#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wek s MET 33 N 0.00 1.54 0.09 3.17 0.00 0.15 -4.72 119.30 119.52 2wek s MET 33 Ca 0.00 -0.82 -0.03 0.00 0.00 0.00 0.00 55.69 54.84 2wek s MET 33 Cb 0.00 0.54 -0.05 0.00 0.00 0.00 0.00 34.83 35.32 2wek s MET 33 CO 0.00 -0.70 0.29 -0.65 0.00 0.00 0.00 175.02 173.96 2wek s GLN 34 N -3.69 3.54 0.01 3.16 -0.21 -1.26 -1.18 119.66 120.02 2wek s GLN 34 Ca 0.10 -0.24 -0.28 0.00 0.02 0.00 0.00 55.36 54.97 2wek s GLN 34 Cb -0.04 -2.96 0.08 0.00 1.00 0.00 0.00 33.01 31.09 2wek s GLN 34 CO 0.03 0.56 0.71 -1.59 -2.12 0.00 0.00 175.29 172.88 2wek s LYS 35 N -2.45 1.06 0.09 2.91 -2.85 -0.87 -2.00 119.74 115.63 2wek s LYS 35 Ca 0.36 -0.06 -0.24 0.00 -1.00 0.00 0.00 55.97 55.04 2wek s LYS 35 Cb -0.13 0.49 -0.07 0.00 -2.06 0.00 0.00 37.83 36.07 2wek s LYS 35 CO 0.25 -0.39 0.72 -0.51 0.10 0.00 0.00 175.35 175.51 2wek s LEU 36 N -1.84 4.52 -0.03 2.77 1.43 -0.62 -0.98 118.68 123.92 2wek s LEU 36 Ca -0.04 1.47 0.03 0.00 -1.03 0.00 0.00 54.13 54.55 2wek s LEU 36 Cb -0.00 -3.17 0.01 0.00 0.03 0.00 0.00 46.19 43.05 2wek s LEU 36 CO -0.01 0.14 -0.10 -0.69 0.23 0.00 0.00 176.35 175.92 2wek s VAL 37 N -0.65 0.88 -0.20 -1.59 1.01 0.67 -4.31 120.40 116.21 2wek s VAL 37 Ca 0.35 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.65 2wek s VAL 37 Cb -0.21 -0.79 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 2wek s VAL 37 CO 0.23 0.28 1.32 -0.69 0.00 0.00 0.00 175.10 176.24 2wek s VAL 38 N 0.30 4.16 -0.15 2.92 1.01 -0.52 0.55 120.40 128.66 2wek s VAL 38 Ca -0.05 1.37 0.03 0.00 0.00 0.00 0.00 61.98 63.32 2wek s VAL 38 Cb -0.10 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2wek s VAL 38 CO 0.01 -0.23 0.14 0.35 0.00 0.00 0.00 175.10 175.36 2wek n THR 39 N 5.68 0.00 -3.72 3.92 -2.24 0.50 -2.52 114.28 115.90 2wek n THR 39 Ca 0.15 -0.43 -0.12 0.00 -2.27 0.00 0.00 64.05 61.38 2wek n THR 39 Cb 0.45 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.57 2wek n THR 39 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2wek s ARG 40 N -1.26 0.35 -0.21 -0.78 3.00 -0.86 -4.88 118.95 114.31 2wek s ARG 40 Ca 0.01 0.62 -0.29 0.00 -1.00 0.00 0.00 55.73 55.07 2wek s ARG 40 Cb 0.02 0.03 -0.02 0.00 0.00 0.00 0.00 34.95 34.98 2wek s ARG 40 CO 0.12 -0.12 1.39 -0.51 0.00 0.00 0.00 175.30 176.18 2wek s LEU 41 N 0.95 4.03 -0.24 -0.88 1.43 -1.26 -4.22 118.68 118.49 2wek s LEU 41 Ca -0.06 1.58 -0.26 0.00 -1.03 0.00 0.00 54.13 54.35 2wek s LEU 41 Cb -0.07 -3.54 0.09 0.00 0.03 0.00 0.00 46.19 42.71 2wek s LEU 41 CO -0.07 -0.99 0.84 -0.55 0.23 0.00 0.00 176.35 175.81 2wek s SER 42 N 2.88 -0.61 0.00 2.29 0.15 -0.72 -4.88 113.70 112.81 2wek s SER 42 Ca 0.61 1.11 0.28 0.00 0.70 0.00 0.00 55.95 58.64 2wek s SER 42 Cb -0.22 1.09 1.62 0.00 -1.71 0.00 0.00 66.02 66.80 2wek s SER 42 CO 0.22 -0.26 2.00 -0.81 1.20 0.00 0.00 173.24 175.59 2wek n PRO 43 N 2.22 0.78 -3.15 5.44 -0.04 -1.26 -2.52 135.00 136.47 2wek n PRO 43 Ca -0.14 0.01 -0.44 0.00 -0.04 0.00 0.00 63.50 62.89 2wek n PRO 43 Cb 0.56 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.45 2wek n PRO 43 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2wek s ASN 44 N -2.11 6.23 0.20 3.54 3.84 -1.26 -4.80 114.94 120.58 2wek s ASN 44 Ca 0.39 -0.86 -0.10 0.00 0.21 0.00 0.00 52.86 52.50 2wek s ASN 44 Cb 0.19 -2.30 0.23 0.00 -0.55 0.00 0.00 41.25 38.83 2wek s ASN 44 CO 0.34 -0.89 1.78 0.15 -2.79 0.00 0.00 177.10 175.69 2wek h PHE 45 N 9.00 0.52 -0.60 0.43 3.57 -1.93 -1.22 116.94 126.71 2wek h PHE 45 Ca -0.27 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.28 2wek h PHE 45 Cb 1.09 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.65 2wek h PHE 45 CO 0.75 0.21 0.37 -0.09 -2.23 0.00 0.00 178.31 177.32 2wek h ARG 46 N 0.53 0.71 -0.01 1.11 9.65 -1.93 -1.29 114.38 123.15 2wek h ARG 46 Ca 0.28 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 59.04 2wek h ARG 46 Cb 0.25 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.66 2wek h ARG 46 CO -0.22 0.47 -0.40 0.93 2.80 0.00 0.00 179.97 183.55 2wek h GLU 47 N 0.73 0.02 0.11 0.20 5.08 -1.70 -3.30 114.58 115.72 2wek h GLU 47 Ca 0.24 -0.01 -0.31 0.00 -1.00 0.00 0.00 59.36 58.28 2wek h GLU 47 Cb 0.01 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2wek h GLU 47 CO -0.09 0.41 -1.58 0.00 -1.00 0.00 0.00 179.01 176.74 2wek h ALA 48 N 1.59 0.32 -3.52 3.43 0.00 -0.81 -3.42 119.26 116.84 2wek h ALA 48 Ca -0.00 -1.16 -0.67 0.00 0.00 0.00 0.00 54.91 53.08 2wek h ALA 48 Cb 0.71 0.33 -0.21 0.00 0.00 0.00 0.00 17.79 18.62 2wek h ALA 48 CO 0.05 1.18 -0.70 0.08 0.00 0.00 0.00 179.25 179.87 2wek s VAL 49 N -2.61 3.65 -0.06 0.00 1.01 -0.53 -0.37 120.40 121.49 2wek s VAL 49 Ca -0.10 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2wek s VAL 49 Cb 0.07 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 2wek s VAL 49 CO 0.84 0.56 -0.20 -0.89 0.00 0.00 0.00 175.10 175.41 2wek s THR 50 N -0.29 2.54 -0.50 3.92 2.01 0.19 -4.83 115.64 118.68 2wek s THR 50 Ca 0.04 -0.89 -0.25 0.00 0.31 0.00 0.00 61.69 60.90 2wek s THR 50 Cb -0.13 -1.97 0.03 0.00 0.01 0.00 0.00 72.50 70.44 2wek s THR 50 CO 0.02 0.57 0.94 -0.22 -0.69 0.00 0.00 174.62 175.24 2wek s LEU 51 N -0.29 4.03 0.08 4.42 2.96 -1.26 -0.24 118.68 128.38 2wek s LEU 51 Ca 0.01 -0.09 -0.24 0.00 -0.22 0.00 0.00 54.13 53.58 2wek s LEU 51 Cb -0.13 -3.03 -0.06 0.00 0.50 0.00 0.00 46.19 43.47 2wek s LEU 51 CO 0.03 -1.14 0.75 -0.44 -1.32 0.00 0.00 176.35 174.23 2wek s SER 52 N 2.53 7.24 -0.01 3.68 0.01 -0.15 -4.95 113.70 122.05 2wek s SER 52 Ca 0.34 1.48 0.17 0.00 1.31 0.00 0.00 55.95 59.24 2wek s SER 52 Cb -0.11 -2.46 -0.21 0.00 0.21 0.00 0.00 66.02 63.45 2wek s SER 52 CO 0.23 0.09 0.57 0.54 0.41 0.00 0.00 173.24 175.08 2wek n ARG 53 N 2.41 1.19 -2.58 12.44 1.74 -1.26 -2.04 116.66 128.56 2wek n ARG 53 Ca -0.04 -0.06 -0.08 0.00 -0.77 0.00 0.00 57.85 56.91 2wek n ARG 53 Cb 0.50 -1.32 0.04 0.00 -1.02 0.00 0.00 32.46 30.66 2wek n ARG 53 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2wek n ASP 54 N -1.65 2.63 -4.79 0.55 8.00 -1.25 -4.44 116.55 115.60 2wek n ASP 54 Ca 0.01 -2.57 -0.35 0.00 0.71 0.00 0.00 54.79 52.58 2wek n ASP 54 Cb 0.32 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 2wek n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wek s PRO 56 N -2.88 3.91 -0.21 0.00 0.04 -1.26 0.34 135.00 134.95 2wek s PRO 56 Ca 0.63 1.48 -0.29 0.00 0.04 0.00 0.00 61.00 62.86 2wek s PRO 56 Cb -0.20 -2.30 -0.00 0.00 0.04 0.00 0.00 34.50 32.04 2wek s PRO 56 CO 0.24 -0.36 1.15 0.08 0.04 0.00 0.00 177.00 178.15 2wek s VAL 57 N -1.79 4.49 0.54 -0.36 1.01 -1.26 -4.75 120.40 118.28 2wek s VAL 57 Ca 0.63 1.79 -0.19 0.00 0.00 0.00 0.00 61.98 64.21 2wek s VAL 57 Cb -0.20 -4.18 -0.06 0.00 0.00 0.00 0.00 36.38 31.94 2wek s VAL 57 CO 0.25 -0.18 1.09 -2.16 0.00 0.00 0.00 175.10 174.10 2wek s PRO 58 N 3.38 3.43 0.13 2.72 0.04 -1.26 -4.95 135.00 138.49 2wek s PRO 58 Ca 0.49 1.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.96 2wek s PRO 58 Cb -0.18 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.28 2wek s PRO 58 CO 0.11 -0.76 0.38 -0.51 0.04 0.00 0.00 177.00 176.26 2wek s LEU 59 N -3.86 4.28 -0.11 -3.56 2.01 -1.26 -4.89 118.68 111.28 2wek s LEU 59 Ca 0.70 0.64 -0.23 0.00 0.01 0.00 0.00 54.13 55.25 2wek s LEU 59 Cb -0.21 -3.25 -0.03 0.00 0.01 0.00 0.00 46.19 42.71 2wek s LEU 59 CO 0.27 0.07 0.70 -2.16 1.01 0.00 0.00 176.35 176.24 2wek s PRO 60 N -2.51 4.36 1.18 1.29 0.04 -1.26 -4.98 135.00 133.12 2wek s PRO 60 Ca 0.39 0.82 -0.20 0.00 0.04 0.00 0.00 61.00 62.06 2wek s PRO 60 Cb -0.12 -3.50 0.30 0.00 0.04 0.00 0.00 34.50 31.22 2wek s PRO 60 CO 0.23 -0.06 0.89 0.41 0.04 0.00 0.00 177.00 178.51 2wek n GLY 61 N 3.32 -3.23 0.25 0.56 0.00 -1.26 -4.41 105.19 100.41 2wek n GLY 61 Ca -0.01 -1.41 0.03 0.00 0.00 0.00 0.00 46.02 44.63 2wek n GLY 61 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2wek h ASP 62 N -2.92 -0.05 -0.55 1.61 3.58 -1.96 -2.00 116.42 114.13 2wek h ASP 62 Ca -0.36 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.22 2wek h ASP 62 Cb 1.14 0.19 0.00 0.00 1.72 0.00 0.00 39.33 42.39 2wek h ASP 62 CO 0.23 -0.03 0.00 0.61 -2.88 0.00 0.00 179.24 177.16 2wek n GLY 63 N -1.34 2.10 3.64 -0.78 0.00 -1.26 -2.31 105.19 105.24 2wek n GLY 63 Ca 0.11 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 2wek n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wek s ASP 64 N -0.87 4.73 -0.07 1.61 1.01 -0.76 -0.94 116.67 121.39 2wek s ASP 64 Ca 0.41 -0.28 -0.04 0.00 0.71 0.00 0.00 52.55 53.36 2wek s ASP 64 Cb 0.25 -1.03 -0.04 0.00 1.01 0.00 0.00 42.92 43.11 2wek s ASP 64 CO 0.22 0.17 0.10 -0.76 0.21 0.00 0.00 175.17 175.11 2wek s LEU 65 N -2.29 4.06 -0.27 1.23 1.43 0.20 -1.22 118.68 121.83 2wek s LEU 65 Ca 0.24 0.29 -0.11 0.00 -1.03 0.00 0.00 54.13 53.53 2wek s LEU 65 Cb -0.11 -2.13 -0.05 0.00 0.03 0.00 0.00 46.19 43.93 2wek s LEU 65 CO 0.16 0.35 0.17 -0.22 0.23 0.00 0.00 176.35 177.05 2wek s LEU 66 N -1.29 4.00 -0.16 1.79 2.96 0.50 0.03 118.68 126.52 2wek s LEU 66 Ca 0.18 0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 54.07 2wek s LEU 66 Cb -0.12 -2.10 -0.02 0.00 0.50 0.00 0.00 46.19 44.45 2wek s LEU 66 CO 0.08 -0.02 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.33 2wek s VAL 67 N 1.58 3.51 -0.35 1.68 1.01 -0.46 -1.46 120.40 125.90 2wek s VAL 67 Ca 0.07 -0.49 -0.26 0.00 0.00 0.00 0.00 61.98 61.31 2wek s VAL 67 Cb -0.15 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.71 2wek s VAL 67 CO 0.09 0.49 0.93 -0.60 0.00 0.00 0.00 175.10 176.00 2wek s ARG 68 N 0.62 3.89 -0.02 2.72 6.06 -0.45 -1.55 118.95 130.22 2wek s ARG 68 Ca -0.04 0.65 -0.30 0.00 -2.50 0.00 0.00 55.73 53.54 2wek s ARG 68 Cb -0.15 -3.78 -0.04 0.00 0.06 0.00 0.00 34.95 31.04 2wek s ARG 68 CO 0.03 -0.90 1.25 -0.80 -2.50 0.00 0.00 175.30 172.38 2wek s ASN 69 N 1.81 7.00 -0.20 -2.12 0.01 -0.56 -2.53 114.94 118.36 2wek s ASN 69 Ca 0.38 1.92 0.03 0.00 -0.71 0.00 0.00 52.86 54.49 2wek s ASN 69 Cb -0.12 -2.56 -0.14 0.00 0.41 0.00 0.00 41.25 38.83 2wek s ASN 69 CO 0.17 -0.60 -0.15 -1.14 -1.51 0.00 0.00 177.10 173.88 2wek n ARG 70 N 5.03 0.63 -4.59 -0.60 0.63 0.25 -4.61 116.66 113.39 2wek n ARG 70 Ca 0.11 0.10 -0.22 0.00 -0.92 0.00 0.00 57.85 56.92 2wek n ARG 70 Cb 0.46 -1.40 -0.15 0.00 0.45 0.00 0.00 32.46 31.82 2wek n ARG 70 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2wek s PHE 71 N -2.40 1.32 0.06 -0.14 0.08 -0.85 -0.25 117.98 115.80 2wek s PHE 71 Ca -0.25 -0.28 0.06 0.00 0.12 0.00 0.00 56.93 56.58 2wek s PHE 71 Cb 0.07 -0.83 -0.03 0.00 -0.57 0.00 0.00 43.02 41.66 2wek s PHE 71 CO 0.49 0.00 -0.15 0.14 -0.10 0.00 0.00 175.22 175.60 2wek s VAL 72 N -0.51 1.23 -0.02 -0.44 -7.23 -0.46 -1.45 120.40 111.52 2wek s VAL 72 Ca 0.05 -1.22 -0.16 0.00 -1.81 0.00 0.00 61.98 58.84 2wek s VAL 72 Cb -0.06 -1.14 -0.05 0.00 0.56 0.00 0.00 36.38 35.68 2wek s VAL 72 CO 0.00 -0.09 0.43 -0.83 -0.31 0.00 0.00 175.10 174.31 2wek s GLY 73 N -1.50 2.48 -0.19 2.32 0.00 -1.16 -1.02 107.32 108.25 2wek s GLY 73 Ca 0.01 -0.19 -0.15 0.00 0.00 0.00 0.00 44.72 44.38 2wek s GLY 73 CO 0.02 0.30 0.37 0.14 0.00 0.00 0.00 173.10 173.94 2wek s VAL 74 N -0.72 5.23 0.08 1.40 1.01 -0.68 -4.59 120.40 122.12 2wek s VAL 74 Ca 0.24 0.67 0.08 0.00 0.00 0.00 0.00 61.98 62.97 2wek s VAL 74 Cb -0.17 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2wek s VAL 74 CO 0.13 0.29 -0.19 0.20 0.00 0.00 0.00 175.10 175.53 2wek s ASN 75 N 0.89 3.76 0.23 3.32 0.01 -1.26 -4.52 114.94 117.37 2wek s ASN 75 Ca 0.18 -0.51 -0.06 0.00 -0.71 0.00 0.00 52.86 51.76 2wek s ASN 75 Cb -0.14 -0.54 0.37 0.00 0.41 0.00 0.00 41.25 