#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h61 n ALA 2 N 0.00 0.00 0.16 7.33 0.00 -1.26 -4.78 120.51 121.95 1h61 n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1h61 n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1h61 n ALA 2 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1h61 n GLU 3 N 0.00 0.00 -0.00 0.00 4.07 -1.26 -5.00 120.64 118.45 1h61 n GLU 3 Ca 0.00 0.00 0.02 0.00 -0.06 0.00 0.00 57.16 57.12 1h61 n GLU 3 Cb 0.00 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.35 1h61 n GLU 3 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1h61 n LYS 4 N -3.28 2.97 0.29 5.31 5.02 -1.26 -4.67 118.16 122.55 1h61 n LYS 4 Ca 0.00 -0.02 0.19 0.00 -2.02 0.00 0.00 58.31 56.46 1h61 n LYS 4 Cb 0.00 -0.89 0.98 0.00 -0.02 0.00 0.00 35.03 35.10 1h61 n LYS 4 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1h61 h LEU 5 N 0.00 0.00 -3.50 -0.35 3.38 -1.94 -2.26 115.31 110.64 1h61 h LEU 5 Ca 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.71 1h61 h LEU 5 Cb 0.15 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.74 1h61 h LEU 5 CO 0.00 0.00 0.08 0.49 0.09 0.00 0.00 178.44 179.10 1h61 n PHE 6 N -3.33 1.54 -4.20 1.13 3.72 -1.26 -0.67 117.46 114.39 1h61 n PHE 6 Ca -0.01 -1.67 -0.30 0.00 -0.05 0.00 0.00 57.45 55.42 1h61 n PHE 6 Cb 0.22 -0.60 -0.09 0.00 -0.94 0.00 0.00 39.48 38.07 1h61 n PHE 6 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1h61 s THR 7 N -3.27 3.63 0.82 4.37 -4.23 -0.85 -4.76 115.64 111.35 1h61 s THR 7 Ca 0.47 -1.14 -0.12 0.00 -1.18 0.00 0.00 61.69 59.72 1h61 s THR 7 Cb 0.42 -2.70 0.09 0.00 1.34 0.00 0.00 72.50 71.66 1h61 s THR 7 CO 0.02 0.13 1.19 -2.84 -0.54 0.00 0.00 174.62 172.58 1h61 s PRO 8 N -2.20 1.55 -0.16 3.99 0.02 -1.19 -3.84 135.00 133.18 1h61 s PRO 8 Ca 0.23 1.68 -0.08 0.00 0.02 0.00 0.00 61.00 62.85 1h61 s PRO 8 Cb -0.11 -1.77 0.06 0.00 0.02 0.00 0.00 34.50 32.69 1h61 s PRO 8 CO 0.15 -2.26 0.37 -1.17 -0.33 0.00 0.00 177.00 173.75 1h61 s LEU 9 N -5.89 -0.07 -0.20 -5.54 2.96 0.28 -4.91 118.68 105.31 1h61 s LEU 9 Ca 0.71 0.81 -0.29 0.00 -0.22 0.00 0.00 54.13 55.14 1h61 s LEU 9 Cb -0.27 1.18 0.00 0.00 0.50 0.00 0.00 46.19 47.60 1h61 s LEU 9 CO 0.52 -0.20 1.04 -0.75 -1.32 0.00 0.00 176.35 175.65 1h61 s LYS 10 N 1.58 4.29 -0.50 1.98 2.20 -1.26 -0.55 119.74 127.48 1h61 s LYS 10 Ca -0.08 1.38 0.04 0.00 -0.36 0.00 0.00 55.97 56.95 1h61 s LYS 10 Cb -0.09 -3.62 0.13 0.00 -1.51 0.00 0.00 37.83 32.73 1h61 s LYS 10 CO -0.12 -0.56 0.24 0.08 -0.36 0.00 0.00 175.35 174.63 1h61 s VAL 11 N 2.95 2.58 0.00 4.02 1.01 0.36 -4.81 120.40 126.51 1h61 s VAL 11 Ca 0.45 -3.20 0.00 0.00 0.00 0.00 0.00 61.98 59.23 1h61 s VAL 11 Cb -0.16 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.42 1h61 s VAL 11 CO 0.09 -0.78 0.00 0.61 0.00 0.00 0.00 175.10 175.02 1h61 n GLY 12 N 3.25 3.68 0.00 4.51 0.00 -1.26 -2.15 105.19 113.21 1h61 n GLY 12 Ca 0.05 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.10 1h61 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h61 n ALA 13 N 12.13 1.98 -2.53 4.61 0.00 -0.09 -4.84 120.51 131.77 1h61 n ALA 13 Ca 0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 53.44 53.12 1h61 n ALA 13 Cb 0.00 -1.34 -0.11 0.00 0.00 0.00 0.00 19.45 18.01 1h61 n ALA 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1h61 s VAL 14 N -2.90 1.60 -0.18 0.00 -7.23 -0.91 -5.13 120.40 105.64 1h61 s VAL 14 Ca 0.12 -2.01 0.01 0.00 -1.81 0.00 0.00 61.98 58.29 1h61 s VAL 14 Cb 0.14 -2.86 0.03 0.00 0.56 0.00 0.00 36.38 34.24 1h61 s VAL 14 CO 0.36 -0.02 -0.16 -0.89 -0.31 0.00 0.00 175.10 174.08 1h61 s THR 15 N -3.01 1.87 0.08 5.32 2.01 -1.26 -0.48 115.64 120.16 1h61 s THR 15 Ca 0.35 -0.93 -0.25 0.00 0.31 0.00 0.00 61.69 61.17 1h61 s THR 15 Cb 0.09 -1.77 -0.06 0.00 0.01 0.00 0.00 72.50 70.77 1h61 s THR 15 CO 0.16 0.40 0.76 0.00 -0.69 0.00 0.00 174.62 175.25 1h61 s ALA 16 N 1.34 3.40 -0.93 7.40 0.00 0.29 -4.92 121.76 128.35 1h61 s ALA 16 Ca 0.03 0.29 0.28 0.00 0.00 0.00 0.00 51.96 52.55 1h61 s ALA 16 Cb -0.14 -2.97 1.11 0.00 0.00 0.00 0.00 23.12 21.12 1h61 s ALA 16 CO -0.11 0.14 1.87 -0.35 0.00 0.00 0.00 175.76 177.31 1h61 n PRO 17 N 2.44 0.06 -3.99 0.00 -0.04 -1.26 -0.56 135.00 131.66 1h61 n PRO 17 Ca -0.04 0.07 -0.09 0.00 -0.04 0.00 0.00 63.50 63.40 1h61 n PRO 17 Cb 0.50 -1.58 -0.05 0.00 -0.04 0.00 0.00 33.50 32.33 1h61 n PRO 17 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1h61 s ASN 18 N -3.38 -0.03 -0.16 3.54 2.20 -1.25 -3.16 114.94 112.71 1h61 s ASN 18 Ca 0.13 -0.96 0.16 0.00 -0.94 0.00 0.00 52.86 51.25 1h61 s ASN 18 Cb 0.17 0.61 0.67 0.00 -2.00 0.00 0.00 41.25 40.70 1h61 s ASN 18 CO 0.53 -1.19 1.59 0.54 -2.94 0.00 0.00 177.10 175.63 1h61 n ARG 19 N -0.41 3.86 -3.20 3.55 3.00 0.16 -4.37 116.66 119.24 1h61 n ARG 19 Ca -0.02 -2.91 -0.45 0.00 -0.01 0.00 0.00 57.85 54.46 1h61 n ARG 19 Cb 0.62 -1.96 -0.05 0.00 0.00 0.00 0.00 32.46 31.07 1h61 n ARG 19 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1h61 s VAL 20 N -2.36 5.03 0.15 1.55 1.01 -1.26 -1.86 120.40 122.66 1h61 s VAL 20 Ca 0.48 -1.32 0.01 0.00 0.00 0.00 0.00 61.98 61.15 1h61 s VAL 20 Cb 0.35 -4.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1h61 s VAL 20 CO 0.17 -1.02 0.30 -0.36 0.00 0.00 0.00 175.10 174.18 1h61 s PHE 21 N 2.07 3.49 -0.33 5.22 0.40 0.05 -0.80 117.98 128.08 1h61 s PHE 21 Ca 0.09 0.20 -0.16 0.00 -0.60 0.00 0.00 56.93 56.46 1h61 s PHE 21 Cb -0.25 -1.73 -0.01 0.00 0.51 0.00 0.00 43.02 41.53 1h61 s PHE 21 CO 0.04 0.49 0.40 1.41 0.70 0.00 0.00 175.22 178.25 1h61 s MET 22 N -3.14 3.63 0.69 0.44 -2.45 -0.26 -0.93 119.30 117.28 1h61 s MET 22 Ca 0.36 -0.30 -0.14 0.00 -1.25 0.00 0.00 55.69 54.35 1h61 s MET 22 Cb -0.11 -3.79 0.02 0.00 1.25 0.00 0.00 34.83 32.20 1h61 s MET 22 CO 0.28 -0.52 1.13 0.00 1.05 0.00 0.00 175.02 176.97 1h61 s ALA 23 N 2.11 2.34 0.14 4.11 0.00 -0.62 -1.33 121.76 128.50 1h61 s ALA 23 Ca 0.14 0.59 -0.31 0.00 0.00 0.00 0.00 51.96 52.38 1h61 s ALA 23 Cb -0.16 -3.35 -0.10 0.00 0.00 0.00 0.00 23.12 19.51 1h61 s ALA 23 CO 0.12 -1.50 1.65 -1.25 0.00 0.00 0.00 175.76 174.78 1h61 s PRO 24 N -4.14 4.19 -0.22 0.00 0.04 -1.21 -4.68 135.00 128.97 1h61 s PRO 24 Ca 0.68 2.42 -0.03 0.00 0.04 0.00 0.00 61.00 64.12 1h61 s PRO 24 Cb -0.22 -3.31 0.07 0.00 0.04 0.00 0.00 34.50 31.08 1h61 s PRO 24 CO 0.44 -0.69 0.05 -0.51 0.04 0.00 0.00 177.00 176.33 1h61 s LEU 25 N 1.73 1.34 0.03 -3.56 1.43 -1.26 -4.88 118.68 113.51 1h61 s LEU 25 Ca 0.73 -1.00 -0.30 0.00 -1.03 0.00 0.00 54.13 52.53 1h61 s LEU 25 Cb -0.44 -0.63 -0.07 0.00 0.03 0.00 0.00 46.19 45.08 1h61 s LEU 25 CO 0.32 -0.33 1.56 -0.89 0.23 0.00 0.00 176.35 177.24 1h61 s THR 26 N 1.83 3.32 0.00 5.49 2.01 -1.26 -4.23 115.64 122.80 1h61 s THR 26 Ca 0.01 0.73 0.00 0.00 0.31 0.00 0.00 61.69 62.74 1h61 s THR 26 Cb -0.17 -3.47 0.00 0.00 0.01 0.00 0.00 72.50 68.87 1h61 s THR 26 CO -0.13 -0.01 0.06 0.54 -0.69 0.00 0.00 174.62 174.40 1h61 n ARG 27 N 5.63 5.57 -3.92 4.92 5.12 -1.26 -4.79 116.66 127.93 1h61 n ARG 27 Ca 0.15 -0.06 -0.27 0.00 -1.93 0.00 0.00 57.85 55.74 1h61 n ARG 27 Cb 0.42 -0.54 -0.01 0.00 -1.16 0.00 0.00 32.46 31.17 1h61 n ARG 27 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1h61 n LEU 28 N -0.81 -2.25 -0.07 0.55 4.77 -1.26 -0.72 117.00 117.21 1h61 n LEU 28 Ca 0.00 -1.02 0.08 0.00 -0.03 0.00 0.00 56.01 55.04 1h61 n LEU 28 Cb 0.00 -2.23 0.11 0.00 -2.33 0.00 0.00 43.42 38.97 1h61 n LEU 28 CO 0.00 0.45 0.56 0.54 -1.33 0.00 0.00 177.39 177.61 1h61 n ARG 29 N -4.39 1.73 -1.62 3.23 1.74 -1.12 -3.55 116.66 112.68 1h61 n ARG 29 Ca -0.28 -2.33 -0.31 0.00 -0.77 0.00 0.00 57.85 54.17 1h61 n ARG 29 Cb 0.67 -1.39 0.05 0.00 -1.02 0.00 0.00 32.46 30.77 1h61 n ARG 29 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1h61 s SER 30 N -2.41 5.37 0.16 0.55 0.01 -0.34 -4.81 113.70 112.24 1h61 s SER 30 Ca 0.25 1.53 -0.30 0.00 1.31 0.00 0.00 55.95 58.74 1h61 s SER 30 Cb 0.21 -2.41 -0.07 0.00 0.21 0.00 0.00 66.02 63.97 1h61 s SER 30 CO 0.02 -1.44 0.96 -0.63 0.41 0.00 0.00 173.24 172.57 1h61 s ILE 31 N -3.09 4.30 -0.02 1.44 1.01 -0.32 -4.66 121.20 119.87 1h61 s ILE 31 Ca 0.58 2.05 0.05 0.00 0.00 0.00 0.00 60.65 63.33 1h61 s ILE 31 Cb -0.14 -4.31 -0.01 0.00 0.01 0.00 0.00 42.46 38.01 1h61 s ILE 31 CO 0.55 0.38 -0.17 -1.61 0.00 0.00 0.00 174.94 174.09 1h61 s GLU 32 N -0.46 1.38 0.61 2.79 2.02 -1.26 -0.58 118.70 123.20 1h61 s GLU 32 Ca 0.45 -0.59 -0.16 0.00 0.02 0.00 0.00 54.97 54.69 1h61 s GLU 32 Cb -0.25 -1.32 -0.03 0.00 0.10 0.00 0.00 34.13 32.64 1h61 s GLU 32 CO 0.31 0.34 1.07 -1.25 0.02 0.00 0.00 175.26 175.76 1h61 s PRO 33 N -0.34 3.17 0.00 0.39 0.04 -1.26 -4.97 135.00 132.03 1h61 s PRO 33 Ca 0.05 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.36 1h61 s PRO 33 Cb -0.07 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1h61 s PRO 33 CO -0.00 -0.94 0.00 0.41 0.04 0.00 0.00 177.00 176.51 1h61 n GLY 34 N -0.82 2.38 3.91 0.56 0.00 -1.26 -4.68 105.19 105.28 1h61 n GLY 34 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 1h61 n GLY 34 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h61 n ASP 35 N 0.00 -0.88 -4.72 1.61 8.00 0.25 -4.77 116.55 116.04 1h61 n ASP 35 Ca 0.00 -1.00 -0.36 0.00 0.71 0.00 0.00 54.79 54.14 1h61 n ASP 35 Cb 0.00 -3.15 -0.07 0.00 -0.02 0.00 0.00 41.12 37.88 1h61 n ASP 35 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1h61 s ILE 36 N -3.89 5.33 0.69 0.53 1.01 -0.50 -2.00 121.20 122.36 1h61 s ILE 36 Ca 0.05 0.46 -0.16 0.00 0.00 0.00 0.00 60.65 61.00 1h61 s ILE 36 Cb -0.02 -3.59 0.01 0.00 0.01 0.00 0.00 42.46 38.87 1h61 s ILE 36 CO 0.88 0.39 1.25 -2.84 0.00 0.00 0.00 174.94 174.62 1h61 s PRO 37 N 0.51 2.34 0.36 2.79 0.02 -1.26 -1.17 135.00 138.59 1h61 s PRO 37 Ca 0.14 1.90 0.08 0.00 0.02 0.00 0.00 61.00 63.15 1h61 s PRO 37 Cb -0.13 -1.84 -0.06 0.00 0.02 0.00 0.00 34.50 32.49 1h61 s PRO 37 CO 0.03 -1.72 0.01 0.95 -0.33 0.00 0.00 177.00 175.94 1h61 s THR 38 N -1.70 2.38 0.41 0.99 -4.23 -1.26 -4.84 115.64 107.38 1h61 s THR 38 Ca 0.78 -1.99 0.09 0.00 -1.18 0.00 0.00 61.69 59.39 1h61 s THR 38 Cb -0.33 -2.83 0.22 0.00 1.34 0.00 0.00 72.50 70.90 1h61 s THR 38 CO 0.42 -0.13 2.00 -0.65 -0.54 0.00 0.00 174.62 175.72 1h61 h PRO 39 N 1.79 0.38 -0.56 3.99 0.11 -1.96 -0.92 132.00 134.83 1h61 h PRO 39 Ca -0.43 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1h61 h PRO 39 Cb 1.25 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1h61 h PRO 39 CO 0.71 0.35 0.26 1.25 -0.21 0.00 0.00 178.00 180.36 1h61 h LEU 40 N 0.38 0.74 -1.08 2.35 5.85 -1.98 -0.09 115.31 121.47 1h61 h LEU 40 Ca 0.09 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 1h61 h LEU 40 Cb 0.14 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1h61 h LEU 40 CO -0.00 0.67 0.14 0.24 -0.34 0.00 0.00 178.44 179.14 1h61 h MET 41 N 0.76 0.79 -0.80 1.25 2.86 -1.68 -1.05 114.93 117.06 1h61 h MET 41 Ca 0.19 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1h61 h MET 41 Cb 0.13 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 1h61 h MET 41 CO -0.02 0.71 0.43 0.78 1.06 0.00 0.00 176.91 179.87 1h61 h GLY 42 N 0.94 1.21 1.01 8.32 0.00 -0.18 -1.62 103.07 112.75 1h61 h GLY 42 Ca 0.17 -0.56 -0.08 0.00 0.00 0.00 0.00 47.33 46.86 1h61 h GLY 42 CO -0.00 0.53 -0.03 -2.09 0.00 0.00 0.00 176.54 174.95 1h61 h GLU 43 N 1.12 0.86 -0.38 4.80 4.81 -0.41 -1.15 114.58 124.23 1h61 h GLU 43 Ca 0.28 -0.29 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1h61 h GLU 43 Cb 0.05 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 1h61 h GLU 43 CO -0.04 0.92 0.17 -0.92 -0.73 0.00 0.00 179.01 178.40 1h61 h TYR 44 N 0.71 0.31 -0.33 0.92 3.20 -0.87 -0.55 116.97 120.36 1h61 h TYR 44 Ca 0.13 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.87 1h61 h TYR 44 Cb 0.55 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1h61 h TYR 44 CO 0.04 0.15 -0.40 1.88 -1.64 0.00 0.00 178.16 178.20 1h61 h TYR 45 N 0.35 0.95 -0.62 -3.82 0.05 -1.22 -3.02 116.97 109.64 1h61 h TYR 45 Ca 0.16 -0.28 -0.03 0.00 0.05 0.00 0.00 58.73 58.63 1h61 h TYR 45 Cb 0.10 -0.20 -0.03 0.00 1.01 0.00 0.00 36.73 37.61 1h61 h TYR 45 CO -0.12 1.06 0.28 -0.09 -1.05 0.00 0.00 178.16 178.25 1h61 h ARG 46 N 0.65 0.89 0.00 4.88 2.43 -0.82 -1.63 114.38 120.78 1h61 h ARG 46 Ca 0.05 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1h61 h ARG 46 Cb 0.96 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1h61 h ARG 46 CO 0.09 0.70 -0.05 1.96 -1.51 0.00 0.00 179.97 181.16 1h61 h GLN 47 N 0.88 0.00 -0.41 0.20 4.20 -0.98 -2.61 115.11 116.39 1h61 h GLN 47 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 1h61 h GLN 47 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1h61 