -0.30 -2.72 -0.04 0.00 1.00 0.00 0.00 33.01 30.94 3h75 s GLN 327 CO 0.37 -0.49 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.41 3h75 s LEU 328 N 1.21 2.84 -0.42 2.90 1.43 0.51 -4.98 118.68 122.16 3h75 s LEU 328 Ca -0.05 -0.63 -0.06 0.00 -1.03 0.00 0.00 54.13 52.37 3h75 s LEU 328 Cb -0.18 -1.56 0.11 0.00 0.03 0.00 0.00 46.19 44.59 3h75 s LEU 328 CO -0.07 0.12 0.24 -0.44 0.23 0.00 0.00 176.35 176.43 3h75 s SER 329 N -2.71 5.42 -0.10 2.29 0.01 -1.26 -3.03 113.70 114.33 3h75 s SER 329 Ca 0.23 -1.89 0.11 0.00 1.31 0.00 0.00 55.95 55.71 3h75 s SER 329 Cb -0.09 -1.90 -0.15 0.00 0.21 0.00 0.00 66.02 64.09 3h75 s SER 329 CO 0.14 -0.57 0.08 0.18 0.41 0.00 0.00 173.24 173.47 3h75 n LEU 330 N 4.73 0.00 -4.77 2.44 4.77 -1.26 -4.91 117.00 118.01 3h75 n LEU 330 Ca -0.05 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.52 3h75 n LEU 330 Cb 0.41 0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.71 3h75 n LEU 330 CO 0.36 0.23 0.92 -0.36 -1.33 0.00 0.00 177.39 177.21 3h75 s PHE 331 N -2.39 3.22 -0.05 -1.77 0.08 -1.26 -4.37 117.98 111.44 3h75 s PHE 331 Ca -0.06 1.51 -0.05 0.00 0.12 0.00 0.00 56.93 58.46 3h75 s PHE 331 Cb 0.04 -3.55 0.01 0.00 -0.57 0.00 0.00 43.02 38.96 3h75 s PHE 331 CO 0.48 -1.43 0.13 -0.65 -0.10 0.00 0.00 175.22 173.66 3h75 s GLN 332 N -1.69 0.15 -0.70 0.44 -0.21 -0.50 -4.93 119.66 112.22 3h75 s GLN 332 Ca 0.48 0.19 -0.26 0.00 0.02 0.00 0.00 55.36 55.78 3h75 s GLN 332 Cb -0.37 0.07 0.04 0.00 1.00 0.00 0.00 33.01 33.75 3h75 s GLN 332 CO 0.49 -0.02 1.21 0.00 -2.12 0.00 0.00 175.29 174.85 3h75 s ALA 333 N 0.09 2.85 0.37 6.09 0.00 -1.26 -1.25 121.76 128.64 3h75 s ALA 333 Ca -0.00 -1.35 -0.27 0.00 0.00 0.00 0.00 51.96 50.34 3h75 s ALA 333 Cb -0.01 -4.15 -0.12 0.00 0.00 0.00 0.00 23.12 18.84 3h75 s ALA 333 CO 0.00 -3.09 1.18 1.28 0.00 0.00 0.00 175.76 175.13 3h75 n LEU 334 N 8.95 3.18 -4.95 0.00 4.77 -0.52 -4.95 117.00 123.48 3h75 n LEU 334 Ca 0.03 1.15 -0.23 0.00 -0.03 0.00 0.00 56.01 56.92 3h75 n LEU 334 Cb 0.48 -1.43 -0.00 0.00 -2.33 0.00 0.00 43.42 40.14 3h75 n LEU 334 CO 0.70 -0.87 0.22 0.42 -1.33 0.00 0.00 177.39 176.52 3h75 s THR 335 N -1.15 4.67 0.33 -5.08 -4.23 -1.26 -4.72 115.64 104.20 3h75 s THR 335 Ca 0.59 -0.48 0.02 0.00 -1.18 0.00 0.00 61.69 60.64 3h75 s THR 335 Cb -0.57 -3.71 0.28 0.00 1.34 0.00 0.00 72.50 69.83 3h75 s THR 335 CO 0.60 -0.47 1.96 -0.65 -0.54 0.00 0.00 174.62 175.51 3h75 h PRO 336 N 0.62 0.89 -0.47 3.99 0.11 -1.95 -0.73 132.00 134.46 3h75 h PRO 336 Ca -0.48 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 3h75 h PRO 336 Cb 1.23 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 3h75 h PRO 336 CO 0.60 0.59 0.27 0.00 -0.21 0.00 0.00 178.00 179.25 3h75 h ALA 337 N 1.56 0.60 -0.56 -0.75 0.00 -1.99 -0.54 119.26 117.57 3h75 h ALA 337 Ca 0.31 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 