41.35 2wek s ASN 75 CO 0.07 0.22 1.76 0.00 -1.51 0.00 0.00 177.10 177.64 2wek h ALA 76 N 4.17 0.98 0.00 0.60 0.00 -2.00 -0.79 119.26 122.22 2wek h ALA 76 Ca -0.49 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2wek h ALA 76 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2wek h ALA 76 CO 0.46 -0.12 0.00 0.43 0.00 0.00 0.00 179.25 180.02 2wek n SER 77 N -4.92 0.00 -0.29 0.00 7.64 -1.26 -3.11 113.62 111.68 2wek n SER 77 Ca 0.12 -1.64 0.13 0.00 1.01 0.00 0.00 58.87 58.49 2wek n SER 77 Cb 0.32 0.00 0.37 0.00 -1.01 0.00 0.00 64.21 63.90 2wek n SER 77 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2wek h ASP 78 N 0.00 0.67 1.61 6.43 3.32 -1.56 -0.07 116.42 126.82 2wek h ASP 78 Ca 0.00 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.02 2wek h ASP 78 Cb 0.00 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2wek h ASP 78 CO 0.00 0.32 -0.39 0.16 -1.72 0.00 0.00 179.24 177.60 2wek h ILE 79 N 0.69 0.65 -0.57 0.35 3.07 -1.76 -0.96 117.51 118.98 2wek h ILE 79 Ca 0.47 -1.92 -0.07 0.00 1.55 0.00 0.00 64.86 64.89 2wek h ILE 79 Cb 0.78 2.32 -0.02 0.00 -0.27 0.00 0.00 36.82 39.63 2wek h ILE 79 CO -0.23 0.37 0.07 0.78 -1.05 0.00 0.00 178.15 178.09 2wek h ASN 80 N 0.00 0.88 -0.30 2.16 2.35 -1.62 -2.58 115.58 116.47 2wek h ASN 80 Ca -0.01 -0.20 -0.11 0.00 -0.55 0.00 0.00 56.30 55.44 2wek h ASN 80 Cb 1.29 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.43 2wek h ASN 80 CO 0.05 0.90 -0.23 0.22 -1.65 0.00 0.00 177.43 176.72 2wek h TYR 81 N 0.87 0.81 0.00 1.19 3.20 -0.73 -2.02 116.97 120.29 2wek h TYR 81 Ca 0.17 -0.23 -0.06 0.00 3.14 0.00 0.00 58.73 61.76 2wek h TYR 81 Cb 0.42 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2wek h TYR 81 CO 0.03 0.96 -0.28 0.66 -1.64 0.00 0.00 178.16 177.88 2wek h SER 82 N 0.44 0.00 1.13 -2.11 4.64 -1.22 -1.88 113.55 114.55 2wek h SER 82 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2wek h SER 82 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 2wek h SER 82 CO 0.06 0.28 0.00 0.00 -0.87 0.00 0.00 176.83 176.30 2wek n ALA 83 N -2.30 2.09 -0.73 5.18 0.00 -0.97 -1.76 120.51 122.02 2wek n ALA 83 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2wek n ALA 83 Cb 0.42 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.43 2wek n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wek n GLY 84 N 0.91 0.57 0.20 0.00 0.00 -0.71 -4.42 105.19 101.73 2wek n GLY 84 Ca 0.05 -0.61 0.08 0.00 0.00 0.00 0.00 46.02 45.54 2wek n GLY 84 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wek h ARG 85 N 0.42 0.00 0.09 1.61 3.08 -1.58 -2.99 114.38 115.01 2wek h ARG 85 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2wek h ARG 85 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2wek h ARG 85 CO 0.00 0.25 -0.05 -0.92 -1.07 0.00 0.00 179.97 178.19 2wek h TYR 86 N 0.00 -0.12 -2.70 3.04 3.20 -1.88 -3.39 116.97 115.12 2wek h TYR 86 Ca -0.00 -0.00 -0.60 0.00 3.14 0.00 0.00 58.73 61.27 2wek h TYR 86 Cb 1.03 0.04 -0.39 0.00 1.54 0.00 0.00 36.73 38.95 2wek h TYR 86 CO 0.00 0.19 -0.82 0.34 -1.64 0.00 0.00 178.16 176.23 2wek s ASP 87 N -5.37 2.96 0.66 -2.11 3.68 -1.24 -5.01 116.67 110.25 2wek s ASP 87 Ca -0.15 -2.64 0.34 0.00 2.13 0.00 0.00 52.55 52.23 2wek s ASP 87 Cb 0.03 -0.69 1.86 0.00 -1.45 0.00 0.00 42.92 42.66 2wek s ASP 87 CO 0.64 -0.25 2.06 -0.65 0.13 0.00 0.00 175.17 177.10 2wek h PRO 88 N 6.50 0.00 0.00 4.34 0.11 -1.74 0.37 132.00 141.58 2wek h PRO 88 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2wek h PRO 88 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2wek h PRO 88 CO 0.39 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.84 2wek h SER 89 N 0.00 0.00 -3.54 -2.05 4.64 -1.95 -3.45 113.55 107.20 2wek h SER 89 Ca 0.01 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.72 2wek h SER 89 Cb 0.49 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.45 2wek h SER 89 CO -0.00 0.00 0.08 -0.69 -0.87 0.00 0.00 176.83 175.35 2wek s VAL 90 N -3.15 5.01 0.27 0.95 1.01 0.12 -5.06 120.40 119.55 2wek s VAL 90 Ca 0.09 0.93 -0.03 0.00 0.00 0.00 0.00 61.98 62.97 2wek s VAL 90 Cb 0.11 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 2wek s VAL 90 CO 0.57 -0.00 0.50 -0.54 0.00 0.00 0.00 175.10 175.63 2wek s LYS 91 N 2.45 3.57 0.72 2.72 3.01 -1.26 -4.98 119.74 125.96 2wek s LYS 91 Ca 0.24 -0.17 -0.15 0.00 -1.01 0.00 0.00 55.97 54.88 2wek s LYS 91 Cb -0.15 -2.71 0.03 0.00 -1.01 0.00 0.00 37.83 33.99 2wek s LYS 91 CO 0.10 0.26 1.18 -2.14 0.51 0.00 0.00 175.35 175.26 2wek s PRO 92 N -3.62 2.28 0.30 -1.68 0.02 -1.26 -4.60 135.00 126.43 2wek s PRO 92 Ca 0.41 1.65 -0.14 0.00 0.02 0.00 0.00 61.00 62.94 2wek s PRO 92 Cb -0.11 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.47 2wek s PRO 92 CO 0.31 -1.71 0.70 -1.25 -0.33 0.00 0.00 177.00 174.73 2wek s PRO 93 N -3.99 3.99 0.12 5.54 0.04 -1.26 -5.04 135.00 134.39 2wek s PRO 93 Ca 0.72 0.62 -0.18 0.00 0.04 0.00 0.00 61.00 62.20 2wek s PRO 93 Cb -0.26 -2.50 0.04 0.00 0.04 0.00 0.00 34.50 31.82 2wek s PRO 93 CO 0.45 0.20 0.44 -0.59 0.04 0.00 0.00 177.00 177.54 2wek s PHE 94 N -1.92 -0.27 0.74 0.56 -0.12 -1.05 -5.00 117.98 110.92 2wek s PHE 94 Ca 0.52 0.02 -0.11 0.00 -0.05 0.00 0.00 56.93 57.31 2wek s PHE 94 Cb -0.11 0.30 0.04 0.00 -0.63 0.00 0.00 43.02 42.62 2wek s PHE 94 CO 0.18 -0.71 1.09 -0.51 -0.05 0.00 0.00 175.22 175.22 2wek s ASP 95 N -2.66 5.05 0.13 1.98 1.01 -1.26 -1.45 116.67 119.47 2wek s ASP 95 Ca 0.01 1.30 -0.09 0.00 0.71 0.00 0.00 52.55 54.48 2wek s ASP 95 Cb 0.01 -2.09 -0.00 0.00 1.01 0.00 0.00 42.92 41.84 2wek s ASP 95 CO -0.10 -1.62 0.25 -0.51 0.21 0.00 0.00 175.17 173.40 2wek s ILE 96 N -3.21 0.10 0.00 0.77 2.07 -1.26 -4.55 121.20 115.11 2wek s ILE 96 Ca 0.59 -1.26 0.00 0.00 -1.41 0.00 0.00 60.65 58.57 2wek s ILE 96 Cb -0.13 -1.60 0.00 0.00 0.13 0.00 0.00 42.46 40.86 2wek s ILE 96 CO 0.53 -0.44 0.00 0.61 -1.91 0.00 0.00 174.94 173.73 2wek n GLY 97 N -0.15 -0.06 0.00 1.50 0.00 -1.26 -1.62 105.19 103.60 2wek n GLY 97 Ca -0.11 -1.17 0.09 0.00 0.00 0.00 0.00 46.02 44.83 2wek n GLY 97 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2wek n PHE 98 N 1.94 0.00 -3.72 1.61 3.72 -1.26 0.10 117.46 119.86 2wek n PHE 98 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 2wek n PHE 98 Cb 0.00 -0.09 -0.07 0.00 -0.94 0.00 0.00 39.48 38.37 2wek n PHE 98 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 2wek s GLU 99 N -2.97 0.83 0.14 -1.08 -1.05 -1.25 -0.62 118.70 112.69 2wek s GLU 99 Ca 0.04 -0.38 -0.19 0.00 -0.15 0.00 0.00 54.97 54.29 2wek s GLU 99 Cb 0.14 0.37 0.05 0.00 -0.44 0.00 0.00 34.13 34.25 2wek s GLU 99 CO 0.82 -0.27 0.49 0.20 0.95 0.00 0.00 175.26 177.44 2wek s GLY 100 N -1.89 -0.42 -0.07 -3.83 0.00 -0.69 -2.97 107.32 97.45 2wek s GLY 100 Ca -0.07 0.20 -0.05 0.00 0.00 0.00 0.00 44.72 44.80 2wek s GLY 100 CO -0.01 -0.09 0.17 -1.50 0.00 0.00 0.00 173.10 171.67 2wek s ILE 101 N -3.72 -0.02 0.00 0.90 2.07 -0.53 -1.42 121.20 118.48 2wek s ILE 101 Ca 0.02 0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.32 2wek s ILE 101 Cb 0.01 -0.26 0.00 0.00 0.13 0.00 0.00 42.46 42.34 2wek s ILE 101 CO -0.12 0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.55 2wek n GLY 102 N 3.45 1.20 3.55 1.50 0.00 -0.51 -0.59 105.19 113.79 2wek n GLY 102 Ca -0.18 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 2wek n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wek s GLU 103 N 1.70 2.42 -0.21 1.61 8.01 -1.05 -1.29 118.70 129.89 2wek s GLU 103 Ca 0.00 -0.79 -0.29 0.00 0.01 0.00 0.00 54.97 53.90 2wek s GLU 103 Cb 0.00 -2.41 -0.00 0.00 -4.31 0.00 0.00 34.13 27.41 2wek s GLU 103 CO 0.00 0.59 1.18 0.08 0.01 0.00 0.00 175.26 177.12 2wek s VAL 104 N -0.95 4.42 -0.13 2.63 1.01 -0.28 -1.34 120.40 125.77 2wek s VAL 104 Ca 0.16 1.70 0.12 0.00 0.00 0.00 0.00 61.98 63.97 2wek s VAL 104 Cb -0.11 -4.14 -0.17 0.00 0.00 0.00 0.00 36.38 31.95 2wek s VAL 104 CO 0.06 -0.20 0.07 1.33 0.00 0.00 0.00 175.10 176.36 2wek n VAL 105 N 5.46 0.87 -3.94 2.92 0.24 -0.54 0.19 118.33 123.53 2wek n VAL 105 Ca 0.13 -0.56 -0.08 0.00 -2.04 0.00 0.00 64.34 61.79 2wek n VAL 105 Cb 0.46 -0.58 -0.09 0.00 -1.47 0.00 0.00 33.84 32.16 2wek n VAL 105 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wek s ALA 106 N -2.38 0.01 0.01 2.33 0.00 -1.21 -4.86 121.76 115.65 2wek s ALA 106 Ca -0.07 -0.75 -0.22 0.00 0.00 0.00 0.00 51.96 50.93 2wek s ALA 106 Cb 0.04 0.36 0.05 0.00 0.00 0.00 0.00 23.12 23.57 2wek s ALA 106 CO 0.56 -0.42 0.48 -0.48 0.00 0.00 0.00 175.76 175.91 2wek s LEU 107 N -2.67 0.11 1.24 0.00 2.34 -1.26 -0.37 118.68 118.08 2wek s LEU 107 Ca 0.03 0.24 -0.21 0.00 0.06 0.00 0.00 54.13 54.25 2wek s LEU 107 Cb 0.04 1.94 0.30 0.00 -0.56 0.00 0.00 46.19 47.91 2wek s LEU 107 CO -0.09 -0.62 1.11 -0.83 -1.06 0.00 0.00 176.35 174.86 2wek s GLY 108 N -1.65 1.58 0.13 -3.48 0.00 -0.36 -4.85 107.32 98.69 2wek s GLY 108 Ca -0.08 -1.05 -0.03 0.00 0.00 0.00 0.00 44.72 43.56 2wek s GLY 108 CO 0.02 -0.11 1.30 1.41 0.00 0.00 0.00 173.10 175.71 2wek h LEU 109 N -2.72 0.45 -0.01 0.66 -0.00 -1.77 -2.52 115.31 109.40 2wek h LEU 109 Ca -0.43 -0.38 -0.12 0.00 -0.00 0.00 0.00 57.88 56.95 2wek h LEU 109 Cb 1.29 -0.14 0.01 0.00 -0.00 0.00 0.00 40.66 41.82 2wek h LEU 109 CO 0.30 1.20 -0.46 0.28 -0.00 0.00 0.00 178.44 179.75 2wek h SER 110 N 0.18 0.42 -0.92 -0.43 0.02 -1.85 -3.19 113.55 107.77 2wek h SER 110 Ca -0.08 -0.76 0.24 0.00 -0.84 0.00 0.00 61.79 60.35 2wek h SER 110 Cb 1.62 -0.13 -0.13 0.00 0.14 0.00 0.00 62.40 63.90 2wek h SER 110 CO 0.16 1.12 0.42 0.00 -1.14 0.00 0.00 176.83 177.39 2wek h ALA 111 N 0.30 1.54 0.00 3.77 0.00 -1.52 -1.51 119.26 121.84 2wek h ALA 111 Ca -0.06 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2wek h ALA 111 Cb 1.19 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2wek h ALA 111 CO 0.09 -0.39 0.00 -1.13 0.00 0.00 0.00 179.25 177.82 2wek n SER 112 N -5.06 0.00 0.12 0.00 3.41 -0.95 -1.82 113.62 109.32 2wek n SER 112 Ca 0.24 0.02 -0.03 0.00 -0.26 0.00 0.00 58.87 58.84 2wek n SER 112 Cb 0.73 -0.24 0.10 0.00 -0.26 0.00 0.00 64.21 64.54 2wek n SER 112 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wek h ALA 113 N 2.67 0.83 0.00 7.33 0.00 -1.39 -3.36 119.26 125.36 2wek h ALA 113 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2wek h ALA 113 Cb 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2wek h ALA 113 CO 0.00 0.87 -1.56 0.54 0.00 0.00 0.00 179.25 179.09 2wek n ARG 114 N -3.71 0.46 -4.46 0.00 5.12 -0.84 -5.06 116.66 108.17 2wek n ARG 114 Ca -0.01 -0.12 -0.22 0.00 -1.93 0.00 0.00 57.85 55.58 2wek n ARG 114 Cb 0.69 -1.30 -0.11 0.00 -1.16 0.00 0.00 32.46 30.58 2wek n ARG 114 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2wek s TYR 115 N -2.88 1.99 0.04 -1.55 2.02 -0.75 -5.15 117.35 111.06 2wek s TYR 115 Ca -0.04 -0.90 -0.07 0.00 -0.37 0.00 0.00 57.07 55.69 2wek s TYR 115 Cb 0.08 -1.29 -0.00 0.00 -0.40 0.00 0.00 41.96 40.35 2wek s TYR 115 CO 0.54 0.08 0.14 0.95 -1.57 0.00 0.00 175.55 175.69 2wek s THR 116 N -3.21 0.12 0.35 -0.71 -4.23 -1.26 -4.40 115.64 102.30 2wek s THR 116 Ca 0.35 -0.99 -0.28 0.00 -1.18 0.00 0.00 61.69 59.59 2wek s THR 116 Cb 0.08 -0.89 -0.12 0.00 1.34 0.00 0.00 72.50 72.91 2wek s THR 116 CO 0.15 -0.55 1.40 0.52 -0.54 0.00 0.00 174.62 175.60 2wek n VAL 117 N 0.74 1.85 0.00 2.29 0.31 -1.26 -2.07 118.33 120.20 2wek n VAL 117 Ca -0.19 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.68 2wek n VAL 117 Cb 0.59 -1.76 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 2wek n VAL 117 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wek n GLY 118 N 0.84 1.57 