h GLN 47 CO -0.03 0.05 0.00 0.54 -0.67 0.00 0.00 178.83 178.73 1h61 n ARG 48 N -3.56 3.22 0.06 1.46 1.74 -0.64 -4.42 116.66 114.53 1h61 n ARG 48 Ca -0.02 -2.62 0.05 0.00 -0.77 0.00 0.00 57.85 54.49 1h61 n ARG 48 Cb 0.17 -1.70 0.27 0.00 -1.02 0.00 0.00 32.46 30.18 1h61 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h61 n ALA 49 N 0.30 1.15 1.22 7.54 0.00 -0.99 -1.97 120.51 127.76 1h61 n ALA 49 Ca 0.20 0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.85 1h61 n ALA 49 Cb 0.76 -1.17 0.69 0.00 0.00 0.00 0.00 19.45 19.73 1h61 n ALA 49 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1h61 n SER 50 N -1.81 0.00 -4.70 0.00 3.41 -1.26 -4.02 113.62 105.23 1h61 n SER 50 Ca 0.00 0.13 -0.38 0.00 -0.26 0.00 0.00 58.87 58.35 1h61 n SER 50 Cb 0.05 -0.37 0.05 0.00 -0.26 0.00 0.00 64.21 63.67 1h61 n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h61 n ALA 51 N -1.37 1.09 -0.25 7.33 0.00 -0.83 -4.86 120.51 121.62 1h61 n ALA 51 Ca 0.11 0.09 0.10 0.00 0.00 0.00 0.00 53.44 53.74 1h61 n ALA 51 Cb 0.27 -2.27 0.36 0.00 0.00 0.00 0.00 19.45 17.81 1h61 n ALA 51 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1h61 h GLY 52 N 1.09 1.14 -5.06 0.00 0.00 -1.17 -3.42 103.07 95.66 1h61 h GLY 52 Ca -0.50 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 1h61 h GLY 52 CO 0.55 0.15 0.02 -2.27 0.00 0.00 0.00 176.54 174.99 1h61 s LEU 53 N -9.79 -0.76 -0.19 3.11 2.96 -1.26 -4.45 118.68 108.30 1h61 s LEU 53 Ca -0.10 1.42 -0.11 0.00 -0.22 0.00 0.00 54.13 55.11 1h61 s LEU 53 Cb 0.21 2.28 -0.05 0.00 0.50 0.00 0.00 46.19 49.13 1h61 s LEU 53 CO 0.78 -0.23 0.18 -0.63 -1.32 0.00 0.00 176.35 175.13 1h61 s ILE 54 N 1.18 5.38 -0.23 6.68 1.01 -0.31 -1.11 121.20 133.80 1h61 s ILE 54 Ca -0.07 0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.82 1h61 s ILE 54 Cb -0.05 -3.52 -0.01 0.00 0.01 0.00 0.00 42.46 38.89 1h61 s ILE 54 CO -0.12 0.42 -0.01 -0.63 0.00 0.00 0.00 174.94 174.59 1h61 s ILE 55 N 0.46 3.59 0.95 2.92 1.01 -0.45 -0.07 121.20 129.61 1h61 s ILE 55 Ca 0.10 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 60.20 1h61 s ILE 55 Cb -0.12 -2.66 0.16 0.00 0.01 0.00 0.00 42.46 39.86 1h61 s ILE 55 CO 0.00 0.39 1.09 -0.94 0.00 0.00 0.00 174.94 175.48 1h61 s SER 56 N 1.51 2.87 0.76 3.58 1.04 0.52 -3.36 113.70 120.62 1h61 s SER 56 Ca 0.06 1.63 -0.15 0.00 0.48 0.00 0.00 55.95 57.97 1h61 s SER 56 Cb -0.15 -2.28 0.05 0.00 0.10 0.00 0.00 66.02 63.75 1h61 s SER 56 CO -0.02 -3.04 1.21 -1.84 0.98 0.00 0.00 173.24 170.53 1h61 n GLU 57 N -4.16 0.47 -1.70 4.02 0.28 -1.26 -3.98 120.64 114.31 1h61 n GLU 57 Ca 0.07 0.23 -0.44 0.00 -0.16 0.00 0.00 57.16 56.86 1h61 n GLU 57 Cb 0.54 -2.45 -0.03 0.00 1.43 0.00 0.00 31.44 30.94 1h61 n GLU 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1h61 n ALA 58 N -2.84 1.74 -2.99 -1.84 0.00 -1.26 -4.22 120.51 109.09 1h61 n ALA 58 Ca 0.14 0.40 -0.25 0.00 0.00 0.00 0.00 53.44 53.73 1h61 n ALA 58 Cb 0.50 -2.37 -0.16 0.00 0.00 0.00 0.00 19.45 17.42 1h61 n ALA 58 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1h61 s THR 59 N 0.23 1.34 0.28 0.00 2.01 0.69 -4.44 115.64 115.74 1h61 s THR 59 Ca 0.69 -0.66 -0.30 0.00 0.31 0.00 0.00 61.69 61.74 1h61 s THR 59 Cb -0.60 -1.16 -0.11 0.00 0.01 0.00 0.00 72.50 70.65 1h61 s THR 59 CO 0.46 0.39 1.47 -1.10 -0.69 0.00 0.00 174.62 175.15 1h61 s GLN 60 N 0.14 4.22 0.15 4.92 1.11 -0.03 -1.27 119.66 128.90 1h61 s GLN 60 Ca -0.05 2.39 0.25 0.00 0.01 0.00 0.00 55.36 57.96 1h61 s GLN 60 Cb -0.12 -3.07 0.46 0.00 -1.01 0.00 0.00 33.01 29.27 1h61 s GLN 60 CO 0.02 -0.47 1.44 -0.84 0.01 0.00 0.00 175.29 175.45 1h61 h ILE 61 N 3.40 0.00 -2.80 1.08 3.07 -1.86 -0.70 117.51 119.70 1h61 h ILE 61 Ca -0.47 -0.51 0.10 0.00 1.55 0.00 0.00 64.86 65.53 1h61 h ILE 61 Cb 1.22 1.20 -0.06 0.00 -0.27 0.00 0.00 36.82 38.91 1h61 h ILE 61 CO 0.76 0.00 0.31 -0.94 -1.05 0.00 0.00 178.15 177.22 1h61 s SER 62 N -4.37 -0.25 0.25 2.16 1.04 -1.26 -4.59 113.70 106.67 1h61 s SER 62 Ca 0.07 -0.51 -0.02 0.00 0.48 0.00 0.00 55.95 55.97 1h61 s SER 62 Cb 0.13 0.65 0.31 0.00 0.10 0.00 0.00 66.02 67.21 1h61 s SER 62 CO 0.69 -1.19 1.73 0.00 0.98 0.00 0.00 173.24 175.44 1h61 h ALA 63 N 2.00 1.06 -0.05 5.32 0.00 -1.98 -2.36 119.26 123.24 1h61 h ALA 63 Ca -0.21 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1h61 h ALA 63 Cb 1.25 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1h61 h ALA 63 CO 0.24 0.58 -0.05 0.37 0.00 0.00 0.00 179.25 180.39 1h61 h GLN 64 N 0.68 0.08 0.00 0.00 4.15 -1.96 -2.15 115.11 115.91 1h61 h GLN 64 Ca 0.12 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.53 1h61 h GLN 64 Cb 0.54 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.22 1h61 h GLN 64 CO 0.03 0.13 0.00 0.00 -1.93 0.00 0.00 178.83 177.07 1h61 h ALA 65 N 1.88 1.00 -2.69 3.38 0.00 -1.76 -3.45 119.26 117.61 1h61 h ALA 65 Ca 0.02 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.40 1h61 h ALA 65 Cb 0.14 0.00 0.06 0.00 0.00 0.00 0.00 17.79 17.99 1h61 h ALA 65 CO 0.01 0.00 0.89 0.21 0.00 0.00 0.00 179.25 180.35 1h61 s LYS 66 N -3.79 4.18 0.00 0.00 2.20 -0.81 -1.58 119.74 119.95 1h61 s LYS 66 Ca -0.01 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.05 1h61 s LYS 66 Cb 0.10 -3.10 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 1h61 s LYS 66 CO 0.45 -0.61 0.00 0.41 -0.36 0.00 0.00 175.35 175.24 1h61 n GLY 67 N 3.14 0.81 2.99 5.54 0.00 -1.26 -4.74 105.19 111.66 1h61 n GLY 67 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1h61 n GLY 67 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h61 s TYR 68 N -0.44 0.82 0.06 1.61 1.51 -1.26 -4.42 117.35 115.24 1h61 s TYR 68 Ca 0.00 -0.19 -0.31 0.00 -1.01 0.00 0.00 57.07 55.57 1h61 s TYR 68 Cb 0.00 -0.58 -0.06 0.00 -0.11 0.00 0.00 41.96 41.21 1h61 s TYR 68 CO 0.00 -0.07 1.26 0.00 -1.11 0.00 0.00 175.55 175.63 1h61 s ALA 69 N 0.12 3.46 0.00 3.71 0.00 0.02 -2.84 121.76 126.24 1h61 s ALA 69 Ca -0.02 0.91 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1h61 s ALA 69 Cb -0.07 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1h61 s ALA 69 CO 0.00 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 175.64 1h61 n GLY 70 N 3.33 0.36 3.75 0.00 0.00 -1.26 -4.78 105.19 106.58 1h61 n GLY 70 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1h61 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h61 s ALA 71 N -2.05 3.35 0.64 4.61 0.00 -1.13 -1.19 121.76 125.99 1h61 s ALA 71 Ca 0.00 0.52 -0.11 0.00 0.00 0.00 0.00 51.96 52.37 1h61 s ALA 71 Cb 0.00 -3.14 -0.03 0.00 0.00 0.00 0.00 23.12 19.95 1h61 s ALA 71 CO 0.00 0.17 1.05 -1.25 0.00 0.00 0.00 175.76 175.72 1h61 s PRO 72 N -0.82 3.41 0.42 0.00 0.04 -1.26 -4.78 135.00 132.01 1h61 s PRO 72 Ca 0.41 0.68 0.07 0.00 0.04 0.00 0.00 61.00 62.20 1h61 s PRO 72 Cb -0.24 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.16 1h61 s PRO 72 CO 0.29 -0.69 0.03 0.20 0.04 0.00 0.00 177.00 176.87 1h61 s GLY 73 N -4.22 2.52 -0.31 0.56 0.00 -0.85 -0.85 107.32 104.18 1h61 s GLY 73 Ca 0.56 -2.19 0.19 0.00 0.00 0.00 0.00 44.72 43.28 1h61 s GLY 73 CO 0.53 -2.09 1.03 -0.10 0.00 0.00 0.00 173.10 172.48 1h61 n LEU 74 N -1.01 1.28 0.00 0.66 7.94 -0.27 -4.77 117.00 120.83 1h61 n LEU 74 Ca -0.05 -3.48 0.00 0.00 -1.11 0.00 0.00 56.01 51.37 1h61 n LEU 74 Cb 0.67 0.42 0.00 0.00 0.53 0.00 0.00 43.42 45.04 1h61 n LEU 74 CO 0.48 1.41 -0.33 0.00 -1.11 0.00 0.00 177.39 177.85 1h61 n HIS 75 N -0.28 0.00 -4.10 1.96 1.44 -1.26 -4.67 115.22 108.31 1h61 n HIS 75 Ca 0.07 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.56 1h61 n HIS 75 Cb 0.82 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.88 1h61 n HIS 75 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1h61 s SER 76 N -1.48 5.37 0.24 4.39 1.04 -1.26 -5.01 113.70 116.98 1h61 s SER 76 Ca 0.00 -0.33 -0.07 0.00 0.48 0.00 0.00 55.95 56.03 1h61 s SER 76 Cb 0.00 -1.28 0.23 0.00 0.10 0.00 0.00 66.02 65.06 1h61 s SER 76 CO 0.00 -0.07 1.91 -0.65 0.98 0.00 0.00 173.24 175.41 1h61 h PRO 77 N 1.51 1.23 -0.70 4.02 0.11 -1.99 -1.11 132.00 135.07 1h61 h PRO 77 Ca -0.48 -0.08 -0.05 0.00 0.11 0.00 0.00 66.00 65.50 1h61 h PRO 77 Cb 1.24 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 1h61 h PRO 77 CO 0.60 0.81 0.23 0.93 -0.21 0.00 0.00 178.00 180.36 1h61 h GLU 78 N 1.26 1.07 -0.33 1.05 3.07 -1.97 -0.60 114.58 118.14 1h61 h GLU 78 Ca 0.34 -0.22 -0.09 0.00 -0.50 0.00 0.00 59.36 58.89 1h61 h GLU 78 Cb -0.14 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.60 1h61 h GLU 78 CO -0.07 0.91 -0.14 1.96 -1.40 0.00 0.00 179.01 180.27 1h61 h GLN 79 N 1.04 0.68 -0.58 2.33 4.20 -1.77 -1.65 115.11 119.36 1h61 h GLN 79 Ca 0.23 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 1h61 h GLN 79 Cb 0.28 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1h61 h GLN 79 CO -0.01 0.88 0.35 0.82 -0.67 0.00 0.00 178.83 180.21 1h61 h ILE 80 N 0.46 1.17 -0.68 2.54 2.04 -0.97 0.24 117.51 122.30 1h61 h ILE 80 Ca 0.08 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 1h61 h ILE 80 Cb 0.67 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 1h61 h ILE 80 CO 0.04 0.18 0.34 0.00 0.00 0.00 0.00 178.15 178.71 1h61 h ALA 81 N 1.18 0.88 -0.34 1.87 0.00 -1.00 -0.91 119.26 120.94 1h61 h ALA 81 Ca 0.21 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1h61 h ALA 81 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1h61 h ALA 81 CO -0.04 0.43 -0.18 0.00 0.00 0.00 0.00 179.25 179.46 1h61 h ALA 82 N 1.16 0.48 -0.13 0.00 0.00 -0.95 -2.90 119.26 116.92 1h61 h ALA 82 Ca 0.24 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1h61 h ALA 82 Cb 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1h61 h ALA 82 CO -0.03 0.41 -0.17 -1.49 0.00 0.00 0.00 179.25 177.97 1h61 h TRP 83 N 0.49 0.21 -0.85 0.00 4.06 -0.78 -2.38 115.95 116.71 1h61 h TRP 83 Ca 0.07 -0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.02 1h61 h TRP 83 Cb 0.72 -0.06 -0.05 0.00 -1.00 0.00 0.00 29.16 28.77 1h61 h TRP 83 CO 0.06 0.37 0.56 0.87 -3.56 0.00 0.00 178.44 176.74 1h61 h LYS 84 N 0.19 1.07 -0.30 0.49 1.57 -0.97 0.14 116.57 118.76 1h61 h LYS 84 Ca 0.04 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.59 1h61 h LYS 84 Cb 0.41 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1h61 h LYS 84 CO 0.03 0.71 -0.46 0.87 -0.57 0.00 0.00 179.45 180.02 1h61 h LYS 85 N 1.10 0.79 -0.24 3.15 1.57 -1.34 -2.32 116.57 119.28 1h61 h LYS 85 Ca 0.33 -0.45 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 1h61 h LYS 85 Cb -0.04 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1h61 h LYS 85 CO -0.09 1.08 -0.00 0.82 -0.57 0.00 0.00 179.45 180.69 1h61 h ILE 86 N 0.63 1.26 -0.32 1.86 2.04 -1.01 -1.47 117.51 120.50 1h61 h ILE 86 Ca 0.04 -0.90 -0.07 0.00 1.00 0.00 0.00 64.86 64.92 1h61 h ILE 86 Cb 1.03 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 1h61 h ILE 86 CO 0.10 0.28 -0.11 0.71 0.00 0.00 0.00 178.15 179.13 1h61 h THR 87 N 0.19 1.23 -0.53 -0.27 1.35 -1.03 -2.15 112.91 111.71 1h61 h THR 87 Ca 0.07 -1.03 -0.07 0.00 -0.55 0.00 0.00 66.41 64.83 1h61 h THR 87 Cb 0.41 1.12 -0.02 0.00 -1.73 0.00 0.00 68.15 67.92 1h61 h THR 87 CO 0.01 0.34 0.06 0.00 -0.25 0.00 0.00 175.52 175.68 1h61 h ALA 88 N 1.38 1.12 -0.48 6.62 0.00 -1.25 -0.47 119.26 126.18 1h61 h ALA 88 Ca 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1h61 h ALA 88 Cb 0.50 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1h61 h ALA 88 CO 0.03 0.57 0.17 0.78 0.00 0.00 0.00 179.25 180.81 1h61 h GLY 89 N 0.99 0.78 0.99 0.00 0.00 -0.69 0.74 103.07 105.88 1h61 h GLY 89 Ca 0.16 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 47.01 1h61 h GLY 89 CO 0.01 0.41 0.15 -2.08 0.00 0.00 0.00 176.54 175.03 1h61 h VAL 90 N 0.63 1.24 -0.02 4.60 2.07 -1.09 -2.81 116.25 120.88 1h61 h VAL 90 Ca 0.16 -0.84 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 1h61 h VAL 90 Cb 0.22 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1h61 h VAL 90 CO -0.01 0.31 -0.43 0.45 0.02 0.00 0.00 177.57 177.91 1h61 h HIS 91 N 0.77 0.05 0.00 1.57 3.86 -0.84 -1.05 115.15 119.51 1h61 h HIS 91 Ca 0.17 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1h61 h HIS 91 Cb 0.31 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.77 1h61 h HIS 91 CO 0.02 0.46 -0.08 0.00 0.86 0.00 0.00 177.93 179.19 1h61 h ALA 92 N 1.54 1.32 -0.67 2.45 0.00 -0.59 -0.02 119.26 123.29 1h61 h ALA 92 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1h61 h ALA 92 Cb 0.77 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1h61 h ALA 92 CO 0.06 0.10 0.00 0.39 0.00 0.00 0.00 179.25 179.80 1h61 n GLU 93 N -3.65 3.63 -2.62 0.00 -0.58 -0.80 -4.94 120.64 111.67 1h61 n GLU 93 Ca -0.02 -2.88 -0.18 0.00 -0.42 0.00 0.00 57.16 53.67 1h61 n GLU 93 Cb 0.19 -1.86 0.01 0.00 -0.57 0.00 0.00 31.44 29.21 1h61 n GLU 93 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1h61 n ASP 94 N 1.21 -5.13 -4.74 1.62 2.03 -0.02 -4.82 116.55 106.70 1h61 n ASP 94 Ca 0.26 -0.13 -0.19 0.00 0.52 0.00 0.00 54.79 55.24 1h61 n ASP 94 Cb 0.86 -4.09 0.05 0.00 -0.72 0.00 0.00 41.12 37.22 1h61 n ASP 94 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1h61 n GLY 95 N -1.21 2.10 3.08 0.27 0.00 -0.47 -4.98 105.19 103.97 1h61 n GLY 95 Ca -0.14 -2.23 -0.20 0.00 0.00 0.00 0.00 46.02 43.45 1h61 n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h61 s ARG 96 N -4.40 0.88 -0.02 1.61 0.52 -1.26 -4.38 118.95 111.89 1h61 s ARG 96 Ca 0.52 -0.50 -0.01 0.00 -0.52 0.00 0.00 55.73 55.23 1h61 s ARG 96 Cb -0.04 -0.85 0.02 0.00 0.52 0.00 0.00 34.95 34.60 1h61 s ARG 96 CO 0.33 0.23 0.05 -1.50 0.02 0.00 0.00 175.30 174.42 1h61 s ILE 97 N -0.45 -0.04 0.03 1.52 2.07 -1.26 -1.16 121.20 121.91 1h61 s ILE 97 Ca 0.03 0.14 0.04 0.00 -1.41 0.00 0.00 60.65 59.44 1h61 s ILE 97 Cb -0.05 -0.09 -0.04 0.00 0.13 0.00 0.00 42.46 42.41 1h61 s ILE 97 CO 0.00 0.06 -0.05 0.00 -1.91 0.00 0.00 174.94 173.04 1h61 s ALA 98 N 0.73 3.09 -0.21 1.50 0.00 0.89 -0.89 121.76 126.87 1h61 s ALA 98 Ca -0.06 -1.05 -0.09 0.00 0.00 0.00 0.00 51.96 50.76 1h61 s ALA 98 Cb -0.08 -1.15 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 1h61 s ALA 98 CO -0.02 0.64 0.12 0.54 0.00 0.00 0.00 175.76 177.03 1h61 s VAL 99 N -1.08 5.13 -0.15 0.00 0.11 -0.82 -0.35 120.40 123.23 1h61 s VAL 99 Ca 0.19 0.10 -0.23 0.00 -2.93 0.00 0.00 61.98 59.11 1h61 s VAL 99 Cb -0.11 -3.36 -0.03 0.00 -1.53 0.00 0.00 36.38 31.35 1h61 s VAL 99 CO 0.10 0.40 0.71 -1.58 -3.33 0.00 0.00 175.10 171.40 1h61 s GLN 100 N 0.72 4.30 -0.15 1.54 0.74 -1.26 -0.70 119.66 124.86 1h61 s GLN 100 Ca 0.06 0.81 -0.03 0.00 0.05 0.00 0.00 55.36 56.25 1h61 s GLN 100 Cb -0.13 -3.54 -0.03 0.00 1.10 0.00 0.00 33.01 30.42 1h61 s GLN 100 CO 0.02 -0.18 -0.05 -0.51 -0.55 0.00 0.00 175.29 174.02 1h61 s LEU 101 N 1.66 3.21 0.20 3.68 1.43 0.22 -0.23 118.68 128.85 1h61 s LEU 101 Ca 0.34 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 1h61 s LEU 101 Cb -0.17 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 1h61 s LEU 101 CO 0.13 0.17 0.08 -1.66 0.23 0.00 0.00 176.35 175.31 1h61 s TRP 102 N 0.33 1.21 -0.08 0.29 1.48 -0.39 -1.05 118.94 120.72 1h61 s TRP 102 Ca -0.04 -1.24 -0.01 0.00 -1.06 0.00 0.00 56.10 53.75 1h61 s TRP 102 Cb -0.14 -0.66 0.03 0.00 -1.16 0.00 0.00 33.47 31.54 1h61 s TRP 102 CO 0.03 -0.46 -0.01 -1.58 -4.06 0.00 0.00 176.95 170.87 1h61 s HIS 103 N -3.94 0.81 -0.41 1.66 2.46 -1.26 -2.72 115.29 111.89 1h61 s HIS 103 Ca 0.33 -0.29 0.26 0.00 0.47 0.00 0.00 55.06 55.83 1h61 s HIS 103 Cb 0.07 -0.88 0.93 0.00 -0.13 0.00 0.00 32.58 32.57 1h61 s HIS 103 CO 0.09 -0.37 1.78 1.79 -2.47 0.00 0.00 174.74 175.55 1h61 h THR 104 N 6.32 0.00 0.00 0.89 1.35 -1.61 -0.84 112.91 119.02 1h61 h THR 104 Ca -0.21 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 1h61 h THR 104 Cb 1.13 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 1h61 h THR 104 CO 0.29 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.17 1h61 n GLY 105 N 0.51 3.31 0.06 5.82 0.00 -1.26 -2.02 105.19 111.60 1h61 n GLY 105 Ca 0.03 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 45.99 1h61 n GLY 105 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1h61 n ARG 106 N 14.00 0.07 -2.84 1.61 1.85 -1.02 -3.91 116.66 126.43 1h61 n ARG 106 Ca 0.00 0.40 -0.44 0.00 -1.00 0.00 0.00 57.85 56.81 1h61 n ARG 106 Cb 0.00 -1.67 0.00 0.00 -1.05 0.00 0.00 32.46 29.74 1h61 n ARG 106 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1h61 n ILE 107 N -1.82 4.22 -3.56 8.89 2.08 -0.86 -4.47 119.36 123.85 1h61 n ILE 107 Ca 0.02 -4.62 -0.05 0.00 0.56 0.00 0.00 62.75 58.66 1h61 n ILE 107 Cb 0.14 -2.45 0.02 0.00 -0.75 0.00 0.00 39.64 36.60 1h61 n ILE 107 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1h61 n SER 108 N 5.77 -1.49 -3.87 4.38 2.88 -1.25 -4.46 113.62 115.58 1h61 n SER 108 Ca 0.39 -2.01 -0.12 0.00 -1.33 0.00 0.00 58.87 55.80 1h61 n SER 108 Cb 0.42 2.48 -0.13 0.00 -0.75 0.00 0.00 64.21 66.23 1h61 n SER 108 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 1h61 s HIS 109 N -4.28 -0.02 0.47 0.66 2.46 -1.26 -1.75 115.29 111.57 1h61 s HIS 109 Ca 0.11 0.07 0.17 0.00 0.47 0.00 0.00 55.06 55.88 1h61 s HIS 109 Cb -0.03 -0.00 1.15 0.00 -0.13 0.00 0.00 32.58 33.57 1h61 s HIS 109 CO 0.07 -0.05 2.01 0.66 -2.47 0.00 0.00 174.74 174.96 1h61 h SER 110 N 5.88 0.22 0.30 9.88 4.64 -1.88 -2.17 113.55 130.43 1h61 h SER 110 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1h61 h SER 110 Cb 1.21 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1h61 h SER 110 CO 0.47 0.14 0.00 0.77 -0.87 0.00 0.00 176.83 177.34 1h61 h SER 111 N 0.25 0.00 -0.14 4.97 4.64 -1.86 -2.17 113.55 119.25 1h61 h SER 111 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1h61 h SER 111 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1h61 h SER 111 CO -0.05 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.21 1h61 n ILE 112 N -2.42 0.94 -3.20 0.95 -5.35 -0.82 -4.86 119.36 104.61 1h61 n ILE 112 Ca -0.00 -0.97 -0.26 0.00 -0.27 0.00 0.00 62.75 61.24 1h61 n ILE 112 Cb 0.12 0.53 -0.02 0.00 -1.74 0.00 0.00 39.64 38.54 1h61 n ILE 112 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1h61 s GLN 113 N -0.97 3.55 0.26 6.28 -1.52 -0.81 -4.88 119.66 121.57 1h61 s GLN 113 Ca 0.10 -0.11 -0.31 0.00 -1.95 0.00 0.00 55.36 53.09 1h61 s GLN 113 Cb 0.05 -2.59 -0.12 0.00 -0.22 0.00 0.00 33.01 30.13 1h61 s GLN 113 CO 0.07 0.09 1.66 -2.14 -0.25 0.00 0.00 175.29 174.71 1h61 s PRO 114 N -4.17 4.11 0.00 2.91 0.02 -1.26 -1.33 135.00 135.28 1h61 s PRO 114 Ca 0.43 2.61 0.00 0.00 0.02 0.00 0.00 61.00 64.06 1h61 s PRO 114 Cb -0.10 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.38 1h61 s PRO 114 CO 0.36 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 1h61 n GLY 115 N 2.91 0.44 2.27 0.52 0.00 -1.26 -2.96 105.19 107.10 1h61 n GLY 115 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 1h61 n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h61 n GLY 116 N -1.72 0.78 3.95 -0.02 0.00 -0.44 -5.01 105.19 102.72 1h61 n GLY 116 Ca 0.00 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.26 1h61 n GLY 116 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h61 s GLN 117 N -3.42 2.72 0.52 1.61 -1.52 -1.16 -4.60 119.66 113.81 1h61 s GLN 117 Ca 0.00 -0.41 -0.22 0.00 -1.95 0.00 0.00 55.36 52.78 1h61 s GLN 117 Cb 0.00 -2.39 -0.06 0.00 -0.22 0.00 0.00 33.01 30.34 1h61 s GLN 117 CO 0.00 -0.69 1.32 0.00 -0.25 0.00 0.00 175.29 175.67 1h61 s ALA 118 N -2.85 2.89 0.94 6.09 0.00 -1.26 -4.36 121.76 123.21 1h61 s ALA 118 Ca 0.55 1.26 -0.13 0.00 0.00 0.00 0.00 51.96 53.63 1h61 s ALA 118 Cb -0.10 -3.53 0.16 0.00 0.00 0.00 0.00 23.12 19.64 1h61 s ALA 118 CO 0.41 -1.20 1.14 -1.25 0.00 0.00 0.00 175.76 174.87 1h61 s PRO 119 N -2.81 0.88 0.27 0.00 0.04 -1.26 -4.72 135.00 127.39 1h61 s PRO 119 Ca 0.69 0.25 0.09 0.00 0.04 0.00 0.00 61.00 62.07 1h61 s PRO 119 Cb -0.38 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1h61 s PRO 119 CO 0.46 -2.37 0.07 0.14 0.04 0.00 0.00 177.00 175.33 1h61 s VAL 120 N -3.26 3.68 0.15 -0.36 -7.23 -1.26 -0.38 120.40 111.74 1h61 s VAL 120 Ca 0.65 -1.75 -0.07 0.00 -1.81 0.00 0.00 61.98 59.00 1h61 s VAL 120 Cb -0.14 -3.01 0.03 0.00 0.56 0.00 0.00 36.38 33.82 1h61 s VAL 120 CO 0.54 -0.35 0.36 -0.24 -0.31 0.00 0.00 175.10 175.10 1h61 n SER 121 N -1.00 -0.95 -0.11 4.85 2.88 -0.61 -2.42 113.62 116.25 1h61 n SER 121 Ca -0.06 -1.63 -0.12 0.00 -1.33 0.00 0.00 58.87 55.72 1h61 n SER 121 Cb 0.59 1.58 0.00 0.00 -0.75 0.00 0.00 64.21 65.63 1h61 n SER 121 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h61 h ALA 122 N 2.00 0.63 -2.44 -1.46 0.00 -1.86 -0.93 119.26 115.21 1h61 h ALA 122 Ca -0.14 -0.44 -0.21 0.00 0.00 0.00 0.00 54.91 54.12 1h61 h ALA 122 Cb 0.53 -0.13 -0.15 0.00 0.00 0.00 0.00 17.79 18.05 1h61 h ALA 122 CO 0.18 0.67 -0.64 -1.12 0.00 0.00 0.00 179.25 178.34 1h61 s SER 123 N -6.82 0.41 -1.37 0.00 0.01 -1.25 -4.35 113.70 100.32 1h61 s SER 123 Ca -0.11 -1.24 -0.11 0.00 1.31 0.00 0.00 55.95 55.80 1h61 s SER 123 Cb 0.12 0.29 0.11 0.00 0.21 0.00 0.00 66.02 66.74 1h61 s SER 123 CO 0.87 -0.73 2.06 0.00 0.41 0.00 0.00 173.24 175.85 1h61 n ALA 124 N -0.15 5.50 -3.45 1.44 0.00 -1.26 -4.45 120.51 118.13 1h61 n ALA 124 Ca -0.04 -4.11 -0.25 0.00 0.00 0.00 0.00 53.44 49.04 1h61 n ALA 124 Cb 0.64 -3.24 -0.17 0.00 0.00 0.00 0.00 19.45 16.69 1h61 n ALA 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1h61 s LEU 125 N 0.90 1.66 0.42 0.00 1.43 -1.26 -4.86 118.68 116.97 1h61 s LEU 125 Ca 0.43 -0.31 -0.25 0.00 -1.03 0.00 0.00 54.13 52.98 1h61 s LEU 125 Cb 0.12 -0.84 -0.08 0.00 0.03 0.00 0.00 46.19 45.42 1h61 s LEU 125 CO -0.04 0.04 1.21 0.21 0.23 0.00 0.00 176.35 178.00 1h61 s ASN 126 N 0.65 6.30 0.54 2.29 2.47 -1.26 -4.41 114.94 121.52 1h61 s ASN 126 Ca -0.15 2.44 0.32 0.00 0.42 0.00 0.00 52.86 55.90 1h61 s ASN 126 Cb -0.16 -2.62 1.35 0.00 -1.45 0.00 0.00 41.25 38.38 1h61 s ASN 126 CO 0.04 -0.83 1.98 0.00 -3.72 0.00 0.00 177.10 174.57 1h61 h ALA 127 N 2.44 1.02 -5.97 1.71 0.00 -1.85 -3.47 119.26 113.13 1h61 h ALA 127 Ca -0.49 -0.04 -0.41 0.00 0.00 0.00 0.00 54.91 53.97 1h61 h ALA 127 Cb 1.24 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 19.12 1h61 h ALA 127 CO 0.62 0.05 -0.72 0.09 0.00 0.00 0.00 179.25 179.28 1h61 n ASN 128 N -3.16 -5.03 -2.42 0.00 3.02 -1.26 -4.84 115.26 101.56 1h61 n ASN 128 Ca 0.00 -0.64 -0.12 0.00 -0.03 0.00 0.00 54.58 53.80 1h61 n ASN 128 Cb 0.31 -4.65 -0.04 0.00 -0.61 0.00 0.00 39.78 34.79 1h61 n ASN 128 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1h61 n THR 129 N -4.76 0.00 -4.34 3.41 5.66 -1.26 -5.03 114.28 107.96 1h61 n THR 129 Ca -0.04 -1.43 -0.31 0.00 -3.05 0.00 0.00 64.05 59.22 1h61 n THR 129 Cb 0.57 0.78 -0.16 0.00 -1.55 0.00 0.00 70.33 69.97 1h61 n THR 129 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1h61 s ARG 130 N -2.73 2.72 0.62 1.09 0.52 -1.26 -1.47 118.95 118.43 1h61 s ARG 130 Ca 0.23 -0.73 -0.05 0.00 -0.52 0.00 0.00 55.73 54.66 1h61 s ARG 130 Cb 0.00 -2.31 0.13 0.00 0.52 0.00 0.00 34.95 33.30 1h61 s ARG 130 CO 0.17 -0.13 0.85 -2.37 0.02 0.00 0.00 175.30 173.84 1h61 n THR 131 N 4.40 0.00 -4.13 0.02 5.66 -0.00 -4.70 114.28 115.53 1h61 n THR 131 Ca -0.19 -1.00 -0.34 0.00 -3.05 0.00 0.00 64.05 59.46 1h61 n THR 131 Cb 0.51 -1.26 -0.14 0.00 -1.55 0.00 0.00 70.33 67.88 1h61 n THR 131 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1h61 s SER 132 N -4.30 4.11 0.19 1.09 0.15 -1.26 -1.19 113.70 112.49 1h61 s SER 132 Ca 0.53 -0.40 0.01 0.00 0.70 0.00 0.00 55.95 56.78 1h61 s SER 132 Cb -0.02 -1.68 0.01 0.00 -1.71 0.00 0.00 66.02 62.61 1h61 s SER 132 CO 0.36 0.03 0.06 0.18 1.20 0.00 0.00 173.24 175.07 1h61 n LEU 133 N 4.47 0.00 -4.24 3.45 4.77 0.51 -0.80 117.00 125.15 1h61 n LEU 133 Ca -0.18 -1.12 -0.29 0.00 -0.03 0.00 0.00 56.01 54.38 1h61 n LEU 133 Cb 0.51 0.07 -0.16 0.00 -2.33 0.00 0.00 43.42 41.51 1h61 n LEU 133 CO 0.29 -0.25 -0.54 -0.13 -1.33 0.00 0.00 177.39 175.42 1h61 s ARG 134 N -2.74 1.96 0.44 3.23 0.52 -1.26 -0.68 118.95 120.43 1h61 s ARG 134 Ca 0.05 -0.81 -0.06 0.00 -0.52 0.00 0.00 55.73 54.39 1h61 s ARG 134 Cb -0.00 -1.82 0.10 0.00 0.52 0.00 0.00 34.95 33.74 1h61 s ARG 134 CO 0.03 0.44 0.60 -0.40 0.02 0.00 0.00 175.30 175.99 1h61 n ASP 135 N 2.67 0.18 0.28 0.23 5.68 0.09 -4.84 116.55 120.84 1h61 n ASP 135 Ca -0.16 -1.30 0.19 0.00 -0.50 0.00 0.00 54.79 53.02 1h61 n ASP 135 Cb 0.52 -0.45 1.00 0.00 -1.14 0.00 0.00 41.12 41.05 1h61 n ASP 135 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1h61 h GLU 136 N 0.00 0.00 -0.28 0.11 9.09 -2.01 -0.53 114.58 120.96 1h61 h GLU 136 Ca -0.19 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.22 1h61 h GLU 136 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 1h61 h GLU 136 CO 0.15 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.30 1h61 n ASN 137 N -2.81 3.27 0.00 3.06 3.02 -1.26 -4.95 115.26 115.60 1h61 n ASN 137 Ca -0.02 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 1h61 n ASN 137 Cb 0.09 -0.18 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1h61 n ASN 137 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h61 n GLY 138 N 1.39 0.61 3.84 7.41 0.00 -0.21 -5.04 105.19 113.19 1h61 n GLY 138 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1h61 n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h61 s ASN 139 N -2.05 6.87 0.27 1.61 