3h75 h ALA 337 Cb 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3h75 h ALA 337 CO -0.09 0.10 -0.08 1.96 0.00 0.00 0.00 179.25 181.14 3h75 h GLN 338 N 0.62 1.03 -0.61 0.00 4.20 -1.80 -2.74 115.11 115.80 3h75 h GLN 338 Ca 0.17 -0.36 -0.03 0.00 0.06 0.00 0.00 58.65 58.48 3h75 h GLN 338 Cb 0.02 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 3h75 h GLN 338 CO -0.03 1.05 0.24 0.00 -0.67 0.00 0.00 178.83 179.42 3h75 h ALA 339 N 0.97 1.28 -0.58 3.87 0.00 -0.82 -1.90 119.26 122.09 3h75 h ALA 339 Ca 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3h75 h ALA 339 Cb 0.64 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3h75 h ALA 339 CO 0.04 0.53 0.30 -0.09 0.00 0.00 0.00 179.25 180.04 3h75 h ARG 340 N 0.87 0.82 -0.09 0.00 9.65 -0.87 0.46 114.38 125.22 3h75 h ARG 340 Ca 0.21 -0.11 -0.00 0.00 -1.10 0.00 0.00 59.98 58.98 3h75 h ARG 340 Cb 0.17 -0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 28.59 3h75 h ARG 340 CO -0.02 0.64 0.05 1.96 2.80 0.00 0.00 179.97 185.40 3h75 h GLN 341 N 0.78 0.13 -0.22 0.20 4.20 -1.16 -1.59 115.11 117.45 3h75 h GLN 341 Ca 0.20 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.83 3h75 h GLN 341 Cb 0.08 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 3h75 h GLN 341 CO -0.03 0.18 -0.15 -0.07 -0.67 0.00 0.00 178.83 178.09 3h75 h LEU 342 N 0.04 0.36 -0.14 1.46 3.38 -1.18 -2.40 115.31 116.84 3h75 h LEU 342 Ca 0.03 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3h75 h LEU 342 Cb 0.09 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 3h75 h LEU 342 CO -0.00 0.54 -0.03 0.25 0.09 0.00 0.00 178.44 179.28 3h75 h LEU 343 N 0.35 0.27 -0.61 1.67 5.85 -0.68 0.03 115.31 122.19 3h75 h LEU 343 Ca 0.07 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.43 3h75 h LEU 343 Cb 0.47 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 3h75 h LEU 343 CO 0.03 0.57 0.40 -0.09 -0.34 0.00 0.00 178.44 179.01 3h75 h ARG 344 N -0.03 0.80 0.11 1.25 2.43 -1.17 -3.20 114.38 114.58 3h75 h ARG 344 Ca 0.04 -0.05 -0.27 0.00 -0.81 0.00 0.00 59.98 58.88 3h75 h ARG 344 Cb 0.45 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.83 3h75 h ARG 344 CO 0.01 0.54 -1.20 -0.07 -1.51 0.00 0.00 179.97 177.74 3h75 h LEU 345 N 0.82 0.57 0.00 3.80 3.38 -1.42 -3.49 115.31 118.98 3h75 h LEU 345 Ca 0.22 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.63 3h75 h LEU 345 Cb -0.09 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.48 3h75 h LEU 345 CO -0.05 1.41 0.00 0.61 0.09 0.00 0.00 178.44 180.50 3h75 n GLY 346 N 1.38 2.41 0.09 0.83 0.00 -0.01 -1.62 105.19 108.28 3h75 n GLY 346 Ca -0.10 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.52 3h75 n GLY 346 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h75 n ASP 347 N -0.19 0.14 -0.52 1.61 8.00 -1.26 -2.05 116.55 