3.75 2.92 0.00 0.52 -4.96 105.19 109.84 2wek n GLY 118 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2wek n GLY 118 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wek s GLN 119 N -0.50 4.48 -0.06 1.61 0.74 -0.88 -4.61 119.66 120.44 2wek s GLN 119 Ca 0.00 1.99 -0.30 0.00 0.05 0.00 0.00 55.36 57.10 2wek s GLN 119 Cb 0.00 -3.16 -0.03 0.00 1.10 0.00 0.00 33.01 30.91 2wek s GLN 119 CO 0.00 -0.05 1.24 0.00 -0.55 0.00 0.00 175.29 175.93 2wek s ALA 120 N -0.71 3.53 0.03 1.58 0.00 -1.26 -1.12 121.76 123.81 2wek s ALA 120 Ca 0.50 0.64 -0.02 0.00 0.00 0.00 0.00 51.96 53.08 2wek s ALA 120 Cb -0.35 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.20 2wek s ALA 120 CO 0.43 -0.84 0.00 0.14 0.00 0.00 0.00 175.76 175.49 2wek s VAL 121 N 2.43 0.14 0.12 0.00 -7.23 -0.42 -2.81 120.40 112.63 2wek s VAL 121 Ca 0.57 -1.15 0.05 0.00 -1.81 0.00 0.00 61.98 59.64 2wek s VAL 121 Cb -0.25 -0.69 -0.04 0.00 0.56 0.00 0.00 36.38 35.96 2wek s VAL 121 CO 0.22 -0.64 -0.13 0.00 -0.31 0.00 0.00 175.10 174.24 2wek s ALA 122 N -2.26 1.42 0.08 1.32 0.00 -0.35 -1.42 121.76 120.54 2wek s ALA 122 Ca -0.08 -1.27 -0.16 0.00 0.00 0.00 0.00 51.96 50.44 2wek s ALA 122 Cb -0.04 -0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.06 2wek s ALA 122 CO -0.04 0.07 0.38 1.52 0.00 0.00 0.00 175.76 177.70 2wek s TYR 123 N -2.21 -0.20 -0.31 0.00 -0.85 -0.51 0.13 117.35 113.40 2wek s TYR 123 Ca 0.08 0.01 -0.01 0.00 -0.52 0.00 0.00 57.07 56.64 2wek s TYR 123 Cb -0.04 0.20 0.06 0.00 0.38 0.00 0.00 41.96 42.56 2wek s TYR 123 CO 0.02 -0.61 0.00 1.41 -1.52 0.00 0.00 175.55 174.85 2wek s MET 124 N -3.09 2.28 -0.07 -3.49 1.75 -1.26 -1.70 119.30 113.72 2wek s MET 124 Ca -0.01 -1.38 -0.30 0.00 -1.25 0.00 0.00 55.69 52.75 2wek s MET 124 Cb 0.01 -3.17 0.10 0.00 2.84 0.00 0.00 34.83 34.61 2wek s MET 124 CO -0.07 -0.68 0.87 0.00 -0.65 0.00 0.00 175.02 174.49 2wek s ALA 125 N 1.19 -1.84 0.41 4.11 0.00 0.21 -4.98 121.76 120.85 2wek s ALA 125 Ca -0.03 1.31 -0.25 0.00 0.00 0.00 0.00 51.96 52.98 2wek s ALA 125 Cb -0.20 -0.15 -0.08 0.00 0.00 0.00 0.00 23.12 22.69 2wek s ALA 125 CO -0.03 -0.45 1.20 -2.14 0.00 0.00 0.00 175.76 174.34 2wek s PRO 126 N -1.81 3.99 0.00 0.00 0.02 -1.26 -3.93 135.00 132.01 2wek s PRO 126 Ca -0.02 1.91 0.00 0.00 0.02 0.00 0.00 61.00 62.91 2wek s PRO 126 Cb -0.01 -2.66 0.00 0.00 0.02 0.00 0.00 34.50 31.85 2wek s PRO 126 CO -0.00 -0.39 0.00 0.41 -0.33 0.00 0.00 177.00 176.69 2wek n GLY 127 N 0.63 1.39 0.22 0.52 0.00 0.12 -4.87 105.19 103.20 2wek n GLY 127 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2wek n GLY 127 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wek h SER 128 N 0.00 0.00 0.00 1.61 4.64 -1.11 -3.37 113.55 115.32 2wek h SER 128 Ca 0.00 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 2wek h SER 128 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2wek h SER 128 CO 0.00 0.11 3.05 0.49 -0.87 0.00 0.00 176.83 179.62 2wek n PHE 129 N -3.17 2.83 -3.53 4.77 3.72 -0.64 -4.77 117.46 116.67 2wek n PHE 129 Ca 0.02 -2.68 -0.13 0.00 -0.05 0.00 0.00 57.45 54.61 2wek n PHE 129 Cb 0.48 -2.30 -0.04 0.00 -0.94 0.00 0.00 39.48 36.68 2wek n PHE 129 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wek s ALA 130 N 3.41 -1.38 0.38 4.37 0.00 -1.26 -1.59 121.76 125.70 2wek s ALA 130 Ca 0.53 0.50 0.09 0.00 0.00 0.00 0.00 51.96 53.07 2wek s ALA 130 Cb 0.15 0.58 0.76 0.00 0.00 0.00 0.00 23.12 24.60 2wek s ALA 130 CO -0.04 -0.61 1.90 0.93 0.00 0.00 0.00 175.76 177.95 2wek h GLU 131 N 2.46 0.24 -3.63 0.00 5.08 -1.70 -3.42 114.58 113.62 2wek h GLU 131 Ca -0.32 -0.06 -0.26 0.00 -1.00 0.00 0.00 59.36 57.72 2wek h GLU 131 Cb 1.25 -0.03 -0.31 0.00 0.50 0.00 0.00 28.75 30.16 2wek h GLU 131 CO 0.41 0.39 -0.72 0.71 -1.00 0.00 0.00 179.01 178.80 2wek s TYR 132 N -4.70 0.01 -0.04 4.33 2.02 -1.26 -1.49 117.35 116.22 2wek s TYR 132 Ca -0.05 0.06 0.03 0.00 -0.37 0.00 0.00 57.07 56.74 2wek s TYR 132 Cb 0.15 -0.11 0.00 0.00 -0.40 0.00 0.00 41.96 41.61 2wek s TYR 132 CO 0.73 -0.04 -0.13 0.99 -1.57 0.00 0.00 175.55 175.53 2wek s THR 133 N 0.49 1.11 -0.02 -0.71 2.01 -0.60 -4.87 115.64 113.05 2wek s THR 133 Ca -0.04 -0.53 -0.26 0.00 0.31 0.00 0.00 61.69 61.17 2wek s THR 133 Cb -0.06 -0.98 -0.04 0.00 0.01 0.00 0.00 72.50 71.44 2wek s THR 133 CO -0.01 0.33 0.82 -0.69 -0.69 0.00 0.00 174.62 174.38 2wek s VAL 134 N 0.22 4.93 -0.03 3.82 1.01 -1.26 -1.36 120.40 127.73 2wek s VAL 134 Ca -0.06 1.71 0.00 0.00 0.00 0.00 0.00 61.98 63.64 2wek s VAL 134 Cb -0.11 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.14 2wek s VAL 134 CO 0.02 0.23 -0.01 -0.69 0.00 0.00 0.00 175.10 174.65 2wek s VAL 135 N 0.75 0.27 0.19 2.92 1.01 0.10 -4.99 120.40 120.66 2wek s VAL 135 Ca 0.43 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 62.15 2wek s VAL 135 Cb -0.19 -0.35 -0.09 0.00 0.00 0.00 0.00 36.38 35.75 2wek s VAL 135 CO 0.23 0.17 1.32 -2.84 0.00 0.00 0.00 175.10 173.97 2wek s PRO 136 N 1.03 4.38 0.30 2.72 0.02 -1.26 0.61 135.00 142.79 2wek s PRO 136 Ca -0.10 2.06 0.03 0.00 0.02 0.00 0.00 61.00 63.01 2wek s PRO 136 Cb -0.14 -3.20 0.62 0.00 0.02 0.00 0.00 34.50 31.80 2wek s PRO 136 CO -0.01 -0.27 1.83 0.00 -0.33 0.00 0.00 177.00 178.22 2wek h ALA 137 N 5.50 1.59 -0.34 -1.55 0.00 -1.35 -0.94 119.26 122.17 2wek h ALA 137 Ca -0.44 0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.59 2wek h ALA 137 Cb 1.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2wek h ALA 137 CO 0.78 0.15 0.41 0.66 0.00 0.00 0.00 179.25 181.25 2wek h SER 138 N 0.92 0.00 -0.18 0.00 4.64 -1.91 -1.65 113.55 115.38 2wek h SER 138 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 2wek h SER 138 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 2wek h SER 138 CO -0.27 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 177.99 2wek n ILE 139 N -3.63 0.72 -2.34 0.95 -5.35 -0.36 -5.02 119.36 104.33 2wek n ILE 139 Ca 0.06 -0.86 -0.34 0.00 -0.27 0.00 0.00 62.75 61.33 2wek n ILE 139 Cb 0.56 0.68 -0.01 0.00 -1.74 0.00 0.00 39.64 39.13 2wek n ILE 139 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wek s ALA 140 N -0.90 2.78 -0.30 -1.28 0.00 -0.62 -4.59 121.76 116.84 2wek s ALA 140 Ca 0.14 0.64 -0.02 0.00 0.00 0.00 0.00 51.96 52.72 2wek s ALA 140 Cb 0.08 -3.29 0.05 0.00 0.00 0.00 0.00 23.12 19.96 2wek s ALA 140 CO 0.11 -0.58 0.01 0.99 0.00 0.00 0.00 175.76 176.29 2wek s THR 141 N -2.00 3.07 0.30 0.00 2.01 0.12 -4.98 115.64 114.16 2wek s THR 141 Ca 0.68 -1.36 -0.30 0.00 0.31 0.00 0.00 61.69 61.03 2wek s THR 141 Cb -0.19 -2.77 -0.12 0.00 0.01 0.00 0.00 72.50 69.44 2wek s THR 141 CO 0.26 -0.12 1.56 -2.65 -0.69 0.00 0.00 174.62 172.98 2wek n PRO 142 N 4.64 2.64 -4.31 4.92 -0.02 -1.26 -1.21 135.00 140.40 2wek n PRO 142 Ca -0.13 0.93 -0.19 0.00 -2.02 0.00 0.00 63.50 62.10 2wek n PRO 142 Cb 0.43 -2.70 -0.11 0.00 -0.02 0.00 0.00 33.50 31.11 2wek n PRO 142 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2wek s VAL 143 N -0.22 1.61 0.24 -1.45 -7.23 -1.12 -4.87 120.40 107.35 2wek s VAL 143 Ca 0.62 -2.03 -0.06 0.00 -1.81 0.00 0.00 61.98 58.70 2wek s VAL 143 Cb -0.51 -1.87 0.20 0.00 0.56 0.00 0.00 36.38 34.77 2wek s VAL 143 CO 0.51 -0.51 1.85 -0.65 -0.31 0.00 0.00 175.10 175.99 2wek h PRO 144 N 2.94 1.22 -3.08 4.82 0.11 -1.95 -3.42 132.00 132.64 2wek h PRO 144 Ca -0.39 -0.16 0.01 0.00 0.11 0.00 0.00 66.00 65.57 2wek h PRO 144 Cb 1.21 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 2wek h PRO 144 CO 0.57 0.91 0.22 -1.54 -0.21 0.00 0.00 178.00 177.95 2wek s SER 145 N -6.28 -0.09 -0.91 -2.05 1.04 -1.26 -4.91 113.70 99.23 2wek s SER 145 Ca -0.12 -0.89 -0.21 0.00 0.48 0.00 0.00 55.95 55.20 2wek s SER 145 Cb 0.17 0.77 0.09 0.00 0.10 0.00 0.00 66.02 67.15 2wek s SER 145 CO 0.83 -1.49 1.24 -0.69 0.98 0.00 0.00 173.24 174.11 2wek s VAL 146 N -3.19 4.30 0.03 5.02 1.01 -1.26 -4.92 120.40 121.39 2wek s VAL 146 Ca 0.14 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.21 2wek s VAL 146 Cb -0.05 -4.88 -0.02 0.00 0.00 0.00 0.00 36.38 31.43 2wek s VAL 146 CO 0.10 -1.69 -0.15 -0.54 0.00 0.00 0.00 175.10 172.82 2wek s LYS 147 N 3.95 1.01 0.42 2.72 1.02 -1.26 -5.05 119.74 122.55 2wek s LYS 147 Ca 0.36 -0.75 0.12 0.00 0.02 0.00 0.00 55.97 55.73 2wek s LYS 147 Cb -0.05 -1.03 0.90 0.00 -0.52 0.00 0.00 37.83 37.13 2wek s LYS 147 CO -0.05 0.26 1.95 -1.00 -0.92 0.00 0.00 175.35 175.59 2wek h PRO 148 N 5.04 0.10 -0.95 -1.68 0.13 -2.00 -2.72 132.00 129.91 2wek h PRO 148 Ca -0.38 -0.02 0.19 0.00 -0.87 0.00 0.00 66.00 64.92 2wek h PRO 148 Cb 1.17 -0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.21 2wek h PRO 148 CO 0.45 0.27 0.61 0.93 -0.23 0.00 0.00 178.00 180.02 2wek h GLU 149 N 0.09 0.59 -0.02 0.86 3.07 -1.97 -0.35 114.58 116.86 2wek h GLU 149 Ca 0.02 -0.04 -0.16 0.00 -0.50 0.00 0.00 59.36 58.68 2wek h GLU 149 Cb 0.36 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.12 2wek h GLU 149 CO 0.02 0.39 -0.74 1.88 -1.40 0.00 0.00 179.01 179.17 2wek h TYR 150 N 0.61 0.19 -0.08 4.33 0.05 -1.85 -2.87 116.97 117.35 2wek h TYR 150 Ca 0.51 -0.09 -0.11 0.00 0.05 0.00 0.00 58.73 59.10 2wek h TYR 150 Cb 0.98 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.68 2wek h TYR 150 CO -0.00 0.82 -0.44 1.25 -1.05 0.00 0.00 178.16 178.74 2wek h LEU 151 N 0.09 0.19 -2.12 3.88 6.46 -1.15 -2.62 115.31 120.05 2wek h LEU 151 Ca -0.02 -0.08 0.08 0.00 -0.12 0.00 0.00 57.88 57.74 2wek h LEU 151 Cb 1.30 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 41.16 2wek h LEU 151 CO 0.11 0.61 0.28 0.71 -0.62 0.00 0.00 178.44 179.53 2wek h THR 152 N 0.15 0.52 -0.02 1.05 1.35 -1.16 -2.09 112.91 112.72 2wek h THR 152 Ca 0.01 0.00 -0.16 0.00 -0.55 0.00 0.00 66.41 65.71 2wek h THR 152 Cb 0.84 0.78 -0.02 0.00 -1.73 0.00 0.00 68.15 68.03 2wek h THR 152 CO 0.07 0.00 -0.72 -0.07 -0.25 0.00 0.00 175.52 174.54 2wek h LEU 153 N 0.00 0.15 -0.36 3.87 3.38 -1.55 -2.13 115.31 118.67 2wek h LEU 153 Ca 0.14 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2wek h LEU 153 Cb 0.70 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2wek h LEU 153 CO -0.00 0.82 0.22 -0.07 0.09 0.00 0.00 178.44 179.50 2wek h LEU 154 N 0.08 0.37 0.00 1.67 3.38 -1.48 -1.52 115.31 117.82 2wek h LEU 154 Ca -0.02 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 2wek h LEU 154 Cb 1.28 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 2wek h LEU 154 CO 0.10 0.27 -1.19 0.52 0.09 0.00 0.00 178.44 178.23 2wek n VAL 155 N -4.86 0.67 0.04 1.22 0.31 -1.26 -4.47 118.33 109.98 2wek n VAL 155 Ca 0.00 -0.01 -0.13 0.00 -0.01 0.00 0.00 64.34 64.19 2wek n VAL 155 Cb 0.04 -1.67 -0.09 0.00 -0.91 0.00 0.00 33.84 31.22 2wek n VAL 155 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2wek h SER 156 N -0.30 -0.09 -0.38 4.52 0.02 -1.71 -1.57 113.55 114.05 2wek h SER 156 Ca -0.16 -0.28 -0.05 0.00 -0.84 0.00 0.00 61.79 60.46 2wek h SER 156 Cb 0.97 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 2wek h SER 156 CO -0.10 0.24 0.04 1.23 -1.14 0.00 0.00 176.83 177.10 2wek h GLY 157 N -0.42 0.69 1.68 -3.77 0.00 -1.23 -2.79 103.07 97.24 2wek h GLY 157 Ca -0.01 -0.48 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 2wek h GLY 157 CO 0.02 0.44 -0.33 -0.91 0.00 0.00 0.00 176.54 175.76 2wek h THR 158 N 0.48 1.28 -0.10 4.70 1.35 -1.31 0.39 112.91 119.69 2wek h THR 158 Ca 0.11 -1.37 -0.01 0.00 -0.55 0.00 0.00 66.41 64.60 2wek h THR 158 Cb 0.40 1.50 -0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2wek h THR 158 CO 0.01 0.42 0.04 0.74 -0.25 0.00 0.00 175.52 176.49 2wek h THR 159 N 0.32 1.14 -0.36 6.82 2.02 -1.24 0.44 112.91 122.05 2wek h THR 159 Ca 0.04 