0.01 -1.26 -4.74 114.94 115.65 1h61 s ASN 139 Ca 0.00 1.14 -0.30 0.00 -0.71 0.00 0.00 52.86 52.99 1h61 s ASN 139 Cb 0.00 -2.31 -0.10 0.00 0.41 0.00 0.00 41.25 39.25 1h61 s ASN 139 CO 0.00 0.10 1.36 0.00 -1.51 0.00 0.00 177.10 177.05 1h61 s ALA 140 N -1.46 3.56 0.00 0.60 0.00 -1.26 -0.73 121.76 122.47 1h61 s ALA 140 Ca 0.38 1.26 -0.01 0.00 0.00 0.00 0.00 51.96 53.59 1h61 s ALA 140 Cb -0.15 -3.51 -0.01 0.00 0.00 0.00 0.00 23.12 19.45 1h61 s ALA 140 CO 0.19 -0.66 0.02 0.96 0.00 0.00 0.00 175.76 176.27 1h61 s ILE 141 N -0.42 0.04 -0.11 0.00 -4.36 0.15 -4.87 121.20 111.63 1h61 s ILE 141 Ca 0.55 -0.37 -0.20 0.00 -0.26 0.00 0.00 60.65 60.36 1h61 s ILE 141 Cb -0.40 -0.15 -0.04 0.00 1.25 0.00 0.00 42.46 43.12 1h61 s ILE 141 CO 0.46 -0.20 0.57 -0.13 0.24 0.00 0.00 174.94 175.87 1h61 s ARG 142 N -0.61 4.35 0.01 0.37 0.52 -1.26 -0.36 118.95 121.97 1h61 s ARG 142 Ca -0.07 0.61 0.02 0.00 -0.52 0.00 0.00 55.73 55.77 1h61 s ARG 142 Cb -0.04 -3.46 -0.01 0.00 0.52 0.00 0.00 34.95 31.96 1h61 s ARG 142 CO -0.00 0.07 -0.07 0.54 0.02 0.00 0.00 175.30 175.86 1h61 s VAL 143 N 0.86 0.55 0.35 3.52 0.11 -0.34 -4.96 120.40 120.49 1h61 s VAL 143 Ca 0.30 -0.46 -0.28 0.00 -2.93 0.00 0.00 61.98 58.61 1h61 s VAL 143 Cb -0.16 -0.49 -0.12 0.00 -1.53 0.00 0.00 36.38 34.08 1h61 s VAL 143 CO 0.13 0.04 1.41 0.47 -3.33 0.00 0.00 175.10 173.82 1h61 n ASP 144 N 2.60 3.33 -4.77 3.54 8.00 -1.26 -0.82 116.55 127.17 1h61 n ASP 144 Ca -0.15 1.21 -0.36 0.00 0.71 0.00 0.00 54.79 56.20 1h61 n ASP 144 Cb 0.57 -1.56 0.01 0.00 -0.02 0.00 0.00 41.12 40.12 1h61 n ASP 144 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1h61 s THR 145 N -1.03 2.99 0.14 -3.53 -4.23 -0.54 -4.78 115.64 104.65 1h61 s THR 145 Ca 0.55 0.66 -0.24 0.00 -1.18 0.00 0.00 61.69 61.48 1h61 s THR 145 Cb -0.52 -3.29 -0.08 0.00 1.34 0.00 0.00 72.50 69.95 1h61 s THR 145 CO 0.62 -0.09 0.74 -0.89 -0.54 0.00 0.00 174.62 174.46 1h61 s THR 146 N -1.64 4.46 0.20 3.99 2.01 -0.72 -4.86 115.64 119.08 1h61 s THR 146 Ca 0.71 1.61 -0.32 0.00 0.31 0.00 0.00 61.69 64.00 1h61 s THR 146 Cb -0.27 -4.09 -0.11 0.00 0.01 0.00 0.00 72.50 68.03 1h61 s THR 146 CO 0.31 0.52 1.63 -0.89 -0.69 0.00 0.00 174.62 175.50 1h61 s THR 147 N -1.06 2.32 0.73 -0.82 2.01 -1.26 -4.75 115.64 112.82 1h61 s THR 147 Ca 0.35 0.24 -0.08 0.00 0.31 0.00 0.00 61.69 62.50 1h61 s THR 147 Cb -0.22 -3.15 0.06 0.00 0.01 0.00 0.00 72.50 69.20 1h61 s THR 147 CO 0.25 0.02 1.06 -2.16 -0.69 0.00 0.00 174.62 173.10 1h61 s PRO 148 N 0.94 2.15 -0.10 4.92 0.04 -1.26 -4.50 135.00 137.19 1h61 s PRO 148 Ca 0.71 -0.13 -0.03 0.00 0.04 0.00 0.00 61.00 61.59 1h61 s PRO 148 Cb -0.47 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 31.94 1h61 s PRO 148 CO 0.34 -1.33 0.02 0.50 0.04 0.00 0.00 177.00 176.57 1h61 s ARG 149 N -5.34 3.18 0.09 4.56 3.52 0.49 -4.42 118.95 121.04 1h61 s ARG 149 Ca 0.60 -0.37 -0.30 0.00 -0.13 0.00 0.00 55.73 55.53 1h61 s ARG 149 Cb -0.11 -2.90 -0.06 0.00 -1.56 0.00 0.00 34.95 30.33 1h61 s ARG 149 CO 0.46 0.65 1.13 0.00 -0.81 0.00 0.00 175.30 176.72 1h61 s ALA 150 N -0.71 3.35 0.32 6.12 0.00 -1.26 -1.57 121.76 128.00 1h61 s ALA 150 Ca 0.11 0.79 -0.29 0.00 0.00 0.00 0.00 51.96 52.57 1h61 s ALA 150 Cb -0.12 -3.39 -0.11 0.00 0.00 0.00 0.00 23.12 19.50 1h61 s ALA 150 CO 0.02 -0.32 1.46 -0.51 0.00 0.00 0.00 175.76 176.42 1h61 s LEU 151 N 0.53 4.36 0.45 0.00 1.43 -0.35 -4.89 118.68 120.21 1h61 s LEU 151 Ca 0.54 2.87 -0.20 0.00 -1.03 0.00 0.00 54.13 56.31 1h61 s LEU 151 Cb -0.28 -3.65 -0.10 0.00 0.03 0.00 0.00 46.19 42.19 1h61 s LEU 151 CO 0.31 -0.77 0.97 -1.61 0.23 0.00 0.00 176.35 175.48 1h61 s GLU 152 N -1.33 4.11 0.25 1.70 0.41 -1.26 -4.95 118.70 117.63 1h61 s GLU 152 Ca 0.55 1.14 -0.04 0.00 -0.41 0.00 0.00 54.97 56.22 1h61 s GLU 152 Cb -0.44 -2.16 0.48 0.00 -1.78 0.00 0.00 34.13 30.23 1h61 s GLU 152 CO 0.54 -0.14 1.69 -0.07 -0.49 0.00 0.00 175.26 176.79 1h61 h LEU 153 N 1.72 0.05 0.00 1.80 3.38 -2.02 0.13 115.31 120.37 1h61 h LEU 153 Ca -0.49 0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1h61 h LEU 153 Cb 1.19 0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1h61 h LEU 153 CO 0.61 -0.03 0.00 -0.90 0.09 0.00 0.00 178.44 178.21 1h61 n ASP 154 N -5.14 0.00 0.04 -0.43 5.68 -1.26 -2.17 116.55 113.27 1h61 n ASP 154 Ca 0.15 -0.08 0.11 0.00 -0.50 0.00 0.00 54.79 54.47 1h61 n ASP 154 Cb 0.47 -0.20 -0.01 0.00 -1.14 0.00 0.00 41.12 40.25 1h61 n ASP 154 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1h61 n GLU 155 N -1.20 0.40 -0.17 0.11 1.02 0.46 -4.40 120.64 116.87 1h61 n GLU 155 Ca 0.08 -0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.14 1h61 n GLU 155 Cb 0.09 -1.63 0.02 0.00 -0.02 0.00 0.00 31.44 29.90 1h61 n GLU 155 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1h61 h ILE 156 N 0.00 1.15 -0.68 -3.67 5.03 -1.45 -2.40 117.51 115.49 1h61 h ILE 156 Ca 0.00 -0.34 0.09 0.00 -0.12 0.00 0.00 64.86 64.50 1h61 h ILE 156 Cb 0.82 0.46 -0.04 0.00 -3.03 0.00 0.00 36.82 35.03 1h61 h ILE 156 CO 0.00 0.15 0.45 -0.65 -0.68 0.00 0.00 178.15 177.42 1h61 h PRO 157 N 0.68 0.55 -0.80 2.37 0.11 -1.78 -0.97 132.00 132.16 1h61 h PRO 157 Ca 0.18 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.22 1h61 h PRO 157 Cb -0.02 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 30.93 1h61 h PRO 157 CO -0.03 0.36 0.33 0.78 -0.21 0.00 0.00 178.00 179.22 1h61 h GLY 158 N 0.56 1.28 0.95 -0.55 0.00 -1.69 -0.46 103.07 103.16 1h61 h GLY 158 Ca 0.31 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 1h61 h GLY 158 CO -0.10 0.65 0.16 -2.22 0.00 0.00 0.00 176.54 175.03 1h61 h ILE 159 N 1.16 1.21 -0.74 2.60 1.08 -1.01 -0.61 117.51 121.20 1h61 h ILE 159 Ca 0.27 -0.65 -0.01 0.00 -0.39 0.00 0.00 64.86 64.08 1h61 h ILE 159 Cb 0.21 0.82 -0.04 0.00 -3.07 0.00 0.00 36.82 34.74 1h61 h ILE 159 CO -0.02 0.24 0.44 0.58 -0.69 0.00 0.00 178.15 178.69 1h61 h VAL 160 N 0.56 1.21 -0.19 1.67 2.07 -1.02 -2.19 116.25 118.37 1h61 h VAL 160 Ca 0.14 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1h61 h VAL 160 Cb 0.21 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1h61 h VAL 160 CO -0.01 0.23 -0.19 -1.13 0.02 0.00 0.00 177.57 176.49 1h61 h ASN 161 N 1.02 0.32 -0.62 0.57 -1.24 -0.72 -1.53 115.58 113.38 1h61 h ASN 161 Ca 0.27 -0.09 -0.09 0.00 0.71 0.00 0.00 56.30 57.10 1h61 h ASN 161 Cb -0.02 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 38.92 1h61 h ASN 161 CO -0.05 0.53 0.03 0.44 -1.29 0.00 0.00 177.43 177.10 1h61 h ASP 162 N 0.30 1.05 -0.45 1.15 3.32 -0.51 0.10 116.42 121.39 1h61 h ASP 162 Ca 0.05 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.76 1h61 h ASP 162 Cb 0.51 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1h61 h ASP 162 CO 0.03 1.08 0.05 -0.26 -1.72 0.00 0.00 179.24 178.42 1h61 h PHE 163 N 1.00 0.82 -0.32 4.55 0.04 -1.08 -1.02 116.94 120.92 1h61 h PHE 163 Ca 0.18 -0.13 0.01 0.00 2.80 0.00 0.00 57.97 60.84 1h61 h PHE 163 Cb 0.52 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 1h61 h PHE 163 CO 0.04 0.79 0.20 -0.09 -0.60 0.00 0.00 178.31 178.64 1h61 h ARG 164 N 0.62 0.40 -0.61 1.51 2.43 -0.93 -1.74 114.38 116.06 1h61 h ARG 164 Ca 0.13 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 1h61 h ARG 164 Cb 0.43 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 1h61 h ARG 164 CO 0.01 0.26 0.09 0.37 -1.51 0.00 0.00 179.97 179.20 1h61 h GLN 165 N 0.41 1.00 -0.60 0.20 5.75 -0.69 -1.64 115.11 119.55 1h61 h GLN 165 Ca 0.12 -0.25 -0.06 0.00 -0.15 0.00 0.00 58.65 58.31 1h61 h GLN 165 Cb -0.02 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.38 1h61 h GLN 165 CO -0.05 0.92 0.14 0.00 -2.65 0.00 0.00 178.83 177.20 1h61 h ALA 166 N 1.16 1.13 -0.37 3.38 0.00 -0.90 -0.07 119.26 123.59 1h61 h ALA 166 Ca 0.19 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1h61 h ALA 166 Cb 0.41 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1h61 h ALA 166 CO 0.01 0.59 -0.31 0.28 0.00 0.00 0.00 179.25 179.82 1h61 h VAL 167 N 0.89 1.28 -0.79 0.00 2.07 -1.01 0.14 116.25 118.82 1h61 h VAL 167 Ca 0.19 -1.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.22 1h61 h VAL 167 Cb 0.33 1.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1h61 h VAL 167 CO 0.00 0.48 0.38 0.00 0.02 0.00 0.00 177.57 178.46 1h61 h ALA 168 N 0.97 1.02 -0.41 1.67 0.00 -0.78 -1.61 119.26 120.11 1h61 h ALA 168 Ca 0.08 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1h61 h ALA 168 Cb 0.85 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1h61 h ALA 168 CO 0.07 0.58 -0.11 -0.91 0.00 0.00 0.00 179.25 178.89 1h61 h ASN 169 N 1.11 0.72 -0.84 0.00 2.35 -0.55 -2.64 115.58 115.74 1h61 h ASN 169 Ca 0.27 -0.21 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1h61 h ASN 169 Cb 0.11 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.25 1h61 h ASN 169 CO -0.03 0.85 0.41 0.00 -1.65 0.00 0.00 177.43 177.01 1h61 h ALA 170 N 1.22 1.14 -0.19 -0.83 0.00 -0.07 0.09 119.26 120.61 1h61 h ALA 170 Ca 0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1h61 h ALA 170 Cb 0.57 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1h61 h ALA 170 CO 0.04 0.66 0.09 -0.09 0.00 0.00 0.00 179.25 179.95 1h61 h ARG 171 N 1.20 0.28 -0.21 0.00 2.43 -1.03 -2.23 114.38 114.82 1h61 h ARG 171 Ca 0.29 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.37 1h61 h ARG 171 Cb 0.11 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1h61 h ARG 171 CO -0.04 0.30 -0.11 1.49 -1.51 0.00 0.00 179.97 180.11 1h61 h GLU 172 N 0.18 0.34 0.00 0.20 4.81 -1.12 -2.39 114.58 116.61 1h61 h GLU 172 Ca 0.07 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1h61 h GLU 172 Cb 0.12 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1h61 h GLU 172 CO -0.01 0.46 0.00 0.00 -0.73 0.00 0.00 179.01 178.73 1h61 n ALA 173 N -2.49 1.90 -0.43 2.92 0.00 -0.01 -4.88 120.51 117.52 1h61 n ALA 173 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1h61 n ALA 173 Cb 0.28 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1h61 n ALA 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h61 n GLY 174 N 0.22 0.77 3.78 0.00 0.00 -0.90 -3.83 105.19 105.24 1h61 n GLY 174 Ca 0.07 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1h61 n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h61 s PHE 175 N -2.00 2.78 0.02 1.61 0.08 -0.87 -4.90 117.98 114.70 1h61 s PHE 175 Ca 0.00 1.55 0.10 0.00 0.12 0.00 0.00 56.93 58.71 1h61 s PHE 175 Cb 0.00 -3.21 -0.22 0.00 -0.57 0.00 0.00 43.02 39.01 1h61 s PHE 175 CO 0.00 -1.33 0.92 -0.44 -0.10 0.00 0.00 175.22 174.27 1h61 h ASP 176 N 1.31 0.00 -5.26 1.36 3.32 -1.35 -3.44 116.42 112.37 1h61 h ASP 176 Ca -0.50 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.46 1h61 h ASP 176 Cb 1.25 -0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.72 1h61 h ASP 176 CO 0.58 1.01 -0.09 -0.76 -1.72 0.00 0.00 179.24 178.25 1h61 s LEU 177 N -6.35 0.38 0.02 1.55 1.43 -1.23 -4.87 118.68 109.62 1h61 s LEU 177 Ca -0.02 -1.02 0.04 0.00 -1.03 0.00 0.00 54.13 52.10 1h61 s LEU 177 Cb 0.09 1.84 -0.02 0.00 0.03 0.00 0.00 46.19 48.13 1h61 s LEU 177 CO 0.82 -1.22 -0.13 -0.69 0.23 0.00 0.00 176.35 175.37 1h61 s VAL 178 N -3.73 1.04 -0.18 -1.59 1.01 -0.23 -1.95 120.40 114.76 1h61 s VAL 178 Ca 0.23 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1h61 s VAL 178 Cb -0.01 -0.93 0.03 0.00 0.00 0.00 0.00 36.38 35.47 1h61 s VAL 178 CO 0.11 0.07 -0.15 -0.70 0.00 0.00 0.00 175.10 174.43 1h61 s GLU 179 N -0.90 2.50 -0.05 2.72 2.12 0.12 -0.28 118.70 124.94 1h61 s GLU 179 Ca 0.02 -0.82 -0.30 0.00 0.36 0.00 0.00 54.97 54.23 1h61 s GLU 179 Cb -0.07 -2.45 -0.03 0.00 0.26 0.00 0.00 34.13 31.85 1h61 s GLU 179 CO 0.01 -0.31 1.11 -0.51 -0.54 0.00 0.00 175.26 175.02 1h61 s LEU 180 N 1.35 4.29 -0.97 2.70 1.43 -0.25 -0.61 118.68 126.62 1h61 s LEU 180 Ca 0.02 1.73 -0.21 0.00 -1.03 0.00 0.00 54.13 54.64 1h61 s LEU 180 Cb -0.14 -3.56 0.09 0.00 0.03 0.00 0.00 46.19 42.60 1h61 s LEU 180 CO -0.10 -0.49 1.29 -2.28 0.23 0.00 0.00 176.35 175.00 1h61 s HIS 181 N 1.85 2.79 -0.35 0.29 2.46 -0.21 -0.96 115.29 121.15 1h61 s HIS 181 Ca 0.53 -1.07 0.07 0.00 0.47 0.00 0.00 55.06 55.06 1h61 s HIS 181 Cb -0.23 -4.50 0.57 0.00 -0.13 0.00 0.00 32.58 28.29 1h61 s HIS 181 CO 0.22 -1.73 1.64 0.45 -2.47 0.00 0.00 174.74 172.85 1h61 n SER 182 N 7.83 2.94 -2.70 9.88 2.88 -0.21 -4.53 113.62 129.71 1h61 n SER 182 Ca 0.28 -3.73 -0.13 0.00 -1.33 0.00 0.00 58.87 53.96 1h61 n SER 182 Cb 0.50 -0.72 -0.04 0.00 -0.75 0.00 0.00 64.21 63.21 1h61 n SER 182 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h61 n ALA 183 N -1.13 0.30 -2.65 -1.46 0.00 -1.10 -4.22 120.51 110.24 1h61 n ALA 183 Ca 0.44 -1.08 -0.15 0.00 