122.28 3h75 n ASP 347 Ca 0.00 -1.62 0.12 0.00 0.71 0.00 0.00 54.79 54.00 3h75 n ASP 347 Cb 0.00 -0.07 0.12 0.00 -0.02 0.00 0.00 41.12 41.15 3h75 n ASP 347 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h75 n GLN 348 N -0.40 1.34 -0.08 -1.24 1.13 -0.64 -4.39 117.38 113.10 3h75 n GLN 348 Ca 0.00 -1.04 0.10 0.00 -1.94 0.00 0.00 57.00 54.12 3h75 n GLN 348 Cb 0.04 -1.48 0.47 0.00 0.11 0.00 0.00 30.24 29.37 3h75 n GLN 348 CO 0.00 0.00 0.00 -0.24 -1.44 0.00 0.00 177.06 175.38 3h75 h VAL 349 N 2.54 0.95 0.00 5.09 3.04 -1.49 -1.79 116.25 124.58 3h75 h VAL 349 Ca 0.00 -0.17 -0.02 0.00 -1.01 0.00 0.00 66.70 65.51 3h75 h VAL 349 Cb 0.73 0.42 -0.00 0.00 -2.01 0.00 0.00 31.29 30.43 3h75 h VAL 349 CO 0.00 0.09 -0.07 1.23 -1.01 0.00 0.00 177.57 177.80 3h75 h GLY 350 N 0.48 0.00 2.00 3.17 0.00 -1.85 -2.26 103.07 104.61 3h75 h GLY 350 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 3h75 h GLY 350 CO -0.07 0.00 0.00 -0.91 0.00 0.00 0.00 176.54 175.56 3h75 h THR 351 N 0.00 0.00 -0.32 4.70 1.35 -1.64 -1.99 112.91 115.02 3h75 h THR 351 Ca -0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 3h75 h THR 351 Cb 0.18 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 3h75 h THR 351 CO 0.01 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.82 3h75 n ARG 352 N -2.86 2.07 -4.00 4.72 1.74 -0.85 -4.88 116.66 112.60 3h75 n ARG 352 Ca -0.01 -1.62 -0.35 0.00 -0.77 0.00 0.00 57.85 55.10 3h75 n ARG 352 Cb 0.17 -1.42 -0.09 0.00 -1.02 0.00 0.00 32.46 30.09 3h75 n ARG 352 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h75 s VAL 353 N -1.59 4.83 -1.13 1.55 1.01 -0.75 -4.93 120.40 119.39 3h75 s VAL 353 Ca 0.34 -0.02 -0.13 0.00 0.00 0.00 0.00 61.98 62.17 3h75 s VAL 353 Cb 0.19 -3.17 0.19 0.00 0.00 0.00 0.00 36.38 33.59 3h75 s VAL 353 CO 0.27 0.47 1.29 -0.62 0.00 0.00 0.00 175.10 176.51 3h75 s ASP 354 N 0.24 7.05 0.10 3.32 2.15 -1.26 -4.85 116.67 123.42 3h75 s ASP 354 Ca 0.04 -2.98 -0.21 0.00 0.43 0.00 0.00 52.55 49.84 3h75 s ASP 354 Cb -0.12 -2.35 -0.09 0.00 -0.30 0.00 0.00 42.92 40.05 3h75 s ASP 354 CO 0.00 -0.68 1.70 -0.26 -0.17 0.00 0.00 175.17 175.76 3h75 h PHE 355 N 7.31 0.22 -0.64 -5.34 0.04 -1.93 -2.23 116.94 114.37 3h75 h PHE 355 Ca 0.26 -0.01 0.13 0.00 2.80 0.00 0.00 57.97 61.15 3h75 h PHE 355 Cb 0.90 -0.07 -0.04 0.00 2.20 0.00 0.00 35.95 38.94 3h75 h PHE 355 CO 1.04 0.22 0.44 -0.09 -0.60 0.00 0.00 178.31 179.31 3h75 h ARG 356 N 0.16 0.33 0.00 1.51 2.43 -1.89 0.41 114.38 117.33 3h75 h ARG 356 Ca 0.06 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3h75 h ARG 356 Cb 0.07 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3h75 h ARG 356 CO -0.01 0.22 0.00 0.78 -1.51 0.00 0.00 179.97 179.45 3h75 h GLY 357 N 0.33 0.00 1.62 2.80 0.00 -1.81 -2.38 103.07 103.63 3h75 h GLY 357 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.64 