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2wek h THR 159 Cb 0.73 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 2wek h THR 159 CO 0.06 0.12 0.24 0.00 0.37 0.00 0.00 175.52 176.30 2wek h ALA 160 N 0.89 0.45 0.61 6.16 0.00 -1.31 -2.26 119.26 123.81 2wek h ALA 160 Ca 0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2wek h ALA 160 Cb 0.15 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.80 2wek h ALA 160 CO -0.00 -0.09 -0.29 -0.92 0.00 0.00 0.00 179.25 177.95 2wek h TYR 161 N 0.49 -0.76 -0.45 0.00 3.20 -0.76 -2.63 116.97 116.06 2wek h TYR 161 Ca 0.13 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 2wek h TYR 161 Cb -0.06 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 2wek h TYR 161 CO -0.05 -0.44 0.08 0.82 -1.64 0.00 0.00 178.16 176.93 2wek h ILE 162 N -0.92 1.24 -0.30 1.81 2.04 -0.97 -0.21 117.51 120.20 2wek h ILE 162 Ca -0.08 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 2wek h ILE 162 Cb 0.66 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 2wek h ILE 162 CO 0.14 0.31 0.08 0.77 0.00 0.00 0.00 178.15 179.45 2wek h SER 163 N 0.60 0.46 -0.36 1.72 4.64 -1.48 0.70 113.55 119.83 2wek h SER 163 Ca 0.14 -0.22 -0.12 0.00 -0.47 0.00 0.00 61.79 61.11 2wek h SER 163 Cb 0.38 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 2wek h SER 163 CO 0.01 0.56 -0.22 -0.07 -0.87 0.00 0.00 176.83 176.24 2wek h LEU 164 N 0.33 0.87 -0.18 5.97 3.38 -1.43 0.11 115.31 124.36 2wek h LEU 164 Ca 0.10 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 2wek h LEU 164 Cb 0.28 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2wek h LEU 164 CO -0.00 1.06 -0.18 0.50 0.09 0.00 0.00 178.44 179.91 2wek h LYS 165 N 0.74 0.44 0.00 1.13 3.64 -0.75 -0.89 116.57 120.88 2wek h LYS 165 Ca 0.10 -0.23 -0.20 0.00 -1.27 0.00 0.00 60.65 59.05 2wek h LYS 165 Cb 0.76 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.56 2wek h LYS 165 CO 0.06 0.80 -0.96 0.93 -2.27 0.00 0.00 179.45 178.01 2wek h GLU 166 N 0.09 0.00 0.00 1.90 4.39 -0.86 -3.41 114.58 116.69 2wek h GLU 166 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2wek h GLU 166 Cb 0.72 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2wek h GLU 166 CO 0.04 0.96 0.00 1.28 -1.16 0.00 0.00 179.01 180.14 2wek n LEU 167 N -3.39 0.02 0.11 1.33 4.77 0.36 -4.81 117.00 115.40 2wek n LEU 167 Ca -0.00 -0.38 -0.17 0.00 -0.03 0.00 0.00 56.01 55.43 2wek n LEU 167 Cb 0.91 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.86 2wek n LEU 167 CO 0.47 0.01 -0.07 1.23 -1.33 0.00 0.00 177.39 177.69 2wek h GLY 168 N 0.00 0.35 -4.66 -0.72 0.00 -1.11 -3.48 103.07 93.45 2wek h GLY 168 Ca 0.00 -0.89 -0.40 0.00 0.00 0.00 0.00 47.33 46.04 2wek h GLY 168 CO 0.00 0.78 -0.60 0.61 0.00 0.00 0.00 176.54 177.33 2wek n GLY 169 N 1.55 -0.52 3.77 4.60 0.00 -1.26 -4.93 105.19 108.41 2wek n GLY 169 Ca -0.09 0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2wek n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wek s LEU 170 N -6.64 4.19 0.19 0.99 1.43 -1.26 -5.03 118.68 112.55 2wek s LEU 170 Ca 0.32 2.43 -0.23 0.00 -1.03 0.00 0.00 54.13 55.62 2wek s LEU 170 Cb -0.15 -4.00 0.05 0.00 0.03 0.00 0.00 46.19 42.13 2wek s LEU 170 CO 0.39 -0.74 0.75 -0.94 0.23 0.00 0.00 176.35 176.04 2wek s SER 171 N -1.03 -0.35 0.21 2.29 1.04 -1.26 -5.10 113.70 109.49 2wek s SER 171 Ca 0.57 -0.31 -0.32 0.00 0.48 0.00 0.00 55.95 56.37 2wek s SER 171 Cb -0.33 0.60 -0.13 0.00 0.10 0.00 0.00 66.02 66.26 2wek s SER 171 CO 0.41 -1.06 1.50 1.21 0.98 0.00 0.00 173.24 176.28 2wek n GLU 172 N -0.41 2.16 0.00 4.02 2.13 -1.23 -2.46 120.64 124.84 2wek n GLU 172 Ca -0.09 0.77 0.00 0.00 0.66 0.00 0.00 57.16 58.50 2wek n GLU 172 Cb 0.61 -2.49 0.00 0.00 0.27 0.00 0.00 31.44 29.83 2wek n GLU 172 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wek n GLY 173 N 2.75 1.68 3.75 8.31 0.00 -0.05 -4.96 105.19 116.66 2wek n GLY 173 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2wek n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wek s LYS 174 N -0.46 2.74 -0.28 1.61 1.02 -1.03 -4.57 119.74 118.78 2wek s LYS 174 Ca 0.00 1.77 -0.11 0.00 0.02 0.00 0.00 55.97 57.65 2wek s LYS 174 Cb 0.00 -1.91 -0.05 0.00 -0.52 0.00 0.00 37.83 35.36 2wek s LYS 174 CO 0.00 -1.37 0.18 0.15 -0.92 0.00 0.00 175.35 173.38 2wek s LYS 175 N -3.56 3.92 -0.13 1.68 1.02 -1.26 -0.61 119.74 120.80 2wek s LYS 175 Ca 0.76 -0.34 -0.01 0.00 0.02 0.00 0.00 55.97 56.40 2wek s LYS 175 Cb -0.29 -3.62 -0.02 0.00 -0.52 0.00 0.00 37.83 33.38 2wek s LYS 175 CO 0.37 -0.17 -0.10 0.08 -0.92 0.00 0.00 175.35 174.61 2wek s VAL 176 N 1.72 3.38 -0.17 3.17 1.01 -0.43 -0.83 120.40 128.26 2wek s VAL 176 Ca 0.07 -0.55 -0.04 0.00 0.00 0.00 0.00 61.98 61.46 2wek s VAL 176 Cb -0.16 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 2wek s VAL 176 CO 0.10 0.52 -0.03 -0.22 0.00 0.00 0.00 175.10 175.47 2wek s LEU 177 N 0.22 3.21 -0.15 3.92 2.96 0.32 -0.26 118.68 128.90 2wek s LEU 177 Ca -0.06 -0.18 0.02 0.00 -0.22 0.00 0.00 54.13 53.69 2wek s LEU 177 Cb -0.15 -1.79 0.01 0.00 0.50 0.00 0.00 46.19 44.77 2wek s LEU 177 CO 0.04 0.13 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.31 2wek s VAL 178 N 0.62 1.96 0.30 1.68 1.01 0.02 0.17 120.40 126.17 2wek s VAL 178 Ca -0.02 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.11 2wek s VAL 178 Cb -0.14 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2wek s VAL 178 CO 0.02 0.53 0.43 0.42 0.00 0.00 0.00 175.10 176.51 2wek s THR 179 N 1.01 4.55 -1.53 3.92 -4.23 -0.72 -1.39 115.64 117.26 2wek s THR 179 Ca -0.03 -0.97 -0.04 0.00 -1.18 0.00 0.00 61.69 59.47 2wek s THR 179 Cb -0.15 -3.59 0.04 0.00 1.34 0.00 0.00 72.50 70.13 2wek s THR 179 CO -0.05 -0.24 0.31 0.00 -0.54 0.00 0.00 174.62 174.10 2wek n ALA 180 N -1.57 -1.87 0.20 3.99 0.00 -1.23 -4.53 120.51 115.51 2wek n ALA 180 Ca -0.04 -0.29 0.07 0.00 0.00 0.00 0.00 53.44 53.18 2wek n ALA 180 Cb 0.58 -1.53 0.36 0.00 0.00 0.00 0.00 19.45 18.86 2wek n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wek h ALA 181 N 0.83 1.00 -0.55 0.00 0.00 -1.33 -2.34 119.26 116.88 2wek h ALA 181 Ca -0.64 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 53.97 2wek h ALA 181 Cb 1.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2wek h ALA 181 CO 0.69 0.43 0.00 0.00 0.00 0.00 0.00 179.25 180.37 2wek n ALA 182 N -2.28 2.59 -2.67 0.00 0.00 -1.26 -1.89 120.51 115.00 2wek n ALA 182 Ca -0.00 -1.07 0.00 0.00 0.00 0.00 0.00 53.44 52.36 2wek n ALA 182 Cb 0.49 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.96 2wek n ALA 182 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wek n GLY 183 N 1.27 1.67 0.21 0.00 0.00 -0.88 -0.05 105.19 107.40 2wek n GLY 183 Ca 0.19 -2.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.02 2wek n GLY 183 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wek h GLY 184 N 0.00 -0.31 1.01 -0.02 0.00 -1.81 -2.38 103.07 99.57 2wek h GLY 184 Ca 0.00 0.19 -0.26 0.00 0.00 0.00 0.00 47.33 47.26 2wek h GLY 184 CO 0.00 -0.16 -1.62 0.00 0.00 0.00 0.00 176.54 174.75 2wek h THR 185 N -0.33 0.79 -0.91 4.70 1.03 -1.88 -3.38 112.91 112.93 2wek h THR 185 Ca 0.02 -2.57 0.13 0.00 -0.01 0.00 0.00 66.41 63.97 2wek h THR 185 Cb 0.34 2.35 -0.09 0.00 -1.07 0.00 0.00 68.15 69.69 2wek h THR 185 CO -0.08 0.45 0.53 1.23 -0.01 0.00 0.00 175.52 177.64 2wek h GLY 186 N 3.54 1.48 1.69 2.99 0.00 -1.64 -1.27 103.07 109.86 2wek h GLY 186 Ca -0.25 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 46.72 2wek h GLY 186 CO 0.07 0.07 0.08 0.06 0.00 0.00 0.00 176.54 176.83 2wek h GLN 187 N 0.81 0.40 0.16 4.80 3.07 -0.83 -1.03 115.11 122.49 2wek h GLN 187 Ca 0.47 -0.05 -0.24 0.00 0.09 0.00 0.00 58.65 58.92 2wek h GLN 187 Cb 0.54 -0.08 0.03 0.00 0.08 0.00 0.00 27.48 28.05 2wek h GLN 187 CO -0.30 0.37 -1.03 0.74 0.09 0.00 0.00 178.83 178.70 2wek h PHE 188 N 0.40 0.73 -0.95 0.06 0.04 -1.47 -2.54 116.94 113.21 2wek h PHE 188 Ca 0.10 -0.51 0.09 0.00 2.80 0.00 0.00 57.97 60.45 2wek h PHE 188 Cb 0.14 -0.04 -0.07 0.00 2.20 0.00 0.00 35.95 38.18 2wek h PHE 188 CO 0.00 1.39 0.59 0.00 -0.60 0.00 0.00 178.31 179.69 2wek h ALA 189 N 0.14 1.37 0.49 2.45 0.00 -1.10 0.93 119.26 123.54 2wek h ALA 189 Ca -0.17 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2wek h ALA 189 Cb 1.80 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2wek h ALA 189 CO 0.20 0.27 -0.26 1.98 0.00 0.00 0.00 179.25 181.44 2wek h MET 190 N 1.01 -0.67 -0.33 0.00 1.85 -1.24 -2.21 114.93 113.33 2wek h MET 190 Ca 0.44 0.05 -0.09 0.00 -0.61 0.00 0.00 59.70 59.49 2wek h MET 190 Cb 0.32 0.15 -0.01 0.00 0.43 0.00 0.00 31.60 32.50 2wek h MET 190 CO -0.22 -0.45 -0.13 1.96 -0.40 0.00 0.00 176.91 177.67 2wek h GLN 191 N -0.70 0.67 -0.64 0.39 4.20 -0.97 -1.81 115.11 116.25 2wek h GLN 191 Ca -0.06 -0.28 -0.05 0.00 0.06 0.00 0.00 58.65 58.32 2wek h GLN 191 Cb 0.55 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.28 2wek h GLN 191 CO 0.09 0.86 0.20 -0.07 -0.67 0.00 0.00 178.83 179.24 2wek h LEU 192 N 0.44 0.91 -0.68 1.46 3.38 -0.91 -0.25 115.31 119.66 2wek h LEU 192 Ca 0.08 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2wek h LEU 192 Cb 0.65 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2wek h LEU 192 CO 0.04 0.85 -0.02 0.28 0.09 0.00 0.00 178.44 179.69 2wek h SER 193 N 0.95 0.99 -0.63 -0.43 0.02 -1.26 -1.48 113.55 111.69 2wek h SER 193 Ca 0.21 -0.28 -0.05 0.00 -0.84 0.00 0.00 61.79 60.84 2wek h SER 193 Cb 0.27 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 2wek h SER 193 CO -0.01 1.05 0.21 0.11 -1.14 0.00 0.00 176.83 177.05 2wek h LYS 194 N 0.92 0.97 -0.04 3.45 1.79 -0.84 -1.71 116.57 121.11 2wek h LYS 194 Ca 0.16 -0.20 -0.03 0.00 -2.18 0.00 0.00 60.65 58.40 2wek h LYS 194 Cb 0.56 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 2wek h LYS 194 CO 0.03 0.85 -0.12 0.87 -1.08 0.00 0.00 179.45 180.00 2wek h LYS 195 N 0.91 0.06 0.00 3.15 1.57 -0.74 -0.73 116.57 120.79 2wek h LYS 195 Ca 0.21 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2wek h LYS 195 Cb 0.27 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2wek h LYS 195 CO -0.01 0.19 0.00 0.00 -0.57 0.00 0.00 179.45 179.06 2wek n ALA 196 N -2.51 2.51 -2.30 3.86 0.00 -0.59 -4.89 120.51 116.59 2wek n ALA 196 Ca -0.02 -0.14 -0.11 0.00 0.00 0.00 0.00 53.44 53.18 2wek n ALA 196 Cb 0.21 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.31 2wek n ALA 196 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wek n LYS 197 N -0.89 -1.21 -2.61 0.00 5.02 -0.28 -3.53 118.16 114.67 2wek n LYS 197 Ca 0.16 0.50 -0.28 0.00 -2.02 0.00 0.00 58.31 56.68 2wek n LYS 197 Cb 0.07 -4.56 -0.00 0.00 -0.02 0.00 0.00 35.03 30.53 2wek n LYS 197 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wek s HIS 199 N -2.74 3.20 -0.13 0.00 2.46 0.21 -4.55 115.29 113.75 2wek s HIS 199 Ca 0.48 0.50 -0.01 0.00 0.47 0.00 0.00 55.06 56.50 2wek s HIS 199 Cb -0.10 -2.98 -0.02 0.00 -0.13 0.00 0.00 32.58 29.35 2wek s HIS 199 CO 0.44 -0.49 -0.09 0.08 -2.47 0.00 0.00 174.74 172.22 2wek s VAL 200 N 2.57 3.46 -0.10 0.89 1.01 -1.26 -1.31 120.40 125.65 2wek s VAL 200 Ca 0.24 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 2wek s VAL 200 Cb -0.15 -2.