0.00 0.00 0.00 53.44 52.65 1h61 n ALA 183 Cb 1.28 0.73 -0.00 0.00 0.00 0.00 0.00 19.45 21.46 1h61 n ALA 183 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1h61 n HIS 184 N -0.47 -1.53 -1.05 0.00 8.25 -1.26 -2.57 115.22 116.59 1h61 n HIS 184 Ca -0.03 0.12 -0.02 0.00 -0.26 0.00 0.00 57.72 57.53 1h61 n HIS 184 Cb 0.32 -2.81 -0.01 0.00 1.12 0.00 0.00 29.99 28.61 1h61 n HIS 184 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h61 n GLY 185 N -0.90 0.53 1.42 -1.41 0.00 -1.26 -4.66 105.19 98.91 1h61 n GLY 185 Ca -0.11 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 1h61 n GLY 185 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1h61 n TYR 186 N -2.82 -3.72 -0.19 1.61 4.01 -1.06 -4.54 117.16 110.46 1h61 n TYR 186 Ca -0.02 -0.51 -0.06 0.00 -0.16 0.00 0.00 57.90 57.15 1h61 n TYR 186 Cb 0.12 -0.34 -0.01 0.00 -0.31 0.00 0.00 39.34 38.81 1h61 n TYR 186 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1h61 h LEU 187 N 0.00 -1.24 -0.85 7.72 5.85 -1.22 0.25 115.31 125.82 1h61 h LEU 187 Ca -0.14 0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.82 1h61 h LEU 187 Cb 0.44 0.59 -0.04 0.00 0.37 0.00 0.00 40.66 42.02 1h61 h LEU 187 CO 0.12 -0.32 0.56 -0.07 -0.34 0.00 0.00 178.44 178.39 1h61 h LEU 188 N -0.20 0.96 -1.00 2.25 3.38 -1.80 -1.54 115.31 117.37 1h61 h LEU 188 Ca 0.21 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 1h61 h LEU 188 Cb 0.56 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1h61 h LEU 188 CO -0.66 0.69 -0.49 -0.74 0.09 0.00 0.00 178.44 177.33 1h61 h HIS 189 N 1.13 0.00 -0.29 1.13 2.76 -1.49 -1.99 115.15 116.41 1h61 h HIS 189 Ca 0.32 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.46 1h61 h HIS 189 Cb -0.10 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 1h61 h HIS 189 CO -0.01 0.49 0.06 1.96 -1.30 0.00 0.00 177.93 179.13 1h61 h GLN 190 N 0.00 0.42 0.16 5.26 4.20 0.46 -0.64 115.11 124.97 1h61 h GLN 190 Ca -0.00 -0.06 -0.30 0.00 0.06 0.00 0.00 58.65 58.34 1h61 h GLN 190 Cb 0.89 -0.07 0.02 0.00 0.30 0.00 0.00 27.48 28.62 1h61 h GLN 190 CO 0.06 0.40 -1.31 0.74 -0.67 0.00 0.00 178.83 178.06 1h61 h PHE 191 N 0.41 0.79 -0.35 2.96 -1.00 -1.05 -3.27 116.94 115.44 1h61 h PHE 191 Ca 0.10 -0.55 -0.05 0.00 2.81 0.00 0.00 57.97 60.28 1h61 h PHE 191 Cb 0.18 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.68 1h61 h PHE 191 CO 0.01 1.41 -0.01 -0.07 -1.61 0.00 0.00 178.31 178.04 1h61 h LEU 192 N 0.16 0.51 -9.40 1.54 3.38 -0.74 -3.42 115.31 107.33 1h61 h LEU 192 Ca -0.19 -0.10 -0.57 0.00 0.09 0.00 0.00 57.88 57.11 1h61 h LEU 192 Cb 2.00 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 42.55 1h61 h LEU 192 CO 0.24 0.59 -0.04 -0.55 0.09 0.00 0.00 178.44 178.76 1h61 s SER 193 N -6.73 6.85 0.49 -0.43 0.15 -0.31 -4.84 113.70 108.89 1h61 s SER 193 Ca -0.08 1.02 0.23 0.00 0.70 0.00 0.00 55.95 57.82 1h61 s SER 193 Cb 0.15 -2.34 1.28 0.00 -1.71 0.00 0.00 66.02 63.40 1h61 s SER 193 CO 0.77 0.00 2.03 -0.65 1.20 0.00 0.00 173.24 176.60 1h61 h PRO 194 N 6.38 0.00 0.00 5.44 0.11 -1.84 -1.18 132.00 140.91 1h61 h PRO 194 Ca -0.42 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.63 1h61 h PRO 194 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1h61 h PRO 194 CO 0.73 0.15 -0.25 0.66 -0.21 0.00 0.00 178.00 179.09 1h61 h SER 195 N 0.00 0.00 -0.01 -2.05 4.64 -1.92 -3.15 113.55 111.06 1h61 h SER 195 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h61 h SER 195 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1h61 h SER 195 CO 0.02 0.25 -0.07 -1.54 -0.87 0.00 0.00 176.83 174.62 1h61 n SER 196 N -3.75 1.18 -4.02 4.97 3.41 -0.98 -4.93 113.62 109.49 1h61 n SER 196 Ca -0.01 -1.09 -0.31 0.00 -0.26 0.00 0.00 58.87 57.19 1h61 n SER 196 Cb 0.35 0.26 -0.15 0.00 -0.26 0.00 0.00 64.21 64.41 1h61 n SER 196 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1h61 s ASN 197 N -0.77 4.40 -0.18 4.04 3.84 -0.48 -3.88 114.94 121.91 1h61 s ASN 197 Ca 0.06 -1.54 0.16 0.00 0.21 0.00 0.00 52.86 51.75 1h61 s ASN 197 Cb 0.05 -1.48 0.40 0.00 -0.55 0.00 0.00 41.25 39.68 1h61 s ASN 197 CO 0.11 -0.25 1.28 0.00 -2.79 0.00 0.00 177.10 175.45 1h61 n GLN 198 N 4.45 1.85 -1.85 0.43 6.02 -1.26 -4.66 117.38 122.36 1h61 n GLN 198 Ca -0.09 -2.84 -0.36 0.00 -0.01 0.00 0.00 57.00 53.70 1h61 n GLN 198 Cb 0.42 -1.66 0.05 0.00 1.02 0.00 0.00 30.24 30.08 1h61 n GLN 198 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1h61 s ARG 199 N -2.97 2.74 0.00 -1.09 0.52 -1.26 -4.95 118.95 111.93 1h61 s ARG 199 Ca 0.37 1.85 0.09 0.00 -0.52 0.00 0.00 55.73 57.52 1h61 s ARG 199 Cb 0.33 -1.90 0.18 0.00 0.52 0.00 0.00 34.95 34.08 1h61 s ARG 199 CO 0.03 -1.40 1.04 0.25 0.02 0.00 0.00 175.30 175.24 1h61 n THR 200 N -1.88 0.60 -2.05 0.02 -2.24 -1.26 -4.07 114.28 103.39 1h61 n THR 200 Ca 0.14 -0.80 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 1h61 n THR 200 Cb 0.49 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 1h61 n THR 200 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1h61 n ASP 201 N 0.42 0.00 0.00 3.42 5.68 -1.26 -4.94 116.55 119.86 1h61 n ASP 201 Ca 0.08 -0.38 0.09 0.00 -0.50 0.00 0.00 54.79 54.08 1h61 n ASP 201 Cb 0.33 0.00 0.52 0.00 -1.14 0.00 0.00 41.12 40.83 1h61 n ASP 201 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1h61 n GLN 202 N -0.38 0.55 -0.32 0.11 0.00 -1.26 -2.53 117.38 113.55 1h61 n GLN 202 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 57.00 57.09 1h61 n GLN 202 Cb 0.00 -1.50 0.25 0.00 0.00 0.00 0.00 30.24 28.99 1h61 n GLN 202 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1h61 n TYR 203 N -1.00 0.81 -4.06 2.61 4.01 -1.26 -4.49 117.16 113.77 1h61 n TYR 203 Ca 0.13 -0.53 -0.08 0.00 -0.16 0.00 0.00 57.90 57.27 1h61 n TYR 203 Cb 0.06 -0.05 -0.10 0.00 -0.31 0.00 0.00 39.34 38.94 1h61 n TYR 203 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1h61 s GLY 204 N -1.03 0.49 0.00 2.72 0.00 -1.05 -4.21 107.32 104.24 1h61 s GLY 204 Ca 0.38 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.94 1h61 s GLY 204 CO 0.24 -1.25 0.00 0.61 0.00 0.00 0.00 173.10 172.70 1h61 n GLY 205 N 0.05 1.04 3.65 0.20 0.00 -1.26 -4.70 105.19 104.17 1h61 n GLY 205 Ca -0.13 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.62 1h61 n GLY 205 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h61 s SER 206 N -4.00 2.79 0.38 1.61 1.04 -1.26 -4.72 113.70 109.54 1h61 s SER 206 Ca 0.00 1.90 0.09 0.00 0.48 0.00 0.00 55.95 58.42 1h61 s SER 206 Cb 0.00 -2.45 0.77 0.00 0.10 0.00 0.00 66.02 64.44 1h61 s SER 206 CO 0.00 -3.13 1.92 1.62 0.98 0.00 0.00 173.24 174.63 1h61 h VAL 207 N -1.89 1.17 -0.78 5.02 3.04 -1.96 0.24 116.25 121.09 1h61 h VAL 207 Ca -0.48 -0.73 -0.02 0.00 -1.01 0.00 0.00 66.70 64.46 1h61 h VAL 207 Cb 1.28 1.12 -0.04 0.00 -2.01 0.00 0.00 31.29 31.65 1h61 h VAL 207 CO 0.46 0.23 0.41 -0.33 -1.01 0.00 0.00 177.57 177.34 1h61 h GLU 208 N 0.28 1.10 -0.20 4.17 3.07 -1.97 -0.27 114.58 120.76 1h61 h GLU 208 Ca 0.06 -0.14 -0.21 0.00 -0.50 0.00 0.00 59.36 58.57 1h61 h GLU 208 Cb 0.33 -0.21 0.01 0.00 -0.84 0.00 0.00 28.75 28.04 1h61 h GLU 208 CO 0.02 0.83 -0.71 -0.91 -1.40 0.00 0.00 179.01 176.84 1h61 h ASN 209 N 1.09 0.96 0.21 1.42 4.21 -1.57 -2.46 115.58 119.44 1h61 h ASN 209 Ca 0.27 -0.59 -0.07 0.00 1.21 0.00 0.00 56.30 57.12 1h61 h ASN 209 Cb 0.06 -0.28 -0.01 0.00 -1.12 0.00 0.00 38.32 36.97 1h61 h ASN 209 CO -0.04 1.39 -0.28 0.03 -1.29 0.00 0.00 177.43 177.24 1h61 h ARG 210 N 0.58 0.12 -0.01 0.81 3.08 -0.71 -2.56 114.38 115.69 1h61 h ARG 210 Ca -0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1h61 h ARG 210 Cb 1.33 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.37 1h61 h ARG 210 CO 0.15 0.40 -0.25 0.00 -1.07 0.00 0.00 179.97 179.20 1h61 n ALA 211 N -2.48 3.07 -0.09 0.04 0.00 -0.14 -3.36 120.51 117.55 1h61 n ALA 211 Ca -0.02 -0.45 -0.06 0.00 0.00 0.00 0.00 53.44 52.92 1h61 n ALA 211 Cb 0.36 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1h61 n ALA 211 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1h61 h ARG 212 N 1.59 0.02 0.28 0.00 2.43 -1.00 -1.94 114.38 115.76 1h61 h ARG 212 Ca 0.00 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1h61 h ARG 212 Cb 0.55 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1h61 h ARG 212 CO 0.00 0.01 -0.13 1.25 -1.51 0.00 0.00 179.97 179.59 1h61 h LEU 213 N 0.02 -0.32 -1.25 3.80 5.85 -1.77 -0.61 115.31 121.03 1h61 h LEU 213 Ca 0.16 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1h61 h LEU 213 Cb 0.24 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 1h61 h LEU 213 CO -0.32 -0.23 0.51 1.62 -0.34 0.00 0.00 178.44 179.67 1h61 h VAL 214 N -0.38 1.19 -0.06 1.05 3.04 -1.81 -0.66 116.25 118.62 1h61 h VAL 214 Ca -0.04 -0.35 -0.13 0.00 -1.01 0.00 0.00 66.70 65.17 1h61 h VAL 214 Cb 0.29 0.07 -0.01 0.00 -2.01 0.00 0.00 31.29 29.63 1h61 h VAL 214 CO 0.06 0.19 -0.55 -0.07 -1.01 0.00 0.00 177.57 176.20 1h61 h LEU 215 N 1.03 0.20 -0.73 3.16 3.38 -1.15 0.20 115.31 121.40 1h61 h LEU 215 Ca 0.28 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 1h61 h LEU 215 Cb -0.11 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1h61 h LEU 215 CO -0.06 0.70 -0.14 -0.33 0.09 0.00 0.00 178.44 178.70 1h61 h GLU 216 N 0.14 0.82 -0.29 1.13 5.08 -0.28 -1.05 114.58 120.13 1h61 h GLU 216 Ca 0.00 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.01 1h61 h GLU 216 Cb 1.01 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1h61 h GLU 216 CO 0.08 0.92 -0.02 0.28 -1.00 0.00 0.00 179.01 179.27 1h61 h VAL 217 N 0.74 1.26 -0.42 3.13 2.07 -0.72 -1.06 116.25 121.26 1h61 h VAL 217 Ca 0.12 -0.98 0.03 0.00 0.82 0.00 0.00 66.70 66.69 1h61 h VAL 217 Cb 0.65 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 1h61 h VAL 217 CO 0.05 0.31 0.22 0.58 0.02 0.00 0.00 177.57 178.75 1h61 h VAL 218 N 0.31 0.99 -0.76 2.57 2.07 -0.74 -0.90 116.25 119.79 1h61 h VAL 218 Ca 0.08 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1h61 h VAL 218 Cb 0.46 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1h61 h VAL 218 CO 0.02 0.08 0.37 0.44 0.02 0.00 0.00 177.57 178.49 1h61 h ASP 219 N 0.44 0.99 -0.55 0.57 3.32 -1.07 -1.33 116.42 118.78 1h61 h ASP 219 Ca 0.18 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 1h61 h ASP 219 Cb 0.07 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1h61 h ASP 219 CO -0.11 0.84 0.20 0.00 -1.72 0.00 0.00 179.24 178.45 1h61 h ALA 220 N 1.18 0.71 0.00 3.45 0.00 -0.67 -1.90 119.26 122.03 1h61 h ALA 220 Ca 0.26 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 1h61 h ALA 220 Cb 0.12 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1h61 h ALA 220 CO -0.03 0.34 -0.70 -0.39 0.00 0.00 0.00 179.25 178.47 1h61 h VAL 221 N 0.75 1.39 -0.47 0.00 -1.51 -1.02 -1.03 116.25 114.36 1h61 h VAL 221 Ca 0.18 -2.49 -0.13 0.00 -1.23 0.00 0.00 66.70 63.03 1h61 h VAL 221 Cb 0.23 2.38 -0.01 0.00 -2.13 0.00 0.00 31.29 31.75 1h61 h VAL 221 CO -0.01 0.69 -0.21 0.00 -1.23 0.00 0.00 177.57 176.80 1h61 h ASN 223 N 0.84 0.93 -0.08 0.00 -0.73 -1.25 -3.01 115.58 112.28 1h61 h ASN 223 Ca 0.11 -0.44 -0.00 0.00 1.87 0.00 0.00 56.30 57.84 1h61 h ASN 223 Cb 0.78 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 39.11 1h61 h ASN 223 CO 0.07 1.22 0.04 -0.08 -0.37 0.00 0.00 177.43 178.30 1h61 h GLU 224 N 0.69 0.11 0.00 6.67 4.57 -1.05 -3.44 114.58 122.14 1h61 h GLU 224 Ca 0.05 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1h61 h GLU 224 Cb 1.01 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.58 1h61 h GLU 224 CO 0.10 0.21 0.00 1.87 -1.18 0.00 0.00 179.01 180.01 1h61 n TRP 225 N -4.96 0.00 -3.64 0.92 -0.00 -0.70 -4.99 117.44 104.08 1h61 n TRP 225 Ca -0.06 0.00 -0.15 0.00 -0.00 0.00 0.00 57.50 57.29 1h61 n TRP 225 Cb 0.10 0.00 -0.08 0.00 -0.00 0.00 0.00 31.31 31.33 1h61 n TRP 225 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1h61 s SER 226 N 0.10 -0.54 0.43 5.87 0.15 -1.14 -4.95 113.70 113.62 1h61 s SER 226 Ca 0.00 0.79 0.12 0.00 0.70 0.00 0.00 55.95 57.56 1h61 s SER 226 Cb 0.00 0.78 0.99 0.00 -1.71 0.00 0.00 66.02 66.08 1h61 s SER 226 CO 0.00 -0.40 2.00 0.00 1.20 0.00 0.00 173.24 176.04 1h61 h ALA 227 N 4.15 1.94 0.00 5.45 0.00 -1.88 -1.00 119.26 127.93 1h61 h ALA 227 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1h61 h ALA 227 Cb 1.16 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1h61 h ALA 227 CO 0.28 -0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.08 1h61 n ASP 228 N -4.47 0.00 -0.21 0.00 5.75 -1.26 -2.04 116.55 114.32 1h61 n ASP 228 Ca 0.08 -1.51 0.03 0.00 -0.01 0.00 0.00 54.79 53.39 1h61 n ASP 228 Cb 0.30 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.40 1h61 n