#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1eey s SER 2 N 0.00 5.59 0.11 1.61 0.01 -1.26 -3.81 113.70 115.95 1eey s SER 2 Ca 0.00 1.72 -0.07 0.00 1.31 0.00 0.00 55.95 58.91 1eey s SER 2 Cb 0.00 -2.51 -0.01 0.00 0.21 0.00 0.00 66.02 63.70 1eey s SER 2 CO 0.00 -1.30 0.17 -1.00 0.41 0.00 0.00 173.24 171.52 1eey s HIS 3 N -2.74 0.37 0.10 2.43 0.09 -0.83 -4.95 115.29 109.76 1eey s HIS 3 Ca 0.61 -0.79 -0.15 0.00 -0.00 0.00 0.00 55.06 54.73 1eey s HIS 3 Cb -0.15 -0.16 0.03 0.00 -0.00 0.00 0.00 32.58 32.30 1eey s HIS 3 CO 0.45 -0.58 0.36 -1.54 -0.00 0.00 0.00 174.74 173.44 1eey s SER 4 N -2.93 -0.17 -0.05 1.40 1.04 -1.26 -1.04 113.70 110.69 1eey s SER 4 Ca 0.12 -0.32 0.01 0.00 0.48 0.00 0.00 55.95 56.24 1eey s SER 4 Cb 0.05 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.63 1eey s SER 4 CO -0.06 -0.79 -0.04 -0.32 0.98 0.00 0.00 173.24 173.02 1eey s MET 5 N -3.52 0.77 -0.04 4.02 -2.45 -0.84 -0.04 119.30 117.20 1eey s MET 5 Ca 0.01 -0.07 -0.11 0.00 -1.25 0.00 0.00 55.69 54.27 1eey s MET 5 Cb 0.02 -0.84 0.02 0.00 1.25 0.00 0.00 34.83 35.28 1eey s MET 5 CO -0.10 -0.11 0.26 -0.98 1.05 0.00 0.00 175.02 175.14 1eey s ARG 6 N 1.04 0.50 -0.13 4.11 1.70 -0.48 -2.02 118.95 123.69 1eey s ARG 6 Ca -0.09 -0.03 -0.02 0.00 -0.47 0.00 0.00 55.73 55.12 1eey s ARG 6 Cb -0.14 0.22 -0.03 0.00 -0.57 0.00 0.00 34.95 34.44 1eey s ARG 6 CO -0.01 -0.12 -0.06 0.71 -1.08 0.00 0.00 175.30 174.75 1eey s TYR 7 N -0.80 2.98 -0.14 5.89 2.02 -0.32 -1.08 117.35 125.90 1eey s TYR 7 Ca -0.09 -0.25 -0.00 0.00 -0.37 0.00 0.00 57.07 56.36 1eey s TYR 7 Cb -0.05 -1.88 -0.01 0.00 -0.40 0.00 0.00 41.96 39.63 1eey s TYR 7 CO 0.02 0.04 -0.14 -0.06 -1.57 0.00 0.00 175.55 173.85 1eey s PHE 8 N 0.04 2.80 -0.09 2.71 0.08 -0.12 -2.31 117.98 121.08 1eey s PHE 8 Ca -0.01 -0.77 0.02 0.00 0.12 0.00 0.00 56.93 56.30 1eey s PHE 8 Cb -0.14 -1.86 0.01 0.00 -0.57 0.00 0.00 43.02 40.46 1eey s PHE 8 CO 0.03 -0.30 -0.16 -0.06 -0.10 0.00 0.00 175.22 174.63 1eey s PHE 9 N 0.51 1.89 -0.10 0.36 0.08 0.27 -1.56 117.98 119.43 1eey s PHE 9 Ca -0.09 -0.81 0.02 0.00 0.12 0.00 0.00 56.93 56.17 1eey s PHE 9 Cb -0.16 -1.35 0.01 0.00 -0.57 0.00 0.00 43.02 40.95 1eey s PHE 9 CO 0.04 -0.40 -0.17 0.99 -0.10 0.00 0.00 175.22 175.59 1eey s THR 10 N 0.76 1.60 -0.09 0.64 2.01 -0.08 -1.02 115.64 119.46 1eey s THR 10 Ca -0.12 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.20 1eey s THR 10 Cb -0.16 -1.43 0.01 0.00 0.01 0.00 0.00 72.50 70.92 1eey s THR 10 CO 0.02 0.46 -0.19 -0.55 -0.69 0.00 0.00 174.62 173.67 1eey s SER 11 N 0.81 2.57 -0.10 3.53 0.15 -0.02 -0.96 113.70 119.68 1eey s SER 11 Ca -0.10 -0.46 -0.01 0.00 0.70 0.00 0.00 55.95 56.09 1eey s SER 11 Cb -0.16 -1.18 0.03 0.00 -1.71 0.00 0.00 66.02 63.01 1eey s SER 11 CO 0.01 0.10 -0.04 -0.69 1.20 0.00 0.00 173.24 173.82 1eey s VAL 12 N 0.50 0.75 0.49 4.45 1.01 0.19 -1.47 120.40 126.32 1eey s VAL 12 Ca -0.17 -0.15 -0.22 0.00 0.00 0.00 0.00 61.98 61.45 1eey s VAL 12 Cb -0.17 -0.85 -0.07 0.00 0.00 0.00 0.00 36.38 35.29 1eey s VAL 12 CO 0.06 0.29 1.14 -0.94 0.00 0.00 0.00 175.10 175.66 1eey s SER 13 N 1.82 6.05 -0.52 3.32 1.04 -0.71 -0.48 113.70 124.21 1eey s SER 13 Ca 0.05 2.24 0.05 0.00 0.48 0.00 0.00 55.95 58.77 1eey s SER 13 Cb -0.13 -2.59 0.20 0.00 0.10 0.00 0.00 66.02 63.60 1eey s SER 13 CO -0.07 -1.00 0.49 0.54 0.98 0.00 0.00 173.24 174.18 1eey n ARG 14 N -0.76 1.12 -1.70 4.02 1.74 -1.26 -4.30 116.66 115.53 1eey n ARG 14 Ca 0.09 -3.78 -0.56 0.00 -0.77 0.00 0.00 57.85 52.83 1eey n ARG 14 Cb 0.49 -1.83 -0.07 0.00 -1.02 0.00 0.00 32.46 30.03 1eey n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1eey n PRO 15 N 1.96 1.28 -0.80 5.56 -0.02 -1.26 -0.68 135.00 141.05 1eey n PRO 15 Ca 0.25 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1eey n PRO 15 Cb 0.45 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1eey n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1eey n GLY 16 N 4.10 0.43 0.64 -1.23 0.00 -1.26 -4.80 105.19 103.08 1eey n GLY 16 Ca 0.25 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.33 1eey n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1eey n ARG 17 N -1.77 1.91 0.00 1.61 1.74 0.15 -5.10 116.66 115.20 1eey n ARG 17 Ca 0.00 -2.92 0.00 0.00 -0.77 0.00 0.00 57.85 54.16 1eey n ARG 17 Cb 0.06 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 1eey n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1eey n GLY 18 N -1.06 -0.27 3.74 -0.13 0.00 -1.21 -4.95 105.19 101.31 1eey n GLY 18 Ca 0.22 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.40 1eey n GLY 18 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1eey s GLU 19 N 0.00 2.60 0.42 1.61 2.56 -1.26 -4.57 118.70 120.06 1eey s GLU 19 Ca 0.00 1.82 -0.24 0.00 0.00 0.00 0.00 54.97 56.54 1eey s GLU 19 Cb 0.00 -1.88 -0.08 0.00 2.00 0.00 0.00 34.13 34.16 1eey s GLU 19 CO 0.00 -1.49 1.15 -2.14 -0.56 0.00 0.00 175.26 172.22 1eey s PRO 20 N -3.59 3.99 0.13 4.30 0.02 -1.26 -4.54 135.00 134.06 1eey s PRO 20 Ca 0.77 1.76 -0.30 0.00 0.02 0.00 0.00 61.00 63.25 1eey s PRO 20 Cb -0.31 -2.58 -0.06 0.00 0.02 0.00 0.00 34.50 31.57 1eey s PRO 20 CO 0.39 -0.35 1.03 0.50 -0.33 0.00 0.00 177.00 178.23 1eey s ARG 21 N -2.44 4.65 -0.06 5.54 6.06 0.37 -4.86 118.95 128.21 1eey s ARG 21 Ca 0.59 1.57 0.01 0.00 -2.50 0.00 0.00 55.73 55.40 1eey s ARG 21 Cb -0.29 -3.34 0.02 0.00 0.06 0.00 0.00 34.95 31.41 1eey s ARG 21 CO 0.35 0.14 -0.06 0.12 -2.50 0.00 0.00 175.30 173.36 1eey s PHE 22 N -0.05 0.94 -0.04 5.12 5.36 -1.26 -0.64 117.98 127.41 1eey s PHE 22 Ca 0.48 -0.31 0.01 0.00 -0.96 