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 2wek s VAL 200 CO 0.12 0.52 -0.03 -0.63 0.00 0.00 0.00 175.10 175.09 2wek s ILE 201 N 0.17 4.01 -0.04 2.22 1.01 0.64 -1.20 121.20 128.01 2wek s ILE 201 Ca -0.05 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2wek s ILE 201 Cb -0.14 -2.70 0.02 0.00 0.01 0.00 0.00 42.46 39.65 2wek s ILE 201 CO 0.04 0.56 -0.04 -0.83 0.00 0.00 0.00 174.94 174.67 2wek s GLY 202 N -0.43 0.42 -0.08 6.18 0.00 -0.89 -0.80 107.32 111.71 2wek s GLY 202 Ca 0.07 -0.05 -0.07 0.00 0.00 0.00 0.00 44.72 44.67 2wek s GLY 202 CO 0.02 0.36 0.17 -0.51 0.00 0.00 0.00 173.10 173.15 2wek s THR 203 N 0.79 5.45 0.35 0.90 -4.23 -0.48 0.32 115.64 118.74 2wek s THR 203 Ca -0.10 0.17 -0.12 0.00 -1.18 0.00 0.00 61.69 60.46 2wek s THR 203 Cb -0.13 -3.46 0.03 0.00 1.34 0.00 0.00 72.50 70.28 2wek s THR 203 CO 0.00 0.54 0.66 0.00 -0.54 0.00 0.00 174.62 175.28 2wek n SER 205 N -1.24 2.80 -3.70 0.00 3.41 -1.26 -1.42 113.62 112.21 2wek n SER 205 Ca -0.04 -1.87 -0.10 0.00 -0.26 0.00 0.00 58.87 56.59 2wek n SER 205 Cb 0.60 -0.20 -0.05 0.00 -0.26 0.00 0.00 64.21 64.31 2wek n SER 205 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2wek s SER 206 N -1.02 -0.20 0.31 4.04 1.04 -1.26 -4.71 113.70 111.90 2wek s SER 206 Ca 0.24 -0.43 0.06 0.00 0.48 0.00 0.00 55.95 56.30 2wek s SER 206 Cb 0.13 0.50 0.51 0.00 0.10 0.00 0.00 66.02 67.26 2wek s SER 206 CO 0.18 -0.91 1.75 0.44 0.98 0.00 0.00 173.24 175.68 2wek h ASP 207 N 2.34 0.30 -0.09 7.02 3.32 -1.98 -0.92 116.42 126.42 2wek h ASP 207 Ca -0.32 -0.11 -0.13 0.00 0.02 0.00 0.00 57.03 56.50 2wek h ASP 207 Cb 1.25 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 2wek h ASP 207 CO 0.44 0.61 -0.36 -0.33 -1.72 0.00 0.00 179.24 177.88 2wek h GLU 208 N 0.26 0.59 -0.29 3.56 3.07 -1.99 -1.35 114.58 118.43 2wek h GLU 208 Ca 0.04 -0.28 -0.14 0.00 -0.50 0.00 0.00 59.36 58.48 2wek h GLU 208 Cb 0.68 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.58 2wek h GLU 208 CO 0.05 0.86 -0.39 0.87 -1.40 0.00 0.00 179.01 179.01 2wek h LYS 209 N 0.50 0.68 -0.74 2.33 1.57 -1.88 -2.21 116.57 116.82 2wek h LYS 209 Ca 0.05 -0.34 -0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2wek h LYS 209 Cb 0.85 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.13 2wek h LYS 209 CO 0.07 0.95 0.46 0.77 -0.57 0.00 0.00 179.45 181.13 2wek h SER 210 N 0.56 0.88 -0.20 0.86 0.02 -0.89 -0.53 113.55 114.25 2wek h SER 210 Ca 0.05 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 2wek h SER 210 Cb 0.92 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 2wek h SER 210 CO 0.08 0.67 -0.18 0.00 -1.14 0.00 0.00 176.83 176.26 2wek h ALA 211 N 1.49 1.05 -0.11 3.77 0.00 -1.12 0.59 119.26 124.92 2wek h ALA 211 Ca 0.27 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2wek h ALA 211 Cb -0.06 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2wek h ALA 211 CO -0.05 0.58 0.02 0.35 0.00 0.00 0.00 179.25 180.14 2wek h PHE 212 N 0.56 0.19 -0.62 0.00 3.57 -0.75 -1.75 116.94 118.14 2wek h PHE 212 Ca 0.09 -0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.64 2wek h PHE 212 Cb 0.63 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.26 2wek h PHE 212 CO 0.03 0.38 0.29 -0.07 -2.23 0.00 0.00 178.31 176.70 2wek h LEU 213 N -0.05 0.38 -0.82 0.59 3.38 -0.89 -1.57 115.31 116.32 2wek h LEU 213 Ca 0.03 0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.15 2wek h LEU 213 Cb 0.29 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 2wek h LEU 213 CO 0.00 0.23 0.47 0.50 0.09 0.00 0.00 178.44 179.74 2wek h LYS 214 N 0.53 0.78 0.00 1.13 1.63 -0.70 -1.76 116.57 118.18 2wek h LYS 214 Ca 0.30 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 60.05 2wek h LYS 214 Cb 0.29 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 31.74 2wek h LYS 214 CO -0.24 0.51 -0.02 0.66 -3.45 0.00 0.00 179.45 176.91 2wek h SER 215 N 0.80 0.00 -0.01 4.20 4.64 -0.38 -0.53 113.55 122.27 2wek h SER 215 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2wek h SER 215 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2wek h SER 215 CO -0.24 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 175.92 2wek n LEU 216 N -3.12 0.58 0.00 5.97 4.77 -0.75 -4.92 117.00 119.53 2wek n LEU 216 Ca 0.01 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 2wek n LEU 216 Cb 0.36 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2wek n LEU 216 CO 0.29 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2wek n GLY 217 N 1.07 0.87 3.69 -0.72 0.00 -0.21 -4.77 105.19 105.13 2wek n GLY 217 Ca 0.22 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.80 2wek n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wek h ASP 219 N 6.77 0.70 -2.32 0.00 3.32 -1.50 -3.41 116.42 119.98 2wek h ASP 219 Ca -0.44 -0.47 -0.54 0.00 0.02 0.00 0.00 57.03 55.60 2wek h ASP 219 Cb 1.23 -0.21 -0.36 0.00 0.22 0.00 0.00 39.33 40.21 2wek h ASP 219 CO 0.93 1.24 -0.87 -0.60 -1.72 0.00 0.00 179.24 178.22 2wek s ARG 220 N -3.62 0.75 0.36 3.56 6.06 -0.77 -5.02 118.95 120.28 2wek s ARG 220 Ca -0.08 -1.64 -0.26 0.00 -2.50 0.00 0.00 55.73 51.25 2wek s ARG 220 Cb 0.09 -1.22 -0.09 0.00 0.06 0.00 0.00 34.95 33.80 2wek s ARG 220 CO 0.87 -1.30 1.11 -2.14 -2.50 0.00 0.00 175.30 171.34 2wek s PRO 221 N 0.61 4.29 -0.09 5.12 0.02 -1.26 -2.10 135.00 141.59 2wek s PRO 221 Ca 0.26 1.72 0.00 0.00 0.02 0.00 0.00 61.00 63.00 2wek s PRO 221 Cb -0.08 -2.80 0.02 0.00 0.02 0.00 0.00 34.50 31.66 2wek s PRO 221 CO -0.10 -0.08 -0.08 0.42 -0.33 0.00 0.00 177.00 176.83 2wek s ILE 222 N -1.41 0.98 -0.66 2.83 1.01 0.15 -4.91 121.20 119.18 2wek s ILE 222 Ca 0.53 -0.30 -0.23 0.00 0.00 0.00 0.00 60.65 60.66 2wek s ILE 222 Cb -0.28 -0.98 0.07 0.00 0.01 0.00 0.00 42.46 41.27 2wek s ILE 222 CO 0.36 0.35 0.98 0.21 0.00 0.00 0.00 174.94 176.84 2wek s ASN 223 N 1.43 6.18 0.03 3.58 3.84 -1.26 -1.39 114.94 127.35 2wek s ASN 223 Ca -0.01 -0.93 0.17 0.00 0.21 0.00 0.00 52.86 52.30 2wek s ASN 223 Cb -0.13 -2.43 0.73 0.00 -0.55 0.00 0.00 41.25 38.87 2wek s ASN 223 CO -0.05 -1.46 1.55 0.00 -2.79 0.00 0.00 177.10 174.36 2wek n TYR 224 N 7.79 0.11 0.10 0.43 0.18 -0.51 -0.95 117.16 124.32 2wek n TYR 224 Ca -0.03 0.04 -0.03 0.00 1.88 0.00 0.00 57.90 59.76 2wek n TYR 224 Cb 0.46 -0.57 -0.05 0.00 -0.38 0.00 0.00 39.34 38.80 2wek n TYR 224 CO 0.00 0.00 0.00 0.87 -2.08 0.00 0.00 176.86 175.65 2wek h LYS 225 N 0.00 0.00 -0.00 -3.48 1.79 -1.84 -3.38 116.57 109.66 2wek h LYS 225 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2wek h LYS 225 Cb 0.30 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 2wek h LYS 225 CO 0.00 0.77 -0.34 0.25 -1.08 0.00 0.00 179.45 179.05 2wek n THR 226 N -3.30 0.00 -3.68 -0.16 -2.24 -0.42 -4.97 114.28 99.51 2wek n THR 226 Ca 0.01 -0.33 -0.15 0.00 -2.27 0.00 0.00 64.05 61.31 2wek n THR 226 Cb 0.84 1.01 -0.14 0.00 -2.10 0.00 0.00 70.33 69.94 2wek n THR 226 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2wek s GLU 227 N -1.65 0.09 -0.16 -0.78 2.12 -0.12 -5.06 118.70 113.14 2wek s GLU 227 Ca 0.03 0.62 -0.29 0.00 0.36 0.00 0.00 54.97 55.69 2wek s GLU 227 Cb 0.06 -0.17 -0.05 0.00 0.26 0.00 0.00 34.13 34.23 2wek s GLU 227 CO 0.30 -0.28 1.82 -1.25 -0.54 0.00 0.00 175.26 175.31 2wek s PRO 228 N 2.19 3.75 0.27 4.30 0.04 -1.26 -4.21 135.00 140.08 2wek s PRO 228 Ca 0.01 1.96 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2wek s PRO 228 Cb -0.12 -4.13 0.54 0.00 0.04 0.00 0.00 34.50 30.83 2wek s PRO 228 CO -0.07 -1.37 1.82 0.28 0.04 0.00 0.00 177.00 177.70 2wek h VAL 229 N 6.22 0.87 -0.31 -0.36 2.07 -1.93 -2.04 116.25 120.78 2wek h VAL 229 Ca -0.39 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 66.87 2wek h VAL 229 Cb 1.19 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 2wek h VAL 229 CO 0.98 0.16 0.06 1.23 0.02 0.00 0.00 177.57 180.03 2wek h GLY 230 N 0.89 0.35 1.07 2.17 0.00 -1.96 -1.44 103.07 104.14 2wek h GLY 230 Ca 0.48 -0.02 -0.09 0.00 0.00 0.00 0.00 47.33 47.69 2wek h GLY 230 CO -0.29 -0.01 -0.01 -0.84 0.00 0.00 0.00 176.54 175.39 2wek h THR 231 N 0.18 1.27 -0.22 4.70 2.02 -1.79 -1.71 112.91 117.35 2wek h THR 231 Ca 0.14 -1.15 0.03 0.00 0.77 0.00 0.00 66.41 66.20 2wek h THR 231 Cb 0.15 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 2wek h THR 231 CO -0.18 0.41 0.05 0.58 0.37 0.00 0.00 175.52 176.75 2wek h VAL 232 N 0.91 0.91 -0.27 3.16 2.07 -0.94 -1.19 116.25 120.90 2wek h VAL 232 Ca 0.16 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 2wek h VAL 232 Cb 0.56 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2wek h VAL 232 CO 0.03 0.03 0.08 -0.07 0.02 0.00 0.00 177.57 177.65 2wek h LEU 233 N 0.14 0.41 -1.17 2.57 3.38 -1.11 -0.07 115.31 119.46 2wek h LEU 233 Ca 0.10 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 2wek h LEU 233 Cb 0.09 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2wek h LEU 233 CO -0.12 0.51 -0.04 0.11 0.09 0.00 0.00 178.44 178.99 2wek h LYS 234 N 0.28 0.52 0.08 1.13 1.57 -1.23 0.20 116.57 119.12 2wek h LYS 234 Ca 0.09 -0.13 -0.30 0.00 -1.87 0.00 0.00 60.65 58.44 2wek h LYS 234 Cb 0.26 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 2wek h LYS 234 CO -0.00 0.58 -1.59 1.96 -0.57 0.00 0.00 179.45 179.83 2wek h GLN 235 N 0.50 0.17 0.00 3.15 4.20 -1.06 -3.34 115.11 118.72 2wek h GLN 235 Ca 0.10 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.52 2wek h GLN 235 Cb 0.39 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2wek h GLN 235 CO 0.02 0.97 -1.46 0.39 -0.67 0.00 0.00 178.83 178.07 2wek n GLU 236 N -3.35 0.83 -2.81 1.46 1.02 -0.05 -4.66 120.64 113.08 2wek n GLU 236 Ca -0.17 -0.11 -0.19 0.00 -0.02 0.00 0.00 57.16 56.67 2wek n GLU 236 Cb 1.04 -1.31 -0.01 0.00 -0.02 0.00 0.00 31.44 31.14 2wek n GLU 236 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2wek n TYR 237 N -1.87 2.05 0.23 -0.32 4.01 0.69 -4.95 117.16 117.01 2wek n TYR 237 Ca -0.02 -3.39 0.07 0.00 -0.16 0.00 0.00 57.90 54.40 2wek n TYR 237 Cb 0.34 -0.34 0.60 0.00 -0.31 0.00 0.00 39.34 39.63 2wek n TYR 237 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2wek h PRO 238 N 2.90 0.05 -0.00 -0.72 0.13 -1.68 0.29 132.00 132.96 2wek h PRO 238 Ca 0.10 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2wek h PRO 238 Cb 0.92 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.04 2wek h PRO 238 CO 0.65 0.06 -0.05 0.39 -0.23 0.00 0.00 178.00 178.82 2wek n GLU 239 N -4.50 0.95 0.00 0.86 1.02 -1.26 -5.03 120.64 112.68 2wek n GLU 239 Ca -0.02 -0.30 0.00 0.00 -0.02 0.00 0.00 57.16 56.82 2wek n GLU 239 Cb 0.11 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2wek n GLU 239 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wek n GLY 240 N 1.18 -2.41 3.49 0.62 0.00 0.10 -4.23 105.19 103.95 2wek n GLY 240 Ca 0.18 -1.