ASP 228 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1h61 n ARG 229 N -0.58 1.34 -4.11 0.11 5.12 -0.38 -0.92 116.66 117.25 1h61 n ARG 229 Ca 0.03 -0.68 -0.35 0.00 -1.93 0.00 0.00 57.85 54.93 1h61 n ARG 229 Cb 0.01 -1.05 -0.11 0.00 -1.16 0.00 0.00 32.46 30.15 1h61 n ARG 229 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1h61 s ILE 230 N -0.87 4.29 0.29 0.55 -1.09 -0.86 -1.07 121.20 122.43 1h61 s ILE 230 Ca 0.07 -0.21 0.08 0.00 -2.23 0.00 0.00 60.65 58.36 1h61 s ILE 230 Cb 0.06 -2.93 -0.06 0.00 -1.58 0.00 0.00 42.46 37.95 1h61 s ILE 230 CO 0.14 0.45 -0.09 -0.83 -1.23 0.00 0.00 174.94 173.37 1h61 s GLY 231 N 0.67 1.89 -0.08 6.18 0.00 0.62 -0.52 107.32 116.08 1h61 s GLY 231 Ca 0.01 -1.93 -0.07 0.00 0.00 0.00 0.00 44.72 42.73 1h61 s GLY 231 CO 0.02 -1.89 0.22 -1.50 0.00 0.00 0.00 173.10 169.95 1h61 s ILE 232 N -2.86 -0.00 -0.14 0.90 2.07 -0.96 -1.09 121.20 119.11 1h61 s ILE 232 Ca 0.30 0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 59.52 1h61 s ILE 232 Cb 0.02 -0.32 -0.03 0.00 0.13 0.00 0.00 42.46 42.27 1h61 s ILE 232 CO 0.13 0.01 -0.04 -0.60 -1.91 0.00 0.00 174.94 172.52 1h61 s ARG 233 N 0.21 3.53 0.11 3.50 3.52 -0.13 -0.57 118.95 129.11 1h61 s ARG 233 Ca -0.01 -0.52 0.04 0.00 -0.13 0.00 0.00 55.73 55.11 1h61 s ARG 233 Cb -0.02 -2.86 -0.04 0.00 -1.56 0.00 0.00 34.95 30.47 1h61 s ARG 233 CO -0.00 0.31 -0.11 0.14 -0.81 0.00 0.00 175.30 174.83 1h61 s VAL 234 N 0.17 1.08 -0.41 7.11 -7.23 -0.31 -1.04 120.40 119.77 1h61 s VAL 234 Ca -0.02 -1.76 0.08 0.00 -1.81 0.00 0.00 61.98 58.47 1h61 s VAL 234 Cb -0.14 -1.52 0.26 0.00 0.56 0.00 0.00 36.38 35.54 1h61 s VAL 234 CO 0.03 -0.58 0.55 -1.54 -0.31 0.00 0.00 175.10 173.25 1h61 n SER 235 N 0.36 0.49 0.00 4.85 3.41 -1.26 -0.89 113.62 120.58 1h61 n SER 235 Ca -0.14 -2.77 0.14 0.00 -0.26 0.00 0.00 58.87 55.84 1h61 n SER 235 Cb 0.58 -0.64 0.71 0.00 -0.26 0.00 0.00 64.21 64.60 1h61 n SER 235 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1h61 n PRO 236 N 1.30 0.31 -4.20 4.33 -0.04 -1.26 -4.76 135.00 130.68 1h61 n PRO 236 Ca 0.22 0.01 -0.31 0.00 -0.04 0.00 0.00 63.50 63.37 1h61 n PRO 236 Cb 0.53 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.32 1h61 n PRO 236 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1h61 s ILE 237 N -2.68 1.79 0.00 0.52 -1.09 -1.26 -4.73 121.20 113.75 1h61 s ILE 237 Ca 0.24 -0.78 0.00 0.00 -2.23 0.00 0.00 60.65 57.88 1h61 s ILE 237 Cb 0.20 -1.63 0.00 0.00 -1.58 0.00 0.00 42.46 39.44 1h61 s ILE 237 CO 0.47 0.50 0.00 0.61 -1.23 0.00 0.00 174.94 175.28 1h61 n GLY 238 N 4.56 -1.60 3.32 6.18 0.00 -1.26 -4.85 105.19 111.53 1h61 n GLY 238 Ca -0.19 -2.06 -0.32 0.00 0.00 0.00 0.00 46.02 43.45 1h61 n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h61 s THR 239 N 0.00 2.27 -0.08 2.61 2.01 -1.26 -3.22 115.64 117.97 1h61 s THR 239 Ca 0.00 -1.00 -0.01 0.00 0.31 0.00 0.00 61.69 60.99 1h61 s THR 239 Cb 0.00 -1.83 0.03 0.00 0.01 0.00 0.00 72.50 70.70 1h61 s THR 239 CO 0.00 0.57 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.12 1h61 s PHE 240 N -0.36 0.93 -1.49 4.92 0.40 -0.12 -4.65 117.98 117.62 1h61 s PHE 240 Ca 0.02 -0.35 -0.06 0.00 -0.60 0.00 0.00 56.93 55.95 1h61 s PHE 240 Cb -0.12 -0.92 0.05 0.00 0.51 0.00 0.00 43.02 42.54 1h61 s PHE 240 CO 0.02 -0.37 0.57 1.04 0.70 0.00 0.00 175.22 177.18 1h61 n GLN 241 N 4.95 -3.54 -0.82 0.44 6.02 -1.26 -0.77 117.38 122.40 1h61 n GLN 241 Ca -0.11 0.42 0.00 0.00 -0.01 0.00 0.00 57.00 57.31 1h61 n GLN 241 Cb 0.50 -4.78 0.00 0.00 1.02 0.00 0.00 30.24 26.98 1h61 n GLN 241 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1h61 n ASN 242 N -2.90 0.00 -4.33 1.08 5.15 -1.26 -4.90 115.26 108.10 1h61 n ASN 242 Ca -0.18 0.00 -0.38 0.00 -0.60 0.00 0.00 54.58 53.42 1h61 n ASN 242 Cb 0.62 -0.24 -0.12 0.00 -0.53 0.00 0.00 39.78 39.51 1h61 n ASN 242 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1h61 s VAL 243 N -3.57 4.02 0.24 3.44 -7.23 0.05 -5.00 120.40 112.36 1h61 s VAL 243 Ca 0.00 -0.81 -0.02 0.00 -1.81 0.00 0.00 61.98 59.35 1h61 s VAL 243 Cb 0.00 -3.14 0.05 0.00 0.56 0.00 0.00 36.38 33.85 1h61 s VAL 243 CO 0.00 -0.02 0.33 -0.90 -0.31 0.00 0.00 175.10 174.20 1h61 n ASP 244 N 4.87 0.29 -0.51 4.85 5.68 -1.26 -0.95 116.55 129.53 1h61 n ASP 244 Ca -0.14 -1.28 0.07 0.00 -0.50 0.00 0.00 54.79 52.94 1h61 n ASP 244 Cb 0.47 -0.23 0.19 0.00 -1.14 0.00 0.00 41.12 40.41 1h61 n ASP 244 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1h61 n ASN 245 N -3.06 2.62 0.00 -1.12 3.02 -1.20 -4.69 115.26 110.83 1h61 n ASN 245 Ca 0.05 -3.31 0.00 0.00 -0.03 0.00 0.00 54.58 51.29 1h61 n ASN 245 Cb 0.18 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.84 1h61 n ASN 245 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h61 n GLY 246 N -1.12 -1.47 0.00 7.41 0.00 -1.26 -3.82 105.19 104.93 1h61 n GLY 246 Ca 0.20 -1.55 0.13 0.00 0.00 0.00 0.00 46.02 44.81 1h61 n GLY 246 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h61 n PRO 247 N -1.58 0.60 -2.65 1.61 -0.04 -1.26 -3.52 135.00 128.17 1h61 n PRO 247 Ca 0.00 0.02 -0.09 0.00 -0.04 0.00 0.00 63.50 63.39 1h61 n PRO 247 Cb 0.00 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 31.99 1h61 n PRO 247 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1h61 n ASN 248 N -1.15 2.15 -0.28 3.54 4.13 -1.26 -4.95 115.26 117.44 1h61 n ASN 248 Ca 0.16 -2.68 0.02 0.00 1.68 0.00 0.00 54.58 53.76 1h61 n ASN 248 Cb 0.16 -0.49 0.15 0.00 -1.54 0.00 0.00 39.78 38.06 1h61 n ASN 248 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 1h61 h GLU 249 N 2.75 0.73 0.17 3.52 4.11 -1.66 -0.85 114.58 123.36 1h61 h GLU 249 Ca -0.03 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.35 1h61 h GLU 249 Cb 1.21 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1h61 h GLU 249 CO 0.45 0.48 -0.08 1.49 0.07 0.00 0.00 179.01 181.43 1h61 h GLU 250 N 0.75 -0.22 -0.63 1.06 4.81 -1.91 0.37 114.58 118.80 1h61 h GLU 250 Ca 0.38 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.61 1h61 h GLU 250 Cb 0.33 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1h61 h GLU 250 CO -0.24 -0.02 0.34 0.00 -0.73 0.00 0.00 179.01 178.37 1h61 h ALA 251 N 0.41 0.81 -0.38 2.92 0.00 -1.94 -1.68 119.26 119.40 1h61 h ALA 251 Ca -0.02 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1h61 h ALA 251 Cb 0.31 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1h61 h ALA 251 CO 0.04 0.34 0.00 -0.44 0.00 0.00 0.00 179.25 179.19 1h61 h ASP 252 N 0.87 0.56 -0.40 0.00 5.19 -1.08 -1.77 116.42 119.78 1h61 h ASP 252 Ca 0.22 -0.11 -0.06 0.00 -0.62 0.00 0.00 57.03 56.46 1h61 h ASP 252 Cb 0.05 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.40 1h61 h ASP 252 CO -0.03 0.63 0.02 0.00 -3.12 0.00 0.00 179.24 176.74 1h61 h ALA 253 N 1.44 0.54 -0.20 3.45 0.00 -0.42 -2.16 119.26 121.91 1h61 h ALA 253 Ca 0.12 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1h61 h ALA 253 Cb 0.36 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1h61 h ALA 253 CO 0.01 0.30 -0.22 -0.07 0.00 0.00 0.00 179.25 179.27 1h61 h LEU 254 N 0.53 0.35 0.02 0.00 3.38 -0.99 -0.70 115.31 117.90 1h61 h LEU 254 Ca 0.12 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1h61 h LEU 254 Cb 0.44 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1h61 h LEU 254 CO 0.02 0.59 -0.01 0.22 0.09 0.00 0.00 178.44 179.34 1h61 h TYR 255 N 0.32 -0.02 -0.40 1.13 3.20 -1.15 -0.46 116.97 119.60 1h61 h TYR 255 Ca 0.05 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.94 1h61 h TYR 255 Cb 0.57 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.82 1h61 h TYR 255 CO 0.01 0.15 0.23 1.25 -1.64 0.00 0.00 178.16 178.16 1h61 h LEU 256 N -0.19 0.36 -0.72 2.82 6.46 -1.12 -1.33 115.31 121.59 1h61 h LEU 256 Ca -0.00 0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 1h61 h LEU 256 Cb 0.18 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.01 1h61 h LEU 256 CO 0.00 0.26 0.32 0.40 -0.62 0.00 0.00 178.44 178.80 1h61 h ILE 257 N 0.46 1.24 -0.74 4.05 2.04 -1.02 0.14 117.51 123.68 1h61 h ILE 257 Ca 0.16 -0.72 -0.05 0.00 1.00 0.00 0.00 64.86 65.26 1h61 h ILE 257 Cb 0.02 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 1h61 h ILE 257 CO -0.08 0.29 0.27 -0.33 0.00 0.00 0.00 178.15 178.30 1h61 h GLU 258 N 1.02 1.12 -0.57 2.37 5.08 -0.73 -0.71 114.58 122.14 1h61 h GLU 258 Ca 0.24 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 1h61 h GLU 258 Cb 0.16 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1h61 h GLU 258 CO -0.03 0.92 -0.02 0.93 -1.00 0.00 0.00 179.01 179.82 1h61 h GLU 259 N 1.08 1.02 -0.70 2.33 4.39 -0.72 -2.85 114.58 119.14 1h61 h GLU 259 Ca 0.25 -0.33 -0.05 0.00 0.34 0.00 0.00 59.36 59.56 1h61 h GLU 259 Cb 0.24 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 1h61 h GLU 259 CO -0.02 1.02 0.22 -0.07 -1.16 0.00 0.00 179.01 179.01 1h61 h LEU 260 N 0.91 1.00 -1.64 1.33 3.38 -0.60 -2.61 115.31 117.09 1h61 h LEU 260 Ca 0.16 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1h61 h LEU 260 Cb 0.57 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1h61 h LEU 260 CO 0.03 0.93 0.25 0.00 0.09 0.00 0.00 178.44 179.75 1h61 h ALA 261 N 1.20 1.75 0.00 1.53 0.00 -0.92 -1.52 119.26 121.30 1h61 h ALA 261 Ca 0.23 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1h61 h ALA 261 Cb 0.29 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1h61 h ALA 261 CO -0.01 0.23 -0.02 0.87 0.00 0.00 0.00 179.25 180.32 1h61 h LYS 262 N 0.50 0.00 -0.00 0.00 1.57 -1.25 -1.19 116.57 116.19 1h61 h LYS 262 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1h61 h LYS 262 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1h61 h LYS 262 CO -0.03 0.02 -0.19 0.54 -0.57 0.00 0.00 179.45 179.22 1h61 n ARG 263 N -3.93 0.41 -3.70 3.15 3.00 -0.57 -4.95 116.66 110.06 1h61 n ARG 263 Ca -0.03 -0.16 -0.26 0.00 -0.01 0.00 0.00 57.85 57.39 1h61 n ARG 263 Cb 0.11 -1.50 0.06 0.00 0.00 0.00 0.00 32.46 31.13 1h61 n ARG 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1h61 n GLY 264 N 1.38 -0.53 3.77 -0.13 0.00 -0.45 -4.84 105.19 104.39 1h61 n GLY 264 Ca 0.11 0.24 -0.30 0.00 0.00 0.00 0.00 46.02 46.06 1h61 n GLY 264 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1h61 s ILE 265 N -3.32 3.07 0.11 -0.61 -4.36 -1.26 -4.39 121.20 110.44 1h61 s ILE 265 Ca 0.60 0.35 -0.21 0.00 -0.26 0.00 0.00 60.65 61.12 1h61 s ILE 265 Cb -0.28 -2.97 -0.11 0.00 1.25 0.00 0.00 42.46 40.35 1h61 s ILE 265 CO 0.76 -0.45 1.76 0.00 0.24 0.00 0.00 174.94 177.25 1h61 h ALA 266 N -1.20 0.12 -2.86 2.27 0.00 -0.28 -3.43 119.26 113.88 1h61 h ALA 266 Ca -0.47 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1h61 h ALA 266 Cb 1.26 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.90 1h61 h ALA 266 CO 0.56 -0.39 0.03 1.52 0.00 0.00 0.00 179.25 180.98 1h61 s TYR 267 N -6.18 -0.26 -0.20 0.00 -0.85 -1.19 -2.16 117.35 106.51 1h61 s TYR 267 Ca -0.13 -0.04 0.01 0.00 -0.52 0.00 0.00 57.07 56.40 1h61 s TYR 267 Cb 0.07 0.38 0.03 0.00 0.38 0.00 0.00 41.96 42.82 1h61 s TYR 267 CO 0.68 -0.81 -0.18 -1.17 -1.52 0.00 0.00 175.55 172.55 1h61 s LEU 268 N -2.81 2.39 -0.31 -3.49 2.96 0.21 -2.27 118.68 115.37 1h61 s LEU 268 Ca 0.04 -0.78 -0.07 0.00 -0.22 0.00 0.00 54.13 53.10 1h61 s LEU 268 Cb 0.00 -1.50 0.01 0.00 0.50 0.00 0.00 46.19 45.21 1h61 s LEU 268 CO -0.09 -0.04 0.09 -2.28 -1.32 0.00 0.00 176.35 172.71 1h61 s HIS 269 N 1.26 3.17 -0.36 5.38 5.65 0.26 -0.73 115.29 129.92 1h61 s HIS 269 Ca 0.02 -1.05 -0.13 0.00 0.25 0.00 0.00 55.06 54.15 1h61 s HIS 269 Cb -0.14 -2.27 -0.00 0.00 -1.18 0.00 0.00 32.58 28.99 1h61 s HIS 269 CO -0.11 -0.61 0.24 -1.64 -0.65 0.00 0.00 174.74 171.97 1h61 s MET 270 N 1.49 3.25 -0.44 2.88 1.00 0.33 -1.16 119.30 126.64 1h61 s MET 270 Ca 0.02 -0.81 -0.22 0.00 0.00 0.00 0.00 55.69 54.67 1h61 s MET 270 Cb -0.18 -3.82 0.02 0.00 0.00 0.00 0.00 34.83 30.86 1h61 s MET 270 CO 0.03 -0.56 0.75 0.45 0.00 0.00 0.00 175.02 175.69 1h61 s SER 271 N 1.68 6.39 0.21 3.03 0.15 -0.07 -1.86 113.70 123.23 1h61 s SER 271 Ca 0.05 -0.16 0.15 0.00 0.70 0.00 0.00 55.95 56.69 1h61 s SER 271 Cb -0.18 -2.37 -0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1h61 s SER 271 CO 0.09 -0.87 1.27 -0.33 1.20 0.00 0.00 173.24 174.60 1h61 h GLU 272 N 8.94 0.00 -3.75 5.44 5.08 -1.43 -3.40 114.58 125.46 1h61 h GLU 272 Ca -0.25 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.00 1h61 h GLU 272 Cb 1.09 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.18 1h61 h GLU 272 CO 0.94 0.50 -0.44 0.95 -1.00 0.00 0.00 179.01 179.96 1h61 s THR 273 N -2.92 0.13 0.74 1.13 -4.23 -1.26 -4.85 115.64 104.38 1h61 s THR 273 Ca 0.02 -1.11 -0.03 0.00 -1.18 0.00 0.00 61.69 59.39 1h61 s THR 