3h75 h GLY 357 CO -0.08 0.00 -0.32 1.41 0.00 0.00 0.00 176.54 177.55 3h75 h LEU 358 N 0.00 0.00-10.01 3.11 3.38 0.01 -3.46 115.31 108.34 3h75 h LEU 358 Ca 0.00 -0.05 -0.55 0.00 0.09 0.00 0.00 57.88 57.37 3h75 h LEU 358 Cb 0.45 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.32 3h75 h LEU 358 CO 0.00 0.03 0.69 -0.24 0.09 0.00 0.00 178.44 179.01 3h75 n SER 359 N -2.53 3.24 0.00 -0.43 2.88 -0.90 -4.87 113.62 111.01 3h75 n SER 359 Ca 0.04 1.09 0.15 0.00 -1.33 0.00 0.00 58.87 58.81 3h75 n SER 359 Cb 0.48 -1.60 0.84 0.00 -0.75 0.00 0.00 64.21 63.18 3h75 n SER 359 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h75 n ALA 360 N -0.40 2.56 -1.74 -1.46 0.00 -1.26 -4.76 120.51 113.46 3h75 n ALA 360 Ca 0.06 -0.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.91 3h75 n ALA 360 Cb 0.42 -1.48 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 3h75 n ALA 360 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3h75 s GLN 361 N -2.18 4.14 -0.64 0.00 0.74 -1.26 -1.37 119.66 119.08 3h75 s GLN 361 Ca 0.40 2.56 0.00 0.00 0.05 0.00 0.00 55.36 58.37 3h75 s GLN 361 Cb 0.20 -3.69 0.00 0.00 1.10 0.00 0.00 33.01 30.62 3h75 s GLN 361 CO 0.38 -0.85 0.00 0.41 -0.55 0.00 0.00 175.29 174.68 3h75 n GLY 362 N 4.25 0.77 3.82 2.59 0.00 -1.26 -4.99 105.19 110.37 3h75 n GLY 362 Ca 0.18 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 3h75 n GLY 362 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h75 s LYS 363 N -2.09 4.08 1.08 1.61 3.01 -0.47 -5.08 119.74 121.88 3h75 s LYS 363 Ca 0.00 0.60 -0.14 0.00 -1.01 0.00 0.00 55.97 55.42 3h75 s LYS 363 Cb 0.00 -3.19 0.23 0.00 -1.01 0.00 0.00 37.83 33.86 3h75 s LYS 363 CO 0.00 0.63 1.08 -1.25 0.51 0.00 0.00 175.35 176.32 3h75 s PRO 364 N -1.23 -0.24 0.59 -1.68 0.04 -1.26 -4.98 135.00 126.24 3h75 s PRO 364 Ca 0.29 0.46 -0.08 0.00 0.04 0.00 0.00 61.00 61.71 3h75 s PRO 364 Cb -0.18 -1.66 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 3h75 s PRO 364 CO 0.17 -3.17 0.94 0.34 0.04 0.00 0.00 177.00 175.32 3h75 s ASP 365 N -3.32 5.87 0.00 6.66 3.68 -1.26 -3.66 116.67 124.65 3h75 s ASP 365 Ca 0.67 1.01 0.00 0.00 2.13 0.00 0.00 52.55 56.36 3h75 s ASP 365 Cb -0.19 -2.06 0.00 0.00 -1.45 0.00 0.00 42.92 39.22 3h75 s ASP 365 CO 0.59 -0.96 0.00 -1.54 0.13 0.00 0.00 175.17 173.39 3h75 n SER 366 N -2.63 -0.87 -4.67 -0.34 3.41 -1.26 -5.02 113.62 102.25 3h75 n SER 366 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.23 3h75 n SER 366 Cb 0.56 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.33 3h75 n SER 366 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3h75 s TYR 367 N -2.46 3.40 0.03 7.33 5.04 -1.24 -5.02 117.35 124.43 3h75 s TYR 367 Ca 0.00 1.33 0.08 0.00 -2.44 0.00 0.00 57.07 56.04 3h75 s TYR 367 Cb 0.00 -3.10 -0.03 0.00 0.35 0.00 0.00 41.96 39.19 3h75 s TYR 367 CO 