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.05 2wek n GLY 240 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wek s VAL 241 N -0.32 2.91 0.03 1.61 -7.23 0.47 -4.61 120.40 113.27 2wek s VAL 241 Ca 0.00 -1.32 0.04 0.00 -1.81 0.00 0.00 61.98 58.88 2wek s VAL 241 Cb 0.00 -2.29 -0.25 0.00 0.56 0.00 0.00 36.38 34.40 2wek s VAL 241 CO 0.00 0.21 0.96 0.44 -0.31 0.00 0.00 175.10 176.39 2wek h ASP 242 N 4.07 0.18 -3.74 4.85 3.32 -1.32 0.12 116.42 123.91 2wek h ASP 242 Ca -0.49 -0.25 -0.21 0.00 0.02 0.00 0.00 57.03 56.10 2wek h ASP 242 Cb 1.16 -0.06 -0.27 0.00 0.22 0.00 0.00 39.33 40.38 2wek h ASP 242 CO 0.48 1.21 -0.60 -0.69 -1.72 0.00 0.00 179.24 177.91 2wek s VAL 243 N -2.64 -0.00 -0.10 -1.35 1.01 -0.65 -1.29 120.40 115.37 2wek s VAL 243 Ca -0.05 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.97 2wek s VAL 243 Cb 0.08 -0.15 0.01 0.00 0.00 0.00 0.00 36.38 36.32 2wek s VAL 243 CO 0.84 0.01 -0.16 -0.69 0.00 0.00 0.00 175.10 175.09 2wek s VAL 244 N 0.14 1.54 -0.60 2.92 1.01 -0.33 -0.52 120.40 124.56 2wek s VAL 244 Ca -0.01 -0.68 -0.15 0.00 0.00 0.00 0.00 61.98 61.15 2wek s VAL 244 Cb -0.02 -1.39 0.15 0.00 0.00 0.00 0.00 36.38 35.12 2wek s VAL 244 CO -0.00 0.45 0.55 -0.47 0.00 0.00 0.00 175.10 175.62 2wek s TYR 245 N 0.87 3.38 -0.31 5.22 5.04 0.13 -0.10 117.35 131.59 2wek s TYR 245 Ca -0.09 -1.52 -0.07 0.00 -2.44 0.00 0.00 57.07 52.96 2wek s TYR 245 Cb -0.15 -3.77 0.02 0.00 0.35 0.00 0.00 41.96 38.40 2wek s TYR 245 CO 0.00 -1.01 0.09 -2.00 -1.34 0.00 0.00 175.55 171.30 2wek s GLU 246 N 1.23 2.96 0.00 4.97 -6.30 -0.39 -1.75 118.70 119.42 2wek s GLU 246 Ca 0.07 -0.95 0.11 0.00 -2.50 0.00 0.00 54.97 51.70 2wek s GLU 246 Cb -0.25 -3.42 -0.06 0.00 0.00 0.00 0.00 34.13 30.40 2wek s GLU 246 CO -0.00 -0.51 0.56 0.43 0.02 0.00 0.00 175.26 175.76 2wek n SER 247 N 4.86 0.89 -0.10 -1.70 7.64 -1.25 -1.23 113.62 122.72 2wek n SER 247 Ca -0.14 -0.94 -0.21 0.00 1.01 0.00 0.00 58.87 58.59 2wek n SER 247 Cb 0.47 0.74 -0.08 0.00 -1.01 0.00 0.00 64.21 64.34 2wek n SER 247 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2wek n VAL 248 N -0.76 1.14 -2.28 0.44 0.31 -1.22 -1.45 118.33 114.50 2wek n VAL 248 Ca 0.03 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 2wek n VAL 248 Cb 0.20 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 2wek n VAL 248 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wek n GLY 249 N 1.86 -1.86 7.00 2.92 0.00 -1.26 -0.98 105.19 112.86 2wek n GLY 249 Ca -0.40 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 43.94 2wek n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wek n GLY 250 N 0.00 3.17 0.35 -0.02 0.00 -1.26 -2.13 105.19 105.30 2wek n GLY 250 Ca 0.00 -0.14 0.05 0.00 0.00 0.00 0.00 46.02 45.93 2wek n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wek h ALA 251 N -0.76 1.62 -0.33 4.61 0.00 -1.95 -1.06 119.26 121.39 2wek h ALA 251 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2wek h ALA 251 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2wek h ALA 251 CO 0.00 0.28 0.02 1.98 0.00 0.00 0.00 179.25 181.53 2wek h MET 252 N 0.85 0.57 -0.51 0.00 1.85 -1.82 -1.38 114.93 114.50 2wek h MET 252 Ca 0.31 -0.17 0.06 0.00 -0.61 0.00 0.00 59.70 59.29 2wek h MET 252 Cb 0.16 -0.06 -0.05 0.00 0.43 0.00 0.00 31.60 32.08 2wek h MET 252 CO -0.10 0.68 0.22 0.35 -0.40 0.00 0.00 176.91 177.66 2wek h PHE 253 N 0.38 0.39 -0.49 1.39 3.57 -1.06 -0.48 116.94 120.64 2wek h PHE 253 Ca 0.10 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.64 2wek h PHE 253 Cb 0.41 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 2wek h PHE 253 CO 0.03 0.16 0.29 -0.44 -2.23 0.00 0.00 178.31 176.12 2wek h ASP 254 N 0.42 0.46 -0.81 0.41 3.32 -0.87 -1.14 116.42 118.22 2wek h ASP 254 Ca 0.24 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 2wek h ASP 254 Cb 0.21 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.63 2wek h ASP 254 CO -0.21 0.33 0.47 -0.07 -1.72 0.00 0.00 179.24 178.04 2wek h LEU 255 N 0.58 0.99 -0.22 1.55 3.38 -0.96 -2.66 115.31 117.97 2wek h LEU 255 Ca 0.20 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2wek h LEU 255 Cb 0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2wek h LEU 255 CO -0.09 0.78 0.11 0.00 0.09 0.00 0.00 178.44 179.33 2wek h ALA 256 N 1.25 0.29 -0.26 1.53 0.00 -0.32 -1.62 119.26 120.13 2wek h ALA 256 Ca 0.29 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.18 2wek h ALA 256 Cb -0.01 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 2wek h ALA 256 CO -0.05 -0.17 -0.16 0.28 0.00 0.00 0.00 179.25 179.16 2wek h VAL 257 N 0.24 0.54 -0.08 0.00 2.07 -1.14 -1.37 116.25 116.51 2wek h VAL 257 Ca 0.08 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 2wek h VAL 257 Cb 0.10 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2wek h VAL 257 CO -0.01 0.00 0.04 0.44 0.02 0.00 0.00 177.57 178.06 2wek h ASP 258 N -0.14 0.09 0.91 0.57 3.32 -1.16 -2.77 116.42 117.24 2wek h ASP 258 Ca 0.14 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2wek h ASP 258 Cb 0.35 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2wek h ASP 258 CO -0.34 0.08 -0.26 0.00 -1.72 0.00 0.00 179.24 177.00 2wek n ALA 259 N -2.53 2.78 -1.74 3.45 0.00 -0.56 -4.92 120.51 117.00 2wek n ALA 259 Ca -0.02 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 2wek n ALA 259 Cb 0.09 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.21 2wek n ALA 259 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wek n LEU 260 N -1.73 4.27 -4.80 0.00 4.77 -0.95 -0.39 117.00 118.16 2wek n LEU 260 Ca 0.06 1.15 -0.30 0.00 -0.03 0.00 0.00 56.01 56.89 2wek n LEU 260 Cb 0.37 -1.58 0.10 0.00 -2.33 0.00 0.00 43.42 39.98 2wek n LEU 260 CO 0.32 0.11 0.71 0.00 -1.33 0.00 0.00 177.39 177.20 2wek s ALA 261 N 0.01 2.11 0.15 -1.18 0.00 0.43 -4.60 121.76 118.68 2wek s ALA 261 Ca 0.64 -0.30 -0.34 0.00 0.00 0.00 0.00 51.96 51.96 2wek s ALA 261 Cb -0.51 -3.08 -0.15 0.00 0.00 0.00 0.00 23.12 19.38 2wek s ALA 261 CO 0.48 -1.89 1.42 2.41 0.00 0.00 0.00 175.76 178.18 2wek n THR 262 N -3.53 0.29 -1.09 0.00 -1.04 -1.26 -0.47 114.28 107.18 2wek n THR 262 Ca 0.07 -0.07 -0.03 0.00 -2.04 0.00 0.00 64.05 61.97 2wek n THR 262 Cb 0.57 -1.22 -0.01 0.00 -1.82 0.00 0.00 70.33 67.85 2wek n THR 262 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2wek n LYS 263 N 2.67 -1.23 -1.29 -2.82 5.02 0.43 -5.00 118.16 115.93 2wek n LYS 263 Ca 0.16 0.48 -0.32 0.00 -2.02 0.00 0.00 58.31 56.60 2wek n LYS 263 Cb 0.26 -4.48 0.10 0.00 -0.02 0.00 0.00 35.03 30.88 2wek n LYS 263 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2wek s GLY 264 N -2.19 1.96 -0.06 0.72 0.00 0.38 -4.79 107.32 103.34 2wek s GLY 264 Ca 0.00 0.56 0.02 0.00 0.00 0.00 0.00 44.72 45.30 2wek s GLY 264 CO 0.00 0.94 -0.10 1.09 0.00 0.00 0.00 173.10 175.03 2wek s ARG 265 N -4.40 1.46 -0.24 2.90 1.70 -0.41 -0.95 118.95 119.00 2wek s ARG 265 Ca 0.67 -0.33 -0.07 0.00 -0.47 0.00 0.00 55.73 55.53 2wek s ARG 265 Cb -0.22 -1.25 -0.03 0.00 -0.57 0.00 0.00 34.95 32.89 2wek s ARG 265 CO 0.50 -0.00 0.06 -1.17 -1.08 0.00 0.00 175.30 173.61 2wek s LEU 266 N 0.72 3.38 -0.29 -1.89 0.20 0.03 -1.18 118.68 119.65 2wek s LEU 266 Ca -0.14 -0.22 -0.15 0.00 0.69 0.00 0.00 54.13 54.30 2wek s LEU 266 Cb -0.15 -1.90 -0.03 0.00 -0.43 0.00 0.00 46.19 43.68 2wek s LEU 266 CO 0.03 -0.03 0.40 -0.63 -0.29 0.00 0.00 176.35 175.83 2wek s ILE 267 N 1.57 5.15 -0.68 6.68 1.01 0.86 -0.10 121.20 135.69 2wek s ILE 267 Ca 0.06 0.47 -0.23 0.00 0.00 0.00 0.00 60.65 60.94 2wek s ILE 267 Cb -0.15 -3.76 0.06 0.00 0.01 0.00 0.00 42.46 38.62 2wek s ILE 267 CO 0.03 0.06 1.04 -0.69 0.00 0.00 0.00 174.94 175.38 2wek s VAL 268 N 2.12 4.19 0.00 2.92 1.01 0.91 -1.27 120.40 130.29 2wek s VAL 268 Ca 0.15 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2wek s VAL 268 Cb -0.16 -4.74 -0.26 0.00 0.00 0.00 0.00 36.38 31.23 2wek s VAL 268 CO 0.11 -1.55 0.84 0.40 0.00 0.00 0.00 175.10 174.90 2wek h ILE 269 N 5.99 1.13 -1.79 2.22 1.08 -1.46 -2.13 117.51 122.55 2wek h ILE 269 Ca -0.28 -2.84 0.31 0.00 -0.39 0.00 0.00 64.86 61.66 2wek h ILE 269 Cb 1.06 2.68 -0.06 0.00 -3.07 0.00 0.00 36.82 37.44 2wek h ILE 269 CO 1.20 0.77 0.77 0.61 -0.69 0.00 0.00 178.15 180.82 2wek n GLY 270 N 1.62 0.18 2.43 5.37 0.00 -1.03 -4.90 105.19 108.84 2wek n GLY 270 Ca -0.15 -0.97 -0.16 0.00 0.00 0.00 0.00 46.02 44.74 2wek n GLY 270 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2wek n PHE 271 N -0.75 -1.47 0.13 1.61 1.16 -1.15 -3.41 117.46 113.59 2wek n PHE 271 Ca 0.05 -2.89 0.17 0.00 -1.87 0.00 0.00 57.45 52.91 2wek n PHE 271 Cb 0.44 0.47 0.75 0.00 -1.61 0.00 0.00 39.48 39.53 2wek n PHE 271 CO 0.00 0.00 0.00 0.97 -1.87 0.00 0.00 176.76 175.86 2wek h ILE 272 N 2.22 0.63 -0.05 1.97 2.10 -0.63 -0.52 117.51 123.24 2wek h ILE 272 Ca -0.01 0.00 0.01 0.00 1.08 0.00 0.00 64.86 65.94 2wek h ILE 272 Cb 0.97 0.81 -0.00 0.00 -1.09 0.00 0.00 36.82 37.51 2wek h ILE 272 CO 0.38 0.00 0.09 0.77 -1.08 0.00 0.00 178.15 178.31 2wek h SER 273 N 0.00 0.00 0.28 2.19 4.64 -1.34 -2.82 113.55 116.50 2wek h SER 273 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2wek h SER 273 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2wek h SER 273 CO -0.00 0.00 -1.13 0.61 -0.87 0.00 0.00 176.83 175.44 2wek n GLY 274 N -1.24 -1.13 0.21 -0.77 0.00 -0.20 -4.66 105.19 97.39 2wek n GLY 274 Ca -0.02 -0.46 0.02 0.00 0.00 0.00 0.00 46.02 45.56 2wek n GLY 274 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2wek h TYR 275 N 0.00 0.12 0.00 1.61 0.05 -1.50 -2.45 116.97 114.80 2wek h TYR 275 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.76 2wek h TYR 275 Cb 0.70 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.41 2wek h TYR 275 CO 0.00 0.39 0.00 1.96 -1.05 0.00 0.00 178.16 179.46 2wek h GLN 276 N 0.10 0.00 -7.49 4.88 4.20 -1.83 -3.41 115.11 111.56 2wek h GLN 276 Ca 0.01 0.00 -0.47 0.00 0.06 0.00 0.00 58.65 58.25 2wek h GLN 276 Cb 0.56 0.00 0.12 0.00 0.30 0.00 0.00 27.48 28.46 2wek h GLN 276 CO 0.04 0.00 0.34 0.95 -0.67 0.00 0.00 178.83 179.49 2wek s THR 277 N -3.35 2.40 0.33 -0.54 -4.23 -0.93 -4.82 115.64 104.50 2wek s THR 277 Ca 0.05 0.13 0.01 0.00 -1.18 0.00 0.00 61.69 60.70 2wek s THR 277 Cb 0.09 -2.94 0.24 0.00 1.34 0.00 0.00 72.50 71.23 2wek s THR 277 CO 0.54 -0.17 1.97 -0.65 -0.54 0.00 0.00 174.62 175.77 2wek h PRO 278 N -1.25 0.85 0.00 3.99 0.11 -1.89 -2.90 132.00 130.92 2wek h PRO 278 Ca -0.48 -0.07 -0.11 0.00 0.11 0.00 0.00 66.00 65.44 2wek h PRO 278 Cb 1.31 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2wek h PRO 278 CO 0.62 0.60 -1.09 1.79 -0.21 0.00 0.00 178.00 179.72 2wek h THR 279 N 0.87 0.41 0.00 -1.15 1.35 -1.93 -3.48 112.91 108.98 2wek h THR 279 Ca 0.23 -1.74 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 2wek h THR 279 Cb -0.02 1.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2wek h THR 279 CO -0.04 0.23 0.00 0.61 -0.25 0.00 0.00 175.52 176.07 2wek n GLY 280 N 1.30 0.67 3.81 5.82 0.00 -1.10 -5.07 105.19 110.62 2wek n GLY 280 Ca -0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 2wek n GLY 280 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wek s LEU 281 N 0.00 3.87 -0.05 0.99 1.43 -1.17 -3.35 118.68 120.40 2wek s LEU 281 Ca 0.00 -0.07 0.06 0.00 -1.03 0.00 0.00 54.13 53.08 2wek s LEU 281 Cb 0.00 -2.49 -0.02 0.00 0.03 0.00 0.00 46.19 43.71 2wek s LEU 281 CO 0.00 0.08 -0.22 -0.55 0.23 0.00 0.00 176.35 175.90 2wek s SER 282 N -3.00 3.37 0.17 2.29 0.15 -1.26 -4.52 113.70 110.90 2wek s SER 282 Ca 0.31 -0.41 -0.31 0.00 0.70 0.00 0.00 55.95 56.25 2wek s SER 282 Cb -0.11 -0.76 -0.09 0.00 -1.71 0.00 0.00 66.02 63.35 2wek s SER 282 CO 0.24 0.28 1.39 -2.16 1.20 0.00 0.00 173.24 174.19 2wek s PRO 283 N -0.39 4.32 0.21 5.44 0.05 -1.26 -4.47 135.00 138.90 2wek s PRO 283 Ca 0.03 2.13 0.09 0.00 0.05 0.00 0.00 61.00 63.31 2wek s PRO 283 Cb -0.12 -3.20 -0.05 0.00 0.05 0.00 0.00 34.50 31.19 2wek s PRO 283 CO 0.02 -0.39 -0.18 0.14 0.05 0.00 0.00 177.00 176.64 2wek s VAL 284 N 0.58 2.02 -1.11 -0.36 -7.23 -1.26 -4.22 120.40 108.81 2wek s VAL 284 Ca 0.62 -2.13 -0.19 0.00 -1.81 0.00 0.00 61.98 58.46 2wek s VAL 284 Cb -0.38 -2.04 0.09 0.00 0.56 0.00 0.00 36.38 34.61 2wek s VAL 284 CO 0.35 -0.39 1.46 -0.54 -0.31 0.00 0.00 175.10 175.67 2wek s LYS 285 N -3.19 3.79 -0.05 4.82 1.02 -1.26 -4.76 119.74 120.12 2wek s LYS 285 Ca 0.22 -1.76 0.21 0.00 0.02 0.00 0.00 55.97 54.66 2wek s LYS 285 Cb -0.04 -5.27 -0.31 0.00 -0.52 0.00 0.00 37.83 31.69 2wek s LYS 285 CO 0.09 -2.05 0.43 0.00 -0.92 0.00 0.00 175.35 172.90 2wek n ALA 286 N 7.69 2.58 -0.33 5.17 0.00 -1.26 -4.22 120.51 130.14 2wek n ALA 286 Ca 0.36 -0.65 0.03 0.00 0.00 0.00 0.00 53.44 53.18 2wek n ALA 286 Cb 0.48 -0.67 0.20 0.00 0.00 0.00 0.00 19.45 19.46 2wek n ALA 286 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2wek h GLY 287 N 4.00 1.39 -1.44 0.00 0.00 -2.06 -1.61 