0.00 0.00 56.93 56.15 1eey s PHE 22 Cb -0.26 -0.81 0.02 0.00 -0.34 0.00 0.00 43.02 41.63 1eey s PHE 22 CO 0.32 -0.26 -0.04 0.42 -1.46 0.00 0.00 175.22 174.20 1eey s ILE 23 N 1.10 0.49 0.01 3.12 1.01 -0.14 -1.02 121.20 125.77 1eey s ILE 23 Ca -0.08 -0.11 0.05 0.00 0.00 0.00 0.00 60.65 60.52 1eey s ILE 23 Cb -0.14 -0.51 -0.02 0.00 0.01 0.00 0.00 42.46 41.80 1eey s ILE 23 CO -0.01 0.21 -0.17 0.00 0.00 0.00 0.00 174.94 174.97 1eey s ALA 24 N 0.83 1.40 -0.00 9.38 0.00 -0.53 -0.90 121.76 131.94 1eey s ALA 24 Ca -0.11 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 1eey s ALA 24 Cb -0.14 -0.30 -0.00 0.00 0.00 0.00 0.00 23.12 22.68 1eey s ALA 24 CO 0.00 0.32 0.09 0.14 0.00 0.00 0.00 175.76 176.31 1eey s VAL 25 N -0.59 0.08 0.05 0.00 -7.23 -0.60 -0.94 120.40 111.16 1eey s VAL 25 Ca 0.05 -0.63 0.09 0.00 -1.81 0.00 0.00 61.98 59.68 1eey s VAL 25 Cb -0.07 -0.34 -0.03 0.00 0.56 0.00 0.00 36.38 36.50 1eey s VAL 25 CO 0.00 -0.35 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.37 1eey s GLY 26 N -1.16 1.33 0.05 2.32 0.00 -0.91 -0.95 107.32 108.00 1eey s GLY 26 Ca -0.13 -1.22 0.03 0.00 0.00 0.00 0.00 44.72 43.40 1eey s GLY 26 CO 0.01 -1.12 -0.09 -0.19 0.00 0.00 0.00 173.10 171.71 1eey s TYR 27 N -0.81 0.79 -0.22 1.90 1.51 -0.24 -1.05 117.35 119.23 1eey s TYR 27 Ca 0.11 -0.48 0.02 0.00 -1.01 0.00 0.00 57.07 55.71 1eey s TYR 27 Cb -0.10 -0.46 0.04 0.00 -0.11 0.00 0.00 41.96 41.33 1eey s TYR 27 CO 0.02 -0.05 -0.14 0.08 -1.11 0.00 0.00 175.55 174.35 1eey s VAL 28 N -1.31 2.01 0.00 0.71 1.01 0.01 -1.38 120.40 121.45 1eey s VAL 28 Ca -0.08 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 60.64 1eey s VAL 28 Cb -0.10 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.27 1eey s VAL 28 CO 0.01 0.20 0.00 0.47 0.00 0.00 0.00 175.10 175.78 1eey n ASP 29 N 4.55 0.00 -1.38 3.32 8.00 0.94 -1.07 116.55 130.91 1eey n ASP 29 Ca -0.16 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.42 1eey n ASP 29 Cb 0.46 0.00 0.32 0.00 -0.02 0.00 0.00 41.12 41.88 1eey n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1eey n ASP 30 N 7.05 4.62 -4.32 -2.24 8.00 -1.26 -4.91 116.55 123.49 1eey n ASP 30 Ca 0.00 -2.70 -0.35 0.00 0.71 0.00 0.00 54.79 52.45 1eey n ASP 30 Cb 0.00 -0.56 -0.14 0.00 -0.02 0.00 0.00 41.12 40.40 1eey n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1eey s THR 31 N -2.30 3.33 0.27 -3.53 2.01 -0.23 -5.06 115.64 110.13 1eey s THR 31 Ca 0.47 -0.51 -0.29 0.00 0.31 0.00 0.00 61.69 61.66 1eey s THR 31 Cb 0.34 -2.50 -0.09 0.00 0.01 0.00 0.00 72.50 70.25 1eey s THR 31 CO 0.17 0.44 1.01 -1.58 -0.69 0.00 0.00 174.62 173.97 1eey s GLN 32 N 1.30 4.72 0.00 4.92 0.74 -1.26 -0.81 119.66 129.27 1eey s GLN 32 Ca 0.04 1.61 0.00 0.00 0.05 0.00 0.00 55.36 57.06 1eey s GLN 32 Cb -0.14 -3.18 0.00 0.00 1.10 0.00 0.00 33.01 30.78 1eey s GLN 32 CO -0.02 0.35 0.00 1.97 -0.55 0.00 0.00 175.29 177.04 1eey n PHE 33 N 1.24 0.00 -3.97 1.67 -1.74 -0.21 -4.04 117.46 110.41 1eey n PHE 33 Ca -0.01 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.79 1eey n PHE 33 Cb 0.46 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.39 1eey n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1eey s VAL 34 N -1.16 0.10 0.16 1.97 -7.23 -1.24 -0.17 120.40 112.83 1eey s VAL 34 Ca 0.00 -1.45 -0.20 0.00 -1.81 0.00 0.00 61.98 58.52 1eey s VAL 34 Cb 0.00 -1.75 0.05 0.00 0.56 0.00 0.00 36.38 35.24 1eey s VAL 34 CO 0.00 -0.43 0.53 0.00 -0.31 0.00 0.00 175.10 174.89 1eey s ARG 35 N -3.96 1.25 -0.13 4.82 1.70 -0.27 -2.13 118.95 120.23 1eey s ARG 35 Ca 0.15 -0.62 -0.07 0.00 -0.47 0.00 0.00 55.73 54.73 1eey s ARG 35 Cb 0.05 0.54 0.05 0.00 -0.57 0.00 0.00 34.95 35.02 1eey s ARG 35 CO -0.03 -0.53 0.30 0.12 -1.08 0.00 0.00 175.30 174.09 1eey s PHE 36 N -3.79 -0.44 -0.21 5.89 5.36 -0.12 -0.26 117.98 124.42 1eey s PHE 36 Ca 0.03 0.98 0.00 0.00 -0.96 0.00 0.00 56.93 56.99 1eey s PHE 36 Cb -0.00 0.12 0.05 0.00 -0.34 0.00 0.00 43.02 42.85 1eey s PHE 36 CO -0.11 -0.29 -0.05 0.34 -1.46 0.00 0.00 175.22 173.66 1eey s ASP 37 N 1.45 3.40 0.57 6.13 -1.08 -1.26 -1.45 116.67 124.41 1eey s ASP 37 Ca -0.08 -0.95 0.29 0.00 -0.52 0.00 0.00 52.55 51.29 1eey s ASP 37 Cb -0.10 -1.05 1.47 0.00 -1.46 0.00 0.00 42.92 41.78 1eey s ASP 37 CO -0.10 -0.21 1.92 0.77 0.52 0.00 0.00 175.17 178.06 1eey h SER 38 N 8.03 0.00 0.14 -0.34 4.64 -1.47 0.17 113.55 124.73 1eey h SER 38 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1eey h SER 38 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1eey h SER 38 CO 0.41 0.00 -0.18 0.47 -0.87 0.00 0.00 176.83 176.66 1eey n ASP 39 N -3.97 1.26 -4.85 4.97 9.92 -1.26 -4.93 116.55 117.69 1eey n ASP 39 Ca 0.11 -1.13 -0.31 0.00 -0.53 0.00 0.00 54.79 52.93 1eey n ASP 39 Cb 0.73 0.11 0.02 0.00 -0.64 0.00 0.00 41.12 41.33 1eey n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1eey s ALA 40 N -2.33 2.94 0.16 2.24 0.00 0.59 -5.00 121.76 120.37 1eey s ALA 40 Ca 0.28 0.01 -0.06 0.00 0.00 0.00 0.00 51.96 52.19 1eey s ALA 40 Cb 0.20 -3.12 0.03 0.00 0.00 0.00 0.00 23.12 20.23 1eey s ALA 40 CO 0.46 -0.83 1.46 0.00 0.00 0.00 0.00 175.76 176.85 1eey h ALA 41 N -0.32 0.60 -0.46 0.00 0.00 -1.92 -3.32 119.26 113.84 1eey h ALA 41 Ca -0.44 -0.52 -0.08 0.00 0.00 0.00 0.00 54.91 53.87 1eey h ALA 41 Cb 1.20 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1eey h ALA 41 CO 0.60 0.69 -0.04 0.66 0.00 0.00 0.00 179.25 181.16 1eey h SER 42 N 0.52 0.76 -4.19 0.00 4.64 -1.94 -3.47 113.55 109.87 1eey h SER 42 Ca 0.01 -0.20 -0.35 0.00 -0.47 0.00 0.00 61.79 60.78 1eey h SER 42 Cb 1.13 -0.20 0.07 0.