273 Cb 0.08 -1.09 0.12 0.00 1.34 0.00 0.00 72.50 72.95 1h61 s THR 273 CO 0.77 -0.61 1.02 1.51 -0.54 0.00 0.00 174.62 176.77 1h61 s ASP 274 N -2.41 4.29 0.40 3.99 -4.77 -1.26 -4.83 116.67 112.08 1h61 s ASP 274 Ca -0.01 -0.19 0.11 0.00 -3.30 0.00 0.00 52.55 49.16 1h61 s ASP 274 Cb 0.02 -0.20 0.92 0.00 -1.09 0.00 0.00 42.92 42.56 1h61 s ASP 274 CO -0.07 -1.90 1.95 -0.07 0.70 0.00 0.00 175.17 175.78 1h61 h LEU 275 N -0.64 0.49 0.00 2.11 3.38 -2.01 -3.43 115.31 115.21 1h61 h LEU 275 Ca -0.38 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1h61 h LEU 275 Cb 1.27 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1h61 h LEU 275 CO 0.42 0.29 0.00 0.00 0.09 0.00 0.00 178.44 179.25 1h61 n ALA 276 N -2.49 0.00 -0.83 1.53 0.00 -1.26 -5.03 120.51 112.44 1h61 n ALA 276 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.22 1h61 n ALA 276 Cb 0.36 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.92 1h61 n ALA 276 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h61 n GLY 277 N 5.00 -2.64 3.62 0.00 0.00 -1.26 -5.02 105.19 104.89 1h61 n GLY 277 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1h61 n GLY 277 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h61 s GLY 278 N -1.76 0.31 0.08 -0.02 0.00 -1.26 -4.51 107.32 100.16 1h61 s GLY 278 Ca 0.53 3.50 -0.31 0.00 0.00 0.00 0.00 44.72 48.44 1h61 s GLY 278 CO 0.70 2.73 1.73 0.54 0.00 0.00 0.00 173.10 178.80 1h61 s LYS 279 N 1.26 4.17 0.47 2.90 3.01 -1.26 -4.96 119.74 125.33 1h61 s LYS 279 Ca -0.08 2.43 -0.25 0.00 -1.01 0.00 0.00 55.97 57.06 1h61 s LYS 279 Cb -0.03 -3.66 -0.08 0.00 -1.01 0.00 0.00 37.83 33.05 1h61 s LYS 279 CO -0.13 -0.79 1.42 -2.14 0.51 0.00 0.00 175.35 174.22 1h61 s PRO 280 N 2.89 3.57 0.25 -1.68 0.02 -1.26 -4.96 135.00 133.83 1h61 s PRO 280 Ca 0.77 2.39 -0.30 0.00 0.02 0.00 0.00 61.00 63.88 1h61 s PRO 280 Cb -0.42 -2.58 -0.09 0.00 0.02 0.00 0.00 34.50 31.43 1h61 s PRO 280 CO 0.34 -0.90 1.29 0.71 -0.33 0.00 0.00 177.00 178.11 1h61 s TYR 281 N -1.22 3.23 0.44 6.54 1.51 -1.26 -5.01 117.35 121.57 1h61 s TYR 281 Ca 0.63 1.33 -0.18 0.00 -1.01 0.00 0.00 57.07 57.84 1h61 s TYR 281 Cb -0.43 -3.60 -0.10 0.00 -0.11 0.00 0.00 41.96 37.73 1h61 s TYR 281 CO 0.55 -1.75 0.92 -1.54 -1.11 0.00 0.00 175.55 172.62 1h61 s SER 282 N -0.05 6.80 0.46 2.29 1.04 -1.26 -4.94 113.70 118.04 1h61 s SER 282 Ca 0.53 1.56 0.14 0.00 0.48 0.00 0.00 55.95 58.66 1h61 s SER 282 Cb -0.37 -2.49 1.04 0.00 0.10 0.00 0.00 66.02 64.29 1h61 s SER 282 CO 0.43 -0.40 2.02 -0.33 0.98 0.00 0.00 173.24 175.94 1h61 h GLU 283 N 1.64 0.03 -0.46 4.02 5.08 -1.99 -1.59 114.58 121.31 1h61 h GLU 283 Ca -0.48 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 57.84 1h61 h GLU 283 Cb 1.18 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1h61 h GLU 283 CO 0.62 0.16 0.15 0.00 -1.00 0.00 0.00 179.01 178.94 1h61 h ALA 284 N 1.84 0.60 -0.50 3.43 0.00 -1.99 -0.85 119.26 121.78 1h61 h ALA 284 Ca 0.01 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1h61 h ALA 284 Cb 0.25 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1h61 h ALA 284 CO 0.02 0.25 0.04 0.35 0.00 0.00 0.00 179.25 179.90 1h61 h PHE 285 N 0.60 0.93 -0.80 0.00 3.57 -1.75 -1.60 116.94 117.89 1h61 h PHE 285 Ca 0.15 -0.15 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1h61 h PHE 285 Cb 0.26 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.71 1h61 h PHE 285 CO 0.01 0.86 0.53 0.00 -2.23 0.00 0.00 178.31 177.48 1h61 h ARG 286 N 0.73 0.96 -0.56 1.11 3.08 -1.06 -0.77 114.38 117.88 1h61 h ARG 286 Ca 0.15 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 1h61 h ARG 286 Cb 0.46 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1h61 h ARG 286 CO 0.02 0.64 0.01 1.96 -1.07 0.00 0.00 179.97 181.52 1h61 h GLN 287 N 0.99 0.98 -0.52 0.04 1.08 -0.73 -0.05 115.11 116.91 1h61 h GLN 287 Ca 0.32 -0.31 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 1h61 h GLN 287 Cb 0.03 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 1h61 h GLN 287 CO -0.09 0.98 0.15 0.87 -0.95 0.00 0.00 178.83 179.79 1h61 h LYS 288 N 0.87 0.78 -0.05 1.46 1.57 -0.31 -1.87 116.57 119.01 1h61 h LYS 288 Ca 0.16 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1h61 h LYS 288 Cb 0.53 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 1h61 h LYS 288 CO 0.03 0.69 -0.06 0.28 -0.57 0.00 0.00 179.45 179.81 1h61 h VAL 289 N 0.76 1.40 -0.69 0.50 2.07 -0.90 -3.23 116.25 116.16 1h61 h VAL 289 Ca 0.17 -1.29 0.09 0.00 0.82 0.00 0.00 66.70 66.49 1h61 h VAL 289 Cb 0.25 2.15 -0.07 0.00 -1.52 0.00 0.00 31.29 32.10 1h61 h VAL 289 CO -0.01 0.35 0.34 -0.09 0.02 0.00 0.00 177.57 178.18 1h61 h ARG 290 N -0.35 0.57 0.00 1.57 9.65 -0.75 -1.57 114.38 123.50 1h61 h ARG 290 Ca 0.01 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1h61 h ARG 290 Cb 0.60 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.05 1h61 h ARG 290 CO 0.02 0.37 0.00 -0.85 2.80 0.00 0.00 179.97 182.31 1h61 n GLU 291 N -4.87 0.02 0.00 0.20 0.28 -0.73 -3.22 120.64 112.32 1h61 n GLU 291 Ca 0.10 0.16 0.08 0.00 -0.16 0.00 0.00 57.16 57.34 1h61 n GLU 291 Cb 0.26 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.56 1h61 n GLU 291 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1h61 n ARG 292 N -1.49 1.69 -4.88 3.44 1.74 -0.62 -4.94 116.66 111.62 1h61 n ARG 292 Ca 0.05 -0.13 -0.28 0.00 -0.77 0.00 0.00 57.85 56.72 1h61 n ARG 292 Cb 0.22 -1.26 -0.17 0.00 -1.02 0.00 0.00 32.46 30.23 1h61 n ARG 292 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1h61 s PHE 293 N -2.43 1.92 -0.75 -1.55 5.36 -1.05 -4.51 117.98 114.97 1h61 s PHE 293 Ca 0.07 -0.71 0.16 0.00 -0.96 0.00 0.00 56.93 55.49 1h61 s PHE 293 Cb 0.12 -1.32 0.59 0.00 -0.34 0.00 0.00 43.02 42.07 1h61 s PHE 293 CO 0.62 -0.30 1.50 0.72 -1.46 0.00 0.00 175.22 176.30 1h61 n HIS 294 N 3.55 1.16 -3.32 10.12 8.25 -1.26 -4.86 115.22 128.86 1h61 n HIS 294 Ca -0.20 -0.67 0.00 0.00 -0.26 0.00 0.00 57.72 56.58 1h61 n HIS 294 Cb 0.52 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.40 1h61 n HIS 294 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h61 n GLY 295 N 0.50 4.20 3.75 -1.41 0.00 -1.26 -5.09 105.19 105.88 1h61 n GLY 295 Ca 0.22 -2.13 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 1h61 n GLY 295 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h61 s VAL 296 N 0.24 3.35 -0.18 1.61 1.01 -0.92 -4.88 120.40 120.63 1h61 s VAL 296 Ca 0.00 1.29 -0.01 0.00 0.00 0.00 0.00 61.98 63.26 1h61 s VAL 296 Cb 0.00 -3.82 -0.00 0.00 0.00 0.00 0.00 36.38 32.56 1h61 s VAL 296 CO 0.00 0.28 -0.13 -0.63 0.00 0.00 0.00 175.10 174.62 1h61 s ILE 297 N -0.85 2.79 -0.18 2.22 1.01 -1.26 -0.62 121.20 124.31 1h61 s ILE 297 Ca 0.48 -0.71 -0.04 0.00 0.00 0.00 0.00 60.65 60.37 1h61 s ILE 297 Cb -0.34 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 1h61 s ILE 297 CO 0.42 0.49 -0.02 -0.63 0.00 0.00 0.00 174.94 175.21 1h61 s ILE 298 N 1.07 3.92 0.05 2.92 1.01 0.10 -0.71 121.20 129.55 1h61 s ILE 298 Ca -0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 60.65 60.29 1h61 s ILE 298 Cb -0.15 -2.75 -0.04 0.00 0.01 0.00 0.00 42.46 39.53 1h61 s ILE 298 CO -0.03 0.45 0.25 -0.83 0.00 0.00 0.00 174.94 174.78 1h61 s GLY 299 N 0.75 2.21 0.04 6.18 0.00 -0.39 -0.52 107.32 115.59 1h61 s GLY 299 Ca -0.01 -0.72 -0.22 0.00 0.00 0.00 0.00 44.72 43.77 1h61 s GLY 299 CO 0.02 -0.64 0.52 0.00 0.00 0.00 0.00 173.10 172.99 1h61 s ALA 300 N -1.46 -1.32 0.00 3.20 0.00 -0.78 -1.39 121.76 120.01 1h61 s ALA 300 Ca 0.33 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.90 1h61 s ALA 300 Cb -0.13 0.35 0.00 0.00 0.00 0.00 0.00 23.12 23.34 1h61 s ALA 300 CO 0.23 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1h61 n GLY 301 N 0.46 1.85 4.01 0.00 0.00 -1.26 -1.13 105.19 109.12 1h61 n GLY 301 Ca -0.18 -0.63 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 1h61 n GLY 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h61 n ALA 302 N 0.00 -1.32 -1.80 4.61 0.00 -1.26 -4.75 120.51 115.98 1h61 n ALA 302 Ca 0.00 0.11 -0.34 0.00 0.00 0.00 0.00 53.44 53.20 1h61 n ALA 302 Cb 0.00 -4.00 -0.05 0.00 0.00 0.00 0.00 19.45 15.40 1h61 n ALA 302 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1h61 s TYR 303 N -3.33 3.25 0.23 0.00 1.51 -1.26 -5.07 117.35 112.68 1h61 s TYR 303 Ca 0.65 1.63 0.08 0.00 -1.01 0.00 0.00 57.07 58.41 1h61 s TYR 303 Cb -0.33 -2.98 -0.04 0.00 -0.11 0.00 0.00 41.96 38.49 1h61 s TYR 303 CO 0.86 -0.40 0.06 0.95 -1.11 0.00 0.00 175.55 175.91 1h61 s THR 304 N -1.94 3.86 0.27 -0.71 -4.23 -1.26 -5.02 115.64 106.61 1h61 s THR 304 Ca 0.61 -1.58 -0.04 0.00 -1.18 0.00 0.00 61.69 59.50 1h61 s THR 304 Cb -0.15 -3.03 0.22 0.00 1.34 0.00 0.00 72.50 70.88 1h61 s THR 304 CO 0.19 -0.27 1.89 0.00 -0.54 0.00 0.00 174.62 175.89 1h61 h ALA 305 N 2.06 1.27 -0.70 3.99 0.00 -1.99 -1.61 119.26 122.28 1h61 h ALA 305 Ca -0.46 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 1h61 h ALA 305 Cb 1.23 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1h61 h ALA 305 CO 0.60 0.60 0.40 0.93 0.00 0.00 0.00 179.25 181.77 1h61 h GLU 306 N 1.12 0.96 -0.66 0.00 3.07 -1.99 -0.59 114.58 116.48 1h61 h GLU 306 Ca 0.28 -0.10 -0.08 0.00 -0.50 0.00 0.00 59.36 58.97 1h61 h GLU 306 Cb 0.02 -0.19 -0.03 0.00 -0.84 0.00 0.00 28.75 27.71 1h61 h GLU 306 CO -0.05 0.71 0.12 -0.22 -1.40 0.00 0.00 179.01 178.17 1h61 h LYS 307 N 0.95 1.09 -0.02 2.33 3.64 -1.83 -0.77 116.57 121.96 1h61 h LYS 307 Ca 0.25 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1h61 h LYS 307 Cb 0.01 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1h61 h LYS 307 CO -0.04 0.99 0.01 0.00 -2.27 0.00 0.00 179.45 178.14 1h61 h ALA 308 N 1.05 0.03 -0.86 5.00 0.00 -0.79 -1.52 119.26 122.18 1h61 h ALA 308 Ca 0.20 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1h61 h ALA 308 Cb 0.42 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1h61 h ALA 308 CO 0.01 -0.46 0.56 0.93 0.00 0.00 0.00 179.25 180.29 1h61 h GLU 309 N -0.00 1.14 0.14 0.00 4.39 -0.93 -0.56 114.58 118.76 1h61 h GLU 309 Ca 0.01 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.63 1h61 h GLU 309 Cb 0.03 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.42 1h61 h GLU 309 CO -0.00 0.76 -0.08 0.22 -1.16 0.00 0.00 179.01 178.75 1h61 h ASP 310 N 1.17 -0.20 0.09 1.42 3.58 -0.83 0.74 116.42 122.39 1h61 h ASP 310 Ca 0.31 0.01 -0.14 0.00 0.42 0.00 0.00 57.03 57.63 1h61 h ASP 310 Cb -0.13 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 1h61 h ASP 310 CO -0.07 -0.13 -0.50 -0.07 -2.88 0.00 0.00 179.24 175.59 1h61 h LEU 311 N -0.21 0.50 -0.44 2.28 3.38 -1.12 -1.69 115.31 118.01 1h61 h LEU 311 Ca -0.01 -0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.54 1h61 h LEU 311 Cb 0.18 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1h61 h LEU 311 CO 0.02 0.92 -0.44 0.40 0.09 0.00 0.00 178.44 179.42 1h61 h ILE 312 N 0.37 1.28 0.00 1.22 2.04 -1.04 -1.79 117.51 119.59 1h61 h ILE 312 Ca 0.02 -1.63 -0.06 0.00 1.00 0.00 0.00 64.86 64.19 1h61 h ILE 312 Cb 1.00 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 1h61 h ILE 312 CO 0.09 0.53 -0.29 1.23 0.00 0.00 0.00 178.15 179.71 1h61 h GLY 313 N 0.85 0.00 0.82 5.37 0.00 -0.69 -1.76 103.07 107.67 1h61 h GLY 313 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1h61 h GLY 313 CO 0.10 0.00 -0.07 0.28 0.00 0.00 0.00 176.54 176.85 1h61 n LYS 314 N -3.94 0.84 -1.27 4.80 5.02 -0.65 -4.91 118.16 118.04 1h61 n LYS 314 Ca -0.02 -0.25 -0.07 0.00 -2.02 0.00 0.00 58.31 55.95 1h61 n LYS 314 Cb 0.36 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 1h61 n LYS 314 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h61 n GLY 315 N 1.21 0.87 0.11 0.72 0.00 -0.66 -4.93 105.19 102.51 1h61 n GLY 315 Ca 0.17 -0.72 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 1h61 n GLY 315 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1h61 h LEU 316 N 0.00 0.23 -8.69 0.99 3.38 -1.56 -3.48 115.31 106.18 1h61 h LEU 316 Ca -0.15 -0.48 -0.30 0.00 0.09 0.00 0.00 57.88 57.05 1h61 h LEU 316 Cb 0.51 -0.07 -0.15 0.00 0.09 0.00 0.00 40.66 41.04 1h61 h LEU 316 CO 0.21 1.43 -0.66 0.27 0.09 0.00 0.00 178.44 179.78 1h61 s ILE 317 N -2.58 0.66 -0.08 1.22 -4.36 -1.20 -4.73 121.20 110.12 1h61 s ILE 317 Ca -0.13 -1.98 0.10 0.00 -0.26 0.00 0.00 60.65 58.38 1h61 s ILE 317 Cb 0.07 -2.20 -0.15 0.00 1.25 0.00 0.00 42.46 41.43 1h61 s ILE 317 CO 0.81 -0.40 0.10 0.47 0.24 0.00 0.00 174.94 176.16 1h61 n ASP 318 N -0.28 2.28 -3.93 4.36 8.00 0.11 -4.17 116.55 122.93 1h61 n ASP 318 Ca -0.05 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.35 1h61 n ASP 318 Cb 0.64 0.99 -0.05 0.00 -0.02 0.00 0.00 41.12 42.67 1h61 n ASP 