103.07 103.34 2wek h GLY 287 Ca -0.09 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2wek h GLY 287 CO 0.01 0.35 0.00 -1.30 0.00 0.00 0.00 176.54 175.59 2wek n THR 288 N -4.47 0.35 -0.02 4.70 -2.24 -1.26 -4.60 114.28 106.73 2wek n THR 288 Ca 0.14 -0.51 -0.12 0.00 -2.27 0.00 0.00 64.05 61.28 2wek n THR 288 Cb 0.16 0.59 -0.08 0.00 -2.10 0.00 0.00 70.33 68.90 2wek n THR 288 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2wek h LEU 289 N 3.09 0.11 -1.10 3.22 5.85 -1.46 -1.68 115.31 123.33 2wek h LEU 289 Ca 0.00 -0.33 0.11 0.00 0.84 0.00 0.00 57.88 58.50 2wek h LEU 289 Cb 0.68 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.61 2wek h LEU 289 CO 0.00 0.41 0.61 -0.65 -0.34 0.00 0.00 178.44 178.47 2wek h PRO 290 N -0.20 0.93 -0.57 5.25 0.11 -1.81 -1.43 132.00 134.28 2wek h PRO 290 Ca 0.02 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2wek h PRO 290 Cb 0.36 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.23 2wek h PRO 290 CO 0.00 0.62 0.36 0.00 -0.21 0.00 0.00 178.00 178.77 2wek h ALA 291 N 1.54 0.73 -0.38 -0.75 0.00 -1.80 -1.35 119.26 117.25 2wek h ALA 291 Ca 0.45 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.20 2wek h ALA 291 Cb 0.43 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2wek h ALA 291 CO -0.21 0.19 -0.21 0.87 0.00 0.00 0.00 179.25 179.88 2wek h LYS 292 N 0.77 0.73 -0.19 0.00 1.57 -0.45 -1.83 116.57 117.18 2wek h LYS 292 Ca 0.21 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 2wek h LYS 292 Cb -0.06 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 2wek h LYS 292 CO -0.04 0.88 -0.23 -0.07 -0.57 0.00 0.00 179.45 179.42 2wek h LEU 293 N 0.64 0.52 -0.01 2.94 3.38 -1.13 -2.75 115.31 118.92 2wek h LEU 293 Ca 0.09 -0.50 0.03 0.00 0.09 0.00 0.00 57.88 57.59 2wek h LEU 293 Cb 0.71 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 2wek h LEU 293 CO 0.05 0.92 -0.18 0.25 0.09 0.00 0.00 178.44 179.57 2wek h LEU 294 N 0.14 -0.53 -2.64 1.67 6.46 -1.18 0.52 115.31 119.76 2wek h LEU 294 Ca 0.02 0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.86 2wek h LEU 294 Cb 0.79 0.22 -0.00 0.00 -0.73 0.00 0.00 40.66 40.94 2wek h LEU 294 CO 0.05 -0.24 -0.01 0.11 -0.62 0.00 0.00 178.44 177.73 2wek h LYS 295 N -0.29 0.00 -0.15 1.25 6.56 -1.23 -1.63 116.57 121.08 2wek h LYS 295 Ca 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.65 2wek h LYS 295 Cb 0.37 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.03 2wek h LYS 295 CO -0.18 0.01 0.00 1.63 -2.06 0.00 0.00 179.45 178.85 2wek n LYS 296 N -3.43 1.60 -4.32 3.15 5.02 -1.05 -4.99 118.16 114.15 2wek n LYS 296 Ca -0.03 -1.50 -0.37 0.00 -2.02 0.00 0.00 58.31 54.39 2wek n LYS 296 Cb 0.10 -1.19 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 2wek n LYS 296 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2wek n SER 297 N 0.40 -2.38 -4.91 4.39 7.64 -0.02 -0.43 113.62 118.30 2wek n SER 297 Ca 0.07 -1.10 -0.20 0.00 1.01 0.00 0.00 58.87 58.65 2wek n SER 297 Cb 0.31 -2.34 -0.02 0.00 -1.01 0.00 0.00 64.21 61.15 2wek n SER 297 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wek s ALA 298 N -3.39 4.18 0.08 -0.43 0.00 -0.06 -3.59 121.76 118.56 2wek s ALA 298 Ca 0.68 -1.83 0.01 0.00 0.00 0.00 0.00 51.96 50.82 2wek s ALA 298 Cb -0.38 -1.17 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 2wek s ALA 298 CO 0.96 -0.24 -0.06 -1.54 0.00 0.00 0.00 175.76 174.88 2wek s SER 299 N -4.18 1.02 -0.14 0.00 1.04 -0.12 -4.68 113.70 106.62 2wek s SER 299 Ca 0.50 -0.94 0.01 0.00 0.48 0.00 0.00 55.95 55.99 2wek s SER 299 Cb -0.05 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.19 2wek s SER 299 CO 0.29 -0.45 -0.15 -0.69 0.98 0.00 0.00 173.24 173.22 2wek s VAL 300 N -3.36 1.63 -0.11 5.02 1.01 -1.26 -0.79 120.40 122.54 2wek s VAL 300 Ca 0.08 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2wek s VAL 300 Cb 0.04 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.93 2wek s VAL 300 CO -0.05 0.47 -0.11 -1.58 0.00 0.00 0.00 175.10 173.83 2wek s GLN 301 N 1.30 1.83 0.52 2.72 2.00 0.86 -4.95 119.66 123.95 2wek s GLN 301 Ca 0.01 -0.39 -0.11 0.00 -2.00 0.00 0.00 55.36 52.88 2wek s GLN 301 Cb -0.13 -1.72 -0.05 0.00 0.80 0.00 0.00 33.01 31.90 2wek s GLN 301 CO -0.08 -0.19 0.91 0.20 -0.50 0.00 0.00 175.29 175.64 2wek s GLY 302 N 1.39 1.76 -0.06 2.59 0.00 -1.26 -0.06 107.32 111.69 2wek s GLY 302 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 44.72 44.57 2wek s GLY 302 CO -0.06 0.08 0.00 -0.12 0.00 0.00 0.00 173.10 173.00 2wek s PHE 303 N -2.81 0.56 -0.18 1.90 5.36 -0.80 -4.84 117.98 117.17 2wek s PHE 303 Ca 0.53 -0.10 0.00 0.00 -0.96 0.00 0.00 56.93 56.41 2wek s PHE 303 Cb -0.10 -0.68 0.02 0.00 -0.34 0.00 0.00 43.02 41.91 2wek s PHE 303 CO 0.43 -0.26 -0.18 0.12 -1.46 0.00 0.00 175.22 173.87 2wek s PHE 304 N 1.68 2.80 0.33 10.12 5.36 -1.26 -4.74 117.98 132.27 2wek s PHE 304 Ca 0.00 -1.54 0.08 0.00 -0.96 0.00 0.00 56.93 54.52 2wek s PHE 304 Cb -0.13 -1.94 0.81 0.00 -0.34 0.00 0.00 43.02 41.42 2wek s PHE 304 CO -0.04 -0.77 1.80 1.25 -1.46 0.00 0.00 175.22 176.00 2wek h LEU 305 N 7.94 0.71 0.00 6.12 5.85 -1.97 -0.76 115.31 133.20 2wek h LEU 305 Ca -0.45 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.35 2wek h LEU 305 Cb 1.14 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2wek h LEU 305 CO 0.63 0.26 0.00 0.59 -0.34 0.00 0.00 178.44 179.59 2wek n ASN 306 N -4.70 0.00 -0.18 1.25 4.13 -1.26 -1.85 115.26 112.65 2wek n ASN 306 Ca 0.22 -0.16 0.12 0.00 1.68 0.00 0.00 54.58 56.44 2wek n ASN 306 Cb 0.59 -0.20 0.28 0.00 -1.54 0.00 0.00 39.78 38.91 2wek n ASN 306 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2wek n HIS 307 N -1.20 0.00 -1.96 3.10 8.25 -0.29 -4.34 115.22 118.78 2wek n HIS 307 Ca 0.10 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.53 2wek n HIS 307 Cb 0.12 -0.14 0.11 0.00 1.12 0.00 0.00 29.99 31.20 2wek n HIS 307 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2wek n TYR 308 N -0.89 0.89 0.16 4.41 4.01 -0.77 -4.82 117.16 120.14 2wek n TYR 308 Ca 0.09 -1.61 0.01 0.00 -0.16 0.00 0.00 57.90 56.23 2wek n TYR 308 Cb 0.35 -0.26 0.27 0.00 -0.31 0.00 0.00 39.34 39.40 2wek n TYR 308 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2wek h LEU 309 N 1.47 0.00 -2.13 7.72 3.38 -1.76 -1.70 115.31 122.29 2wek h LEU 309 Ca 0.06 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.06 2wek h LEU 309 Cb 1.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 2wek h LEU 309 CO 0.24 0.49 0.30 0.77 0.09 0.00 0.00 178.44 180.33 2wek h SER 310 N 0.00 0.00 0.02 -0.43 4.64 -1.94 -0.71 113.55 115.12 2wek h SER 310 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wek h SER 310 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2wek h SER 310 CO 0.06 0.00 -0.29 0.29 -0.87 0.00 0.00 176.83 176.02 2wek n LYS 311 N -3.17 1.47 -0.02 4.77 4.76 -0.64 -4.70 118.16 120.62 2wek n LYS 311 Ca -0.00 -1.16 -0.13 0.00 -2.87 0.00 0.00 58.31 54.15 2wek n LYS 311 Cb 0.38 -1.48 -0.09 0.00 -1.84 0.00 0.00 35.03 32.01 2wek n LYS 311 CO 0.00 0.00 0.00 -0.92 -1.37 0.00 0.00 177.40 175.11 2wek h TYR 312 N 2.83 0.12 -0.81 2.13 3.20 -1.15 -2.40 116.97 120.89 2wek h TYR 312 Ca 0.00 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.88 2wek h TYR 312 Cb 0.76 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.96 2wek h TYR 312 CO 0.00 0.53 0.51 1.96 -1.64 0.00 0.00 178.16 179.51 2wek h GLN 313 N -0.33 0.93 -0.25 1.82 4.20 -1.84 -0.24 115.11 119.40 2wek h GLN 313 Ca 0.01 -0.06 -0.18 0.00 0.06 0.00 0.00 58.65 58.48 2wek h GLN 313 Cb 0.50 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.07 2wek h GLN 313 CO 0.01 0.62 -0.54 0.00 -0.67 0.00 0.00 178.83 178.25 2wek h ALA 314 N 1.36 0.41 0.10 3.87 0.00 -1.88 -0.02 119.26 123.09 2wek h ALA 314 Ca 0.33 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2wek h ALA 314 Cb 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2wek h ALA 314 CO -0.14 0.61 -0.05 0.00 0.00 0.00 0.00 179.25 179.68 2wek h ALA 315 N 0.64 -0.14 -0.61 0.00 0.00 -1.13 -2.04 119.26 115.99 2wek h ALA 315 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2wek h ALA 315 Cb 1.15 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 2wek h ALA 315 CO 0.12 -0.58 0.36 1.98 0.00 0.00 0.00 179.25 181.13 2wek h MET 316 N -0.14 0.69 -0.58 0.00 -1.53 -0.99 0.24 114.93 112.62 2wek h MET 316 Ca -0.01 -0.04 -0.03 0.00 -3.44 0.00 0.00 59.70 56.18 2wek h MET 316 Cb 0.12 -0.16 -0.03 0.00 -0.55 0.00 0.00 31.60 30.98 2wek h MET 316 CO 0.01 0.46 0.26 1.03 0.14 0.00 0.00 176.91 178.80 2wek h SER 317 N 0.71 0.75 -0.02 1.39 0.87 -0.83 -0.58 113.55 115.84 2wek h SER 317 Ca 0.25 -0.08 -0.25 0.00 -1.23 0.00 0.00 61.79 60.48 2wek h SER 317 Cb 0.06 -0.19 0.02 0.00 -0.44 0.00 0.00 62.40 61.84 2wek h SER 317 CO -0.12 0.66 -0.94 -0.74 -0.53 0.00 0.00 176.83 175.15 2wek h HIS 318 N 0.82 0.99 -0.54 2.24 2.76 -0.92 -2.65 115.15 117.86 2wek h HIS 318 Ca 0.20 -0.52 -0.01 0.00 -2.20 0.00 0.00 60.37 57.84 2wek h HIS 318 Cb 0.12 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 28.94 2wek h HIS 318 CO 0.01 1.36 0.31 -0.07 -1.30 0.00 0.00 177.93 178.24 2wek h LEU 319 N 0.34 0.66 -0.75 0.26 3.38 -0.75 -1.90 115.31 116.56 2wek h LEU 319 Ca -0.11 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2wek h LEU 319 Cb 1.60 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 42.15 2wek h LEU 319 CO 0.19 0.54 0.41 -0.07 0.09 0.00 0.00 178.44 179.60 2wek h LEU 320 N 0.73 0.94 -0.37 1.67 3.38 -1.15 0.11 115.31 120.61 2wek h LEU 320 Ca 0.19 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2wek h LEU 320 Cb 0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 2wek h LEU 320 CO -0.03 0.77 0.18 -0.08 0.09 0.00 0.00 178.44 179.36 2wek h GLU 321 N 1.03 0.54 -0.66 1.13 4.81 -1.11 -0.35 114.58 119.97 2wek h GLU 321 Ca 0.26 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 2wek h GLU 321 Cb 0.04 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 2wek h GLU 321 CO -0.04 0.48 0.43 0.52 -0.73 0.00 0.00 179.01 179.67 2wek h MET 322 N 0.46 0.83 0.56 1.92 2.86 -1.19 -1.84 114.93 118.54 2wek h MET 322 Ca 0.13 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 2wek h MET 322 Cb 0.12 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.60 2wek h MET 322 CO -0.02 0.55 -0.31 0.00 1.06 0.00 0.00 176.91 178.20 2wek h VAL 324 N -0.81 1.21 0.00 0.00 -1.51 -1.06 -2.19 116.25 111.88 2wek h VAL 324 Ca -0.07 -0.94 0.00 0.00 -1.23 0.00 0.00 66.70 64.46 2wek h VAL 324 Cb 0.64 1.27 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 2wek h VAL 324 CO 0.10 0.29 0.00 -1.20 -1.23 0.00 0.00 177.57 175.53 2wek n SER 325 N -4.22 0.00 -0.48 4.19 7.64 -0.69 -4.88 113.62 115.17 2wek n SER 325 Ca -0.01 -0.37 -0.06 0.00 1.01 0.00 0.00 58.87 59.44 2wek n SER 325 Cb 0.31 -0.18 -0.03 0.00 -1.01 0.00 0.00 64.21 63.30 2wek n SER 325 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wek n GLY 326 N 0.87 0.85 0.88 0.23 0.00 -0.83 -4.91 105.19 102.29 2wek n GLY 326 Ca 0.16 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.71 2wek n GLY 326 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wek n ASP 327 N 0.55 2.64 -3.74 1.61 8.00 0.24 -4.84 116.55 121.01 2wek n ASP 327 Ca -0.06 -1.88 -0.18 0.00 0.71 0.00 0.00 54.79 53.38 2wek n ASP 327 Cb 0.24 -0.20 -0.17 0.00 -0.02 0.00 0.00 41.12 40.97 2wek n ASP 327 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2wek s LEU 328 N -1.47 0.69 -0.14 0.64 2.96 -1.04 -4.90 118.68 115.41 2wek s LEU 328 Ca 0.35 0.04 -0.29 0.00 -0.22 0.00 0.00 54.13 54.01 2wek s LEU 328 Cb 0.20 -0.13 -0.01 0.00 0.50 0.00 0.00 46.19 