0.00 -0.32 -0.23 1.03 -1.34 0.00 0.00 175.55 174.69 3h75 s ARG 368 N 2.48 1.61 0.15 4.97 0.52 -1.26 -4.73 118.95 122.69 3h75 s ARG 368 Ca 0.40 -0.98 -0.32 0.00 -0.52 0.00 0.00 55.73 54.32 3h75 s ARG 368 Cb -0.16 -1.72 -0.11 0.00 0.52 0.00 0.00 34.95 33.48 3h75 s ARG 368 CO 0.11 0.45 1.79 0.66 0.02 0.00 0.00 175.30 178.33 3h75 n TYR 369 N 1.94 2.66 -0.63 -0.53 4.01 -1.26 -4.86 117.16 118.48 3h75 n TYR 369 Ca -0.17 -0.07 -0.17 0.00 -0.16 0.00 0.00 57.90 57.34 3h75 n TYR 369 Cb 0.53 -2.71 0.07 0.00 -0.31 0.00 0.00 39.34 36.92 3h75 n TYR 369 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3h75 n PRO 370 N 4.99 1.82 -1.66 -0.72 -0.04 -1.26 -4.98 135.00 133.15 3h75 n PRO 370 Ca 0.17 -1.73 -0.50 0.00 -0.04 0.00 0.00 63.50 61.40 3h75 n PRO 370 Cb 0.36 -1.68 -0.05 0.00 -0.04 0.00 0.00 33.50 32.09 3h75 n PRO 370 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3h75 n PHE 371 N -0.08 2.04 0.00 0.54 3.72 -1.26 -4.80 117.46 117.62 3h75 n PHE 371 Ca 0.34 0.35 0.00 0.00 -0.05 0.00 0.00 57.45 58.09 3h75 n PHE 371 Cb 0.83 -2.50 0.00 0.00 -0.94 0.00 0.00 39.48 36.87 3h75 n PHE 371 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h75 n GLY 372 N 3.57 0.88 0.24 1.37 0.00 -1.26 -4.91 105.19 105.09 3h75 n GLY 372 Ca 0.21 -0.83 0.10 0.00 0.00 0.00 0.00 46.02 45.49 3h75 n GLY 372 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h75 h LEU 373 N 0.00 0.00 -2.11 0.99 5.85 -1.89 -2.59 115.31 115.56 3h75 h LEU 373 Ca 0.00 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.73 3h75 h LEU 373 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 3h75 h LEU 373 CO 0.00 0.17 0.02 -0.61 -0.34 0.00 0.00 178.44 177.67 3h75 h GLN 374 N 0.00 0.00 0.00 1.25 5.75 -1.94 0.27 115.11 120.44 3h75 h GLN 374 Ca -0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 3h75 h GLN 374 Cb 0.39 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.93 3h75 h GLN 374 CO 0.02 0.00 -0.03 -0.07 -2.65 0.00 0.00 178.83 176.10 3h75 h LEU 375 N 0.00 0.00 0.00 -2.39 3.38 -1.77 -2.01 115.31 112.51 3h75 h LEU 375 Ca 0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 3h75 h LEU 375 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3h75 h LEU 375 CO -0.00 0.03 -1.62 0.18 0.09 0.00 0.00 178.44 177.12 3h75 n LEU 376 N -3.23 0.44 -0.43 1.67 4.32 0.05 -4.40 117.00 115.42 3h75 n LEU 376 Ca -0.01 0.18 0.11 0.00 -0.02 0.00 0.00 56.01 56.26 3h75 n LEU 376 Cb 0.19 0.06 -0.02 0.00 -1.62 0.00 0.00 43.42 42.03 3h75 n LEU 376 CO 0.25 0.03 0.26 0.18 -1.22 0.00 0.00 177.39 176.89 3h75 n LEU 377 N -2.58 1.89 0.00 2.23 4.77 -0.91 -5.02 117.00 117.39 3h75 n LEU 377 Ca -0.07 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.17 3h75 n LEU 377 Cb 0.69 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 3h75 n LEU 377 CO 0.43 0.36 0.15 0.54 -1.33 0.00 0.00 177.39 177.54