318 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h61 s ALA 319 N -2.42 -0.37 -0.02 2.24 0.00 -1.06 -4.85 121.76 115.27 1h61 s ALA 319 Ca -0.05 -0.71 0.04 0.00 0.00 0.00 0.00 51.96 51.23 1h61 s ALA 319 Cb 0.04 0.97 -0.01 0.00 0.00 0.00 0.00 23.12 24.13 1h61 s ALA 319 CO 0.46 -0.80 -0.13 0.54 0.00 0.00 0.00 175.76 175.83 1h61 s VAL 320 N -3.97 1.04 -0.23 0.00 0.11 -0.78 -1.26 120.40 115.31 1h61 s VAL 320 Ca 0.18 -0.55 -0.07 0.00 -2.93 0.00 0.00 61.98 58.61 1h61 s VAL 320 Cb 0.00 -0.88 -0.03 0.00 -1.53 0.00 0.00 36.38 33.94 1h61 s VAL 320 CO 0.04 0.30 0.05 0.00 -3.33 0.00 0.00 175.10 172.17 1h61 s ALA 321 N -0.19 3.16 -0.16 1.54 0.00 -0.49 -0.77 121.76 124.85 1h61 s ALA 321 Ca 0.03 -1.05 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 1h61 s ALA 321 Cb -0.06 -2.00 -0.04 0.00 0.00 0.00 0.00 23.12 21.02 1h61 s ALA 321 CO -0.00 -0.34 0.08 -0.06 0.00 0.00 0.00 175.76 175.45 1h61 s PHE 322 N 1.34 3.34 0.00 0.00 0.08 -0.11 -4.39 117.98 118.24 1h61 s PHE 322 Ca 0.05 0.23 0.00 0.00 0.12 0.00 0.00 56.93 57.33 1h61 s PHE 322 Cb -0.15 -2.04 0.00 0.00 -0.57 0.00 0.00 43.02 40.27 1h61 s PHE 322 CO 0.03 0.34 0.00 0.41 -0.10 0.00 0.00 175.22 175.90 1h61 n GLY 323 N 3.06 -0.06 0.30 4.36 0.00 -1.26 -1.59 105.19 109.99 1h61 n GLY 323 Ca -0.17 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.94 1h61 n GLY 323 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1h61 h ARG 324 N 0.00 0.16 0.00 1.61 3.08 -1.97 0.11 114.38 117.37 1h61 h ARG 324 Ca 0.00 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 1h61 h ARG 324 Cb 0.00 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1h61 h ARG 324 CO 0.00 0.11 -0.34 -0.44 -1.07 0.00 0.00 179.97 178.22 1h61 h ASP 325 N 0.17 0.00 1.11 7.04 3.32 -1.97 -2.34 116.42 123.74 1h61 h ASP 325 Ca 0.11 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.01 1h61 h ASP 325 Cb 0.21 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1h61 h ASP 325 CO -0.02 0.34 -0.67 1.88 -1.72 0.00 0.00 179.24 179.05 1h61 h TYR 326 N 0.00 0.00 -0.33 4.55 0.05 -1.19 -0.40 116.97 119.65 1h61 h TYR 326 Ca -0.00 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.76 1h61 h TYR 326 Cb 0.65 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.38 1h61 h TYR 326 CO 0.00 0.67 0.14 0.82 -1.05 0.00 0.00 178.16 178.74 1h61 h ILE 327 N 0.00 1.18 0.00 -2.88 2.04 -0.89 -3.21 117.51 113.75 1h61 h ILE 327 Ca -0.01 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1h61 h ILE 327 Cb 1.41 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 1h61 h ILE 327 CO 0.09 0.19 -0.44 0.00 0.00 0.00 0.00 178.15 177.99 1h61 n ALA 328 N -2.27 3.28 -3.58 1.87 0.00 -1.00 -4.71 120.51 114.10 1h61 n ALA 328 Ca -0.01 -0.30 -0.29 0.00 0.00 0.00 0.00 53.44 52.84 1h61 n ALA 328 Cb 0.13 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 18.26 1h61 n ALA 328 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1h61 s ASN 329 N -3.17 3.44 0.36 0.00 0.01 -0.17 -4.40 114.94 111.01 1h61 s ASN 329 Ca 0.11 -1.91 0.05 0.00 -0.71 0.00 0.00 52.86 50.40 1h61 s ASN 329 Cb 0.17 -0.58 0.73 0.00 0.41 0.00 0.00 41.25 41.98 1h61 s ASN 329 CO 0.68 -0.36 1.98 1.55 -1.51 0.00 0.00 177.10 179.44 1h61 h PRO 330 N 7.55 0.74 -1.42 -0.60 0.13 -1.82 -2.27 132.00 134.32 1h61 h PRO 330 Ca -0.06 -0.04 -0.70 0.00 -0.87 0.00 0.00 66.00 64.32 1h61 h PRO 330 Cb 0.98 -0.17 -0.30 0.00 0.13 0.00 0.00 31.00 31.65 1h61 h PRO 330 CO 0.39 0.49 0.75 -0.40 -0.23 0.00 0.00 178.00 179.00 1h61 n ASP 331 N -4.47 7.29 -0.30 1.44 5.75 -1.26 -4.25 116.55 120.75 1h61 n ASP 331 Ca 0.09 -3.80 0.12 0.00 -0.01 0.00 0.00 54.79 51.18 1h61 n ASP 331 Cb 0.16 -0.95 0.35 0.00 -1.03 0.00 0.00 41.12 39.65 1h61 n ASP 331 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1h61 h LEU 332 N 2.45 0.72 0.10 -2.12 5.85 -1.75 -1.86 115.31 118.71 1h61 h LEU 332 Ca 0.56 0.05 0.01 0.00 0.84 0.00 0.00 57.88 59.35 1h61 h LEU 332 Cb 0.54 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 1h61 h LEU 332 CO 1.44 0.35 -0.19 0.58 -0.34 0.00 0.00 178.44 180.28 1h61 h VAL 333 N 0.75 0.58 -0.76 1.05 2.07 -1.88 0.14 116.25 118.20 1h61 h VAL 333 Ca 0.49 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 68.00 1h61 h VAL 333 Cb 0.74 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1h61 h VAL 333 CO -0.25 0.00 0.46 0.00 0.02 0.00 0.00 177.57 177.80 1h61 h ALA 334 N 0.47 0.97 -0.58 1.67 0.00 -1.79 -0.59 119.26 119.41 1h61 h ALA 334 Ca 0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1h61 h ALA 334 Cb 0.38 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1h61 h ALA 334 CO -0.10 0.44 0.24 0.00 0.00 0.00 0.00 179.25 179.83 1h61 h ARG 335 N 1.04 0.87 -0.11 0.00 3.08 -1.04 -0.24 114.38 117.98 1h61 h ARG 335 Ca 0.27 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 60.05 1h61 h ARG 335 Cb -0.03 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 1h61 h ARG 335 CO -0.05 0.74 -0.46 -0.07 -1.07 0.00 0.00 179.97 179.06 1h61 h LEU 336 N 0.80 0.29 -0.43 3.04 3.38 -0.70 0.18 115.31 121.88 1h61 h LEU 336 Ca 0.20 -0.13 -0.18 0.00 0.09 0.00 0.00 57.88 57.86 1h61 h LEU 336 Cb 0.18 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1h61 h LEU 336 CO -0.02 0.71 -0.62 -0.61 0.09 0.00 0.00 178.44 177.99 1h61 h GLN 337 N 0.22 0.57 -0.01 1.13 4.15 -0.76 -3.11 115.11 117.29 1h61 h GLN 337 Ca 0.01 -0.40 0.00 0.00 0.77 0.00 0.00 58.65 59.04 1h61 h GLN 337 Cb 0.90 0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.65 1h61 h GLN 337 CO 0.07 1.01 -0.28 1.63 -1.93 0.00 0.00 178.83 179.34 1h61 n LYS 338 N -3.93 0.99 -3.48 1.69 5.02 -0.13 0.17 118.16 118.49 1h61 n LYS 338 Ca -0.04 -0.64 -0.21 0.00 -2.02 0.00 0.00 58.31 55.39 1h61 n LYS 338 Cb 0.65 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 34.25 1h61 n LYS 338 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1h61 n LYS 339 N -0.45 -7.13 -3.09 1.97 4.76 0.29 -4.88 118.16 109.65 1h61 n LYS 339 Ca 0.12 0.75 -0.29 0.00 -2.87 0.00 0.00 58.31 56.02 1h61 n LYS 339 Cb 0.38 -5.54 -0.03 0.00 -1.84 0.00 0.00 35.03 27.99 1h61 n LYS 339 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h61 s ALA 340 N -3.29 3.49 0.76 7.82 0.00 0.37 -5.02 121.76 125.89 1h61 s ALA 340 Ca 0.50 -0.41 -0.13 0.00 0.00 0.00 0.00 51.96 51.92 1h61 s ALA 340 Cb -0.22 -2.49 0.06 0.00 0.00 0.00 0.00 23.12 20.47 1h61 s ALA 340 CO 0.66 0.09 1.14 -1.21 0.00 0.00 0.00 175.76 176.44 1h61 s GLU 341 N -3.77 2.10 0.22 0.00 2.02 -1.26 -4.72 118.70 113.28 1h61 s GLU 341 Ca 0.47 1.47 0.06 0.00 0.02 0.00 0.00 54.97 56.99 1h61 s GLU 341 Cb -0.10 -1.86 -0.04 0.00 0.10 0.00 0.00 34.13 32.23 1h61 s GLU 341 CO 0.32 -1.81 0.19 -0.51 0.02 0.00 0.00 175.26 173.46 1h61 s LEU 342 N -5.58 3.86 0.46 1.80 1.43 -1.26 -5.02 118.68 114.37 1h61 s LEU 342 Ca 0.67 -0.17 -0.22 0.00 -1.03 0.00 0.00 54.13 53.38 1h61 s LEU 342 Cb -0.23 -2.42 -0.08 0.00 0.03 0.00 0.00 46.19 43.50 1h61 s LEU 342 CO 0.50 0.00 1.13 0.20 0.23 0.00 0.00 176.35 178.41 1h61 s ASN 343 N -3.56 6.22 0.43 2.29 0.01 -1.26 -4.99 114.94 114.09 1h61 s ASN 343 Ca 0.32 2.22 -0.23 0.00 -0.71 0.00 0.00 52.86 54.46 1h61 s ASN 343 Cb -0.09 -2.59 -0.08 0.00 0.41 0.00 0.00 41.25 38.89 1h61 s ASN 343 CO 0.25 -0.88 1.09 -2.16 -1.51 0.00 0.00 177.10 173.89 1h61 s PRO 344 N -2.77 3.98 0.30 -0.60 0.04 -1.26 -4.86 135.00 129.83 1h61 s PRO 344 Ca 0.64 1.58 -0.24 0.00 0.04 0.00 0.00 61.00 63.02 1h61 s PRO 344 Cb -0.26 -2.44 -0.09 0.00 0.04 0.00 0.00 34.50 31.75 1h61 s PRO 344 CO 0.32 -0.31 0.88 -0.65 0.04 0.00 0.00 177.00 177.27 1h61 s GLN 345 N -2.66 4.47 -0.65 4.56 -0.21 -1.26 -4.94 119.66 118.97 1h61 s GLN 345 Ca 0.61 1.18 0.05 0.00 0.02 0.00 0.00 55.36 57.22 1h61 s GLN 345 Cb -0.23 -2.80 0.16 0.00 1.00 0.00 0.00 33.01 31.14 1h61 s GLN 345 CO 0.29 0.30 0.45 1.03 -2.12 0.00 0.00 175.29 175.24 1h61 s ARG 346 N -2.07 2.24 0.59 2.91 0.52 -1.26 -4.98 118.95 116.90 1h61 s ARG 346 Ca 0.48 -3.13 0.28 0.00 -0.52 0.00 0.00 55.73 52.85 1h61 s ARG 346 Cb -0.18 -3.20 1.57 0.00 0.52 0.00 0.00 34.95 33.66 1h61 s ARG 346 CO 0.23 -1.27 2.01 -1.00 0.02 0.00 0.00 175.30 175.28 1h61 h PRO 347 N 5.56 0.00 -0.11 3.54 0.13 -1.99 -2.27 132.00 136.86 1h61 h PRO 347 Ca 0.13 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.29 1h61 h PRO 347 Cb 0.79 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 1h61 h PRO 347 CO 0.68 0.00 0.10 1.05 -0.23 0.00 0.00 178.00 179.60 1h61 h GLU 348 N 0.00 0.00 -0.39 0.86 9.09 -1.99 -2.02 114.58 120.13 1h61 h GLU 348 Ca 0.15 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.56 1h61 h GLU 348 Cb 0.80 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.90 1h61 h GLU 348 CO -0.00 0.00 0.00 -1.13 0.05 0.00 0.00 179.01 177.93 1h61 n SER 349 N -4.07 4.58 -0.15 3.06 3.41 -0.85 -4.55 113.62 115.05 1h61 n SER 349 Ca -0.00 -2.96 -0.10 0.00 -0.26 0.00 0.00 58.87 55.55 1h61 n SER 349 Cb 0.21 -0.59 -0.01 0.00 -0.26 0.00 0.00 64.21 63.57 1h61 n SER 349 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1h61 h PHE 350 N 2.66 0.76 -3.38 7.33 0.04 -1.48 -3.44 116.94 119.43 1h61 h PHE 350 Ca 0.00 -0.11 -0.65 0.00 2.80 0.00 0.00 57.97 60.01 1h61 h PHE 350 Cb 1.63 -0.21 -0.23 0.00 2.20 0.00 0.00 35.95 39.34 1h61 h PHE 350 CO 0.72 0.73 -0.71 0.71 -0.60 0.00 0.00 178.31 179.15 1h61 s TYR 351 N -5.19 2.92 0.07 -0.55 2.02 -1.26 -4.49 117.35 110.87 1h61 s TYR 351 Ca -0.13 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.18 1h61 s TYR 351 Cb 0.10 -1.87 0.00 0.00 -0.40 0.00 0.00 41.96 39.79 1h61 s TYR 351 CO 0.79 -0.05 0.00 0.41 -1.57 0.00 0.00 175.55 175.13 1h61 n GLY 352 N 3.32 -1.77 4.44 0.71 0.00 0.10 -4.81 105.19 107.18 1h61 n GLY 352 Ca -0.18 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1h61 n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h61 n GLY 353 N -1.10 -0.07 0.00 -0.02 0.00 -1.26 -4.89 105.19 97.84 1h61 n GLY 353 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1h61 n GLY 353 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h61 n GLY 354 N 0.00 5.11 0.30 -0.02 0.00 -1.26 -4.87 105.19 104.45 1h61 n GLY 354 Ca 0.00 -0.84 0.03 0.00 0.00 0.00 0.00 46.02 45.21 1h61 n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h61 h ALA 355 N 1.00 1.62 -2.52 4.61 0.00 -1.99 -3.39 119.26 118.59 1h61 h ALA 355 Ca 0.00 -0.07 -0.53 0.00 0.00 0.00 0.00 54.91 54.31 1h61 h ALA 355 Cb 0.00 -0.16 0.03 0.00 0.00 0.00 0.00 17.79 17.66 1h61 h ALA 355 CO 0.00 0.32 0.99 -2.00 0.00 0.00 0.00 179.25 178.56 1h61 s GLU 356 N -5.36 4.19 -0.48 0.00 2.12 -1.26 -1.20 118.70 116.71 1h61 s GLU 356 Ca -0.08 2.40 0.00 0.00 0.36 0.00 0.00 54.97 57.65 1h61 s GLU 356 Cb 0.17 -3.44 0.00 0.00 0.26 0.00 0.00 34.13 31.12 1h61 s GLU 356 CO 0.74 -0.72 0.00 0.41 -0.54 0.00 0.00 175.26 175.15 1h61 n GLY 357 N 3.97 0.72 1.53 -1.50 0.00 -1.26 -4.84 105.19 103.81 1h61 n GLY 357 Ca 0.16 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1h61 n GLY 357 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1h61 n TYR 358 N -2.80 -0.93 -0.22 1.61 9.36 -0.34 -4.73 117.16 119.12 1h61 n TYR 358 Ca -0.05 0.16 0.06 0.00 3.32 0.00 0.00 57.90 61.40 1h61 n TYR 358 Cb 0.18 0.29 0.17 0.00 -0.63 0.00 0.00 39.34 39.36 1h61 n TYR 358 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1h61 n THR 359 N -3.18 1.03 0.16 2.97 -2.24 -0.71 -4.57 114.28 107.75 1h61 n THR 359 Ca 0.00 -1.02 0.02 0.00 -2.27 0.00 0.00 64.05 60.78 1h61 n THR 359 Cb 0.00 0.48 0.24 0.00 -2.10 0.00 0.00 70.33 68.95 1h61 n THR 359 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1h61 h ASP 360 N 2.27 0.00 -3.17 3.42 3.58 -1.87 -3.45 116.42 117.20 1h61 h ASP 360 Ca 0.00 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 56.87 1h61 h ASP 360 Cb 0.78 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.77 1h61 h ASP 360 CO 0.01 0.51 0.78 -0.31 -2.88 0.00 0.00 179.24 177.35 1h61 s TYR 361 N -3.59 3.28 0.55 0.28 2.02 -1.26 -4.92 117.35 113.71 1h61 s TYR 361 Ca -0.01 1.35 -0.18 0.00 -0.37 0.00 0.00 57.07 57.87 1h61 s TYR 361 Cb 0.12 -3.37 -0.05 0.00 -0.40 0.00 0.00 41.96 38.25 1h61 s TYR 361 CO 0.73 -0.56 1.08 -1.25 -1.57 0.00 0.00 175.55 173.98 1h61 s PRO 362 N 3.30 3.42 0.46 -1.71 0.04 -1.26 -4.62 135.00 134.63 1h61 s PRO 362 Ca 0.44 1.41 0.01 0.00 0.04 0.00 0.00 61.00 62.90 1h61 s PRO 362 Cb -0.14 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1h61 s PRO 362 CO 0.09 -0.75 0.67 -1.12 0.04 0.00 0.00 177.00 175.92 1h61 s SER 363 N -2.17 5.72 0.00 6.66 0.01 -1.26 -4.67 113.70 117.99 1h61 s SER 363 Ca 0.68 0.15 0.03 0.00 1.31 0.00 0.00 55.95 58.13 1h61 s SER 363 Cb -0.19 -1.33 0.19 0.00 0.21 0.00 0.00 66.02 64.90 1h61 s SER 363 CO 0.29 -0.77 0.67 0.18 0.41 0.00 0.00 173.24 174.02