46.75 2wek s LEU 328 CO 0.28 -0.18 1.05 -0.69 -1.32 0.00 0.00 176.35 175.49 2wek s VAL 329 N 1.54 4.68 -0.80 1.68 1.01 -1.26 -4.68 120.40 122.57 2wek s VAL 329 Ca -0.03 1.98 0.02 0.00 0.00 0.00 0.00 61.98 63.95 2wek s VAL 329 Cb -0.13 -4.27 0.22 0.00 0.00 0.00 0.00 36.38 32.20 2wek s VAL 329 CO -0.03 -0.06 0.74 0.00 0.00 0.00 0.00 175.10 175.75 2wek s GLU 331 N -1.76 4.44 -0.16 0.00 2.56 -1.26 -4.73 118.70 117.79 2wek s GLU 331 Ca 0.30 1.82 -0.02 0.00 0.00 0.00 0.00 54.97 57.06 2wek s GLU 331 Cb -0.01 -3.32 -0.02 0.00 2.00 0.00 0.00 34.13 32.79 2wek s GLU 331 CO -0.10 -0.24 -0.09 0.08 -0.56 0.00 0.00 175.26 174.35 2wek s VAL 332 N 0.84 3.30 -0.45 3.70 1.01 -1.26 -1.39 120.40 126.15 2wek s VAL 332 Ca 0.58 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.93 2wek s VAL 332 Cb -0.31 -2.43 0.11 0.00 0.00 0.00 0.00 36.38 33.76 2wek s VAL 332 CO 0.31 0.49 0.30 -0.62 0.00 0.00 0.00 175.10 175.58 2wek s ASP 333 N 0.64 5.57 -0.01 3.32 -1.08 0.53 -4.87 116.67 120.77 2wek s ASP 333 Ca -0.05 -1.91 0.16 0.00 -0.52 0.00 0.00 52.55 50.23 2wek s ASP 333 Cb -0.15 -1.96 0.48 0.00 -1.46 0.00 0.00 42.92 39.83 2wek s ASP 333 CO 0.03 -0.64 1.40 0.18 0.52 0.00 0.00 175.17 176.65 2wek n LEU 334 N 4.82 2.95 0.00 -1.34 4.77 -1.26 -2.10 117.00 124.84 2wek n LEU 334 Ca -0.07 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.44 2wek n LEU 334 Cb 0.41 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2wek n LEU 334 CO 0.40 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.78 2wek n GLY 335 N 1.31 0.69 0.36 -0.72 0.00 -1.26 -0.21 105.19 105.35 2wek n GLY 335 Ca 0.18 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.37 2wek n GLY 335 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wek h ASP 336 N 0.00 0.00 -0.17 1.61 3.32 -1.91 0.24 116.42 119.51 2wek h ASP 336 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2wek h ASP 336 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2wek h ASP 336 CO 0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 2wek n LEU 337 N -3.27 2.78 -4.70 1.55 4.77 -1.26 -4.56 117.00 112.32 2wek n LEU 337 Ca 0.02 -2.41 -0.30 0.00 -0.03 0.00 0.00 56.01 53.29 2wek n LEU 337 Cb 0.51 -0.27 0.21 0.00 -2.33 0.00 0.00 43.42 41.54 2wek n LEU 337 CO 0.20 0.65 0.69 -0.94 -1.33 0.00 0.00 177.39 176.66 2wek s SER 338 N -1.53 1.75 0.06 -1.43 1.04 0.84 -4.92 113.70 109.52 2wek s SER 338 Ca 0.22 0.60 -0.25 0.00 0.48 0.00 0.00 55.95 57.00 2wek s SER 338 Cb 0.16 -0.84 -0.17 0.00 0.10 0.00 0.00 66.02 65.28 2wek s SER 338 CO 0.08 -3.61 1.60 -0.65 0.98 0.00 0.00 173.24 171.64 2wek h PRO 339 N -2.23 -0.19 -0.47 4.02 0.11 -1.96 -2.94 132.00 128.33 2wek h PRO 339 Ca -0.46 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2wek h PRO 339 Cb 1.28 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2wek h PRO 339 CO 0.39 -0.05 0.00 0.39 -0.21 0.00 0.00 178.00 178.52 2wek n GLU 340 N -5.13 2.08 0.00 1.05 1.02 -1.26 -5.04 120.64 113.36 2wek n GLU 340 Ca -0.09 -1.67 0.00 0.00 -0.02 0.00 0.00 57.16 55.38 2wek n GLU 340 Cb 0.14 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 2wek n GLU 340 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wek n GLY 341 N 1.23 -1.61 3.65 0.62 0.00 -1.11 -4.94 105.19 103.02 2wek n GLY 341 Ca 0.16 -1.33 -0.45 0.00 0.00 0.00 0.00 46.02 44.39 2wek n GLY 341 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wek n ARG 342 N -0.00 1.82 -2.21 1.61 0.63 -1.16 -4.52 116.66 112.83 2wek n ARG 342 Ca 0.00 0.65 -0.32 0.00 -0.92 0.00 0.00 57.85 57.26 2wek n ARG 342 Cb 0.00 -2.24 -0.04 0.00 0.45 0.00 0.00 32.46 30.63 2wek n ARG 342 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2wek s PHE 343 N -0.32 2.03 -0.14 -0.14 0.08 0.70 -4.93 117.98 115.26 2wek s PHE 343 Ca 0.66 0.18 0.01 0.00 0.12 0.00 0.00 56.93 57.90 2wek s PHE 343 Cb -0.68 -4.26 -0.00 0.00 -0.57 0.00 0.00 43.02 37.51 2wek s PHE 343 CO 0.53 -1.83 -0.17 0.99 -0.10 0.00 0.00 175.22 174.63 2wek s THR 344 N 8.41 2.53 0.00 0.64 2.01 -1.26 -1.04 115.64 126.93 2wek s THR 344 Ca 0.62 -0.82 0.00 0.00 0.31 0.00 0.00 61.69 61.80 2wek s THR 344 Cb -0.05 -2.05 0.00 0.00 0.01 0.00 0.00 72.50 70.41 2wek s THR 344 CO -0.02 0.53 0.00 0.61 -0.69 0.00 0.00 174.62 175.04 2wek n GLY 345 N 3.95 1.02 0.36 4.40 0.00 0.08 -4.16 105.19 110.84 2wek n GLY 345 Ca -0.19 -1.73 0.04 0.00 0.00 0.00 0.00 46.02 44.14 2wek n GLY 345 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wek h LEU 346 N 0.00 0.78 -2.07 0.99 3.38 -1.96 -1.74 115.31 114.69 2wek h LEU 346 Ca 0.00 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 2wek h LEU 346 Cb 0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2wek h LEU 346 CO 0.00 0.52 0.09 -0.08 0.09 0.00 0.00 178.44 179.06 2wek h GLU 347 N 0.90 0.00 0.00 1.13 4.57 -2.00 -1.35 114.58 117.83 2wek h GLU 347 Ca 0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 2wek h GLU 347 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2wek h GLU 347 CO -0.11 0.00 0.00 0.66 -1.18 0.00 0.00 179.01 178.38 2wek h SER 348 N 0.00 0.00 -0.90 1.04 4.64 -1.47 -3.11 113.55 113.74 2wek h SER 348 Ca 0.06 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.47 2wek h SER 348 Cb 0.23 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.26 2wek h SER 348 CO -0.00 0.00 0.58 0.40 -0.87 0.00 0.00 176.83 176.94 2wek h ILE 349 N 0.00 0.99 -0.54 0.95 2.04 -1.34 -0.40 117.51 119.21 2wek h ILE 349 Ca 0.00 -0.32 0.06 0.00 1.00 0.00 0.00 64.86 65.60 2wek h ILE 349 Cb 0.45 -0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.46 2wek h ILE 349 CO 0.00 0.17 0.25 -0.26 0.00 0.00 0.00 178.15 178.31 2wek h PHE 350 N 0.93 0.46 -0.16 1.37 0.04 -1.73 -1.10 116.94 116.75 2wek h PHE 350 Ca 0.41 0.02 -0.13 0.00 2.80 0.00 0.00 57.97 61.08 2wek h PHE 350 Cb 0.36 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 2wek h PHE 350 CO -0.00 0.20 -0.45 0.00 -0.60 0.00 0.00 178.31 177.46 2wek h ARG 351 N 0.48 0.39 -0.30 1.51 3.08 -1.45 -2.67 114.38 115.43 2wek h ARG 351 Ca 0.25 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 59.99 2wek h ARG 351 Cb 0.19 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 2wek h ARG 351 CO -0.19 0.77 -0.18 0.00 -1.07 0.00 0.00 179.97 179.30 2wek h ALA 352 N 1.20 0.42 -0.50 0.04 0.00 -0.64 -0.02 119.26 119.76 2wek h ALA 352 Ca 0.02 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.64 2wek h ALA 352 Cb 0.92 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 2wek h ALA 352 CO 0.08 0.35 0.23 0.28 0.00 0.00 0.00 179.25 180.19 2wek h VAL 353 N 0.40 0.92 -0.91 0.00 2.07 -1.23 -2.19 116.25 115.31 2wek h VAL 353 Ca 0.06 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2wek h VAL 353 Cb 0.72 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2wek h VAL 353 CO 0.05 0.08 0.58 0.78 0.02 0.00 0.00 177.57 179.08 2wek h ASN 354 N 0.46 1.07 -0.49 0.57 2.35 -1.11 -2.52 115.58 115.91 2wek h ASN 354 Ca 0.23 -0.05 0.04 0.00 -0.55 0.00 0.00 56.30 55.97 2wek h ASN 354 Cb 0.17 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 2wek h ASN 354 CO -0.18 0.80 0.25 0.22 -1.65 0.00 0.00 177.43 176.86 2wek h TYR 355 N 1.25 0.45 0.32 1.19 3.20 -0.71 -0.50 116.97 122.17 2wek h TYR 355 Ca 0.33 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.21 2wek h TYR 355 Cb -0.10 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.04 2wek h TYR 355 CO -0.00 0.22 -0.15 1.98 -1.64 0.00 0.00 178.16 178.56 2wek h MET 356 N 0.48 -0.41 0.00 1.82 4.05 -1.13 -2.36 114.93 117.38 2wek h MET 356 Ca 0.22 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.67 2wek h MET 356 Cb 0.13 0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.02 2wek h MET 356 CO -0.16 -0.28 0.00 0.66 0.23 0.00 0.00 176.91 177.37 2wek n TYR 357 N -5.28 0.27 1.36 1.39 4.01 -0.97 -0.04 117.16 117.91 2wek n TYR 357 Ca -0.10 0.11 0.14 0.00 -0.16 0.00 0.00 57.90 57.88 2wek n TYR 357 Cb 0.19 -0.68 0.50 0.00 -0.31 0.00 0.00 39.34 39.05 2wek n TYR 357 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2wek n MET 358 N -1.75 0.89 -1.99 -0.72 2.81 -0.22 -4.96 117.12 111.18 2wek n MET 358 Ca 0.03 -0.44 -0.08 0.00 -1.81 0.00 0.00 57.70 55.41 2wek n MET 358 Cb 0.18 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.19 2wek n MET 358 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wek n GLY 359 N 1.29 0.21 0.01 3.03 0.00 0.95 -4.96 105.19 105.71 2wek n GLY 359 Ca 0.14 -0.59 0.11 0.00 0.00 0.00 0.00 46.02 45.68 2wek n GLY 359 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wek n LYS 360 N -1.91 0.15 -2.81 1.61 4.76 -0.91 -4.92 118.16 114.14 2wek n LYS 360 Ca -0.09 -0.02 -0.34 0.00 -2.87 0.00 0.00 58.31 54.99 2wek n LYS 360 Cb 0.51 -1.53 -0.07 0.00 -1.84 0.00 0.00 35.03 32.11 2wek n LYS 360 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2wek s ASN 361 N -3.42 7.04 -0.20 4.39 4.22 -1.26 -5.06 114.94 120.65 2wek s ASN 361 Ca 0.06 1.73 0.01 0.00 -2.14 0.00 0.00 52.86 52.52 2wek s ASN 361 Cb 0.16 -2.55 0.03 0.00 1.28 0.00 0.00 41.25 40.17 2wek s ASN 361 CO 0.83 -0.28 -0.17 -0.89 -2.04 0.00 0.00 177.10 174.55 2wek s THR 362 N -2.03 1.99 0.00 0.54 2.01 -1.26 -4.71 115.64 112.18 2wek s THR 362 Ca 0.59 -1.06 0.00 0.00 0.31 0.00 0.00 61.69 61.53 2wek s THR 362 Cb -0.12 -1.90 0.00 0.00 0.01 0.00 0.00 72.50 70.50 2wek s THR 362 CO 0.16 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 175.08 2wek n GLY 363 N 4.60 -1.65 3.67 4.40 0.00 0.93 -4.04 105.19 113.10 2wek n GLY 363 Ca -0.19 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 2wek n GLY 363 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wek s LYS 364 N 0.00 4.33 -0.03 1.61 2.47 -0.48 -2.90 119.74 124.74 2wek s LYS 364 Ca 0.00 1.17 -0.30 0.00 -1.56 0.00 0.00 55.97 55.28 2wek s LYS 364 Cb 0.00 -3.57 -0.05 0.00 -1.46 0.00 0.00 37.83 32.75 2wek s LYS 364 CO 0.00 -0.36 1.44 0.42 0.16 0.00 0.00 175.35 177.01 2wek s ILE 365 N 2.25 3.73 0.02 5.43 1.01 -1.26 -0.35 121.20 132.03 2wek s ILE 365 Ca 0.42 1.05 0.03 0.00 0.00 0.00 0.00 60.65 62.15 2wek s ILE 365 Cb -0.17 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.61 2wek s ILE 365 CO 0.13 -0.03 -0.10 -0.69 0.00 0.00 0.00 174.94 174.25 2wek s VAL 366 N 2.85 0.76 -0.08 2.92 1.01 -0.89 -1.68 120.40 125.28 2wek s VAL 366 Ca 0.65 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.97 2wek s VAL 366 Cb -0.31 -0.69 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 2wek s VAL 366 CO 0.26 0.01 -0.21 -0.69 0.00 0.00 0.00 175.10 174.47 2wek s VAL 367 N -0.64 2.42 -0.13 2.92 1.01 -0.19 -4.34 120.40 121.45 2wek s VAL 367 Ca -0.00 -0.92 -0.06 0.00 0.00 0.00 0.00 61.98 60.99 2wek s VAL 367 Cb -0.06 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 2wek s VAL 367 CO 0.00 0.56 0.10 -1.83 0.00 0.00 0.00 175.10 173.94 2wek s GLU 368 N -0.04 3.49 -0.50 2.72 -1.05 -0.20 -1.36 118.70 121.75 2wek s GLU 368 Ca -0.06 -0.21 -0.06 0.00 -0.15 0.00 0.00 54.97 54.49 2wek s GLU 368 Cb -0.15 -3.14 0.13 0.00 -0.44 0.00 0.00 34.13 30.53 2wek s GLU 368 CO 0.05 0.66 0.34 -0.51 0.95 0.00 0.00 175.26 176.75 2wek s LEU 369 N -0.71 5.53 0.22 1.83 1.43 0.65 -0.74 118.68 126.89 2wek s LEU 369 Ca 0.13 -2.17 -0.30 0.00 -1.03 0.00 0.00 54.13 50.76 2wek s LEU 369 Cb -0.12 -1.93 -0.09 0.00 0.03 0.00 0.00 46.19 44.08 2wek s LEU 369 CO 0.03 -0.58 1.25 -2.84 0.23 0.00 0.00 176.35 174.44 2wek s PRO 370 N 0.96 4.44 0.00 1.29 0.02 -1.26 -4.56 135.00 135.89 2wek s PRO 370 Ca 0.09 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.11 2wek s PRO 370 Cb -0.23 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 31.10 2wek s PRO 370 CO -0.03 -0.15 0.30 0.72 -0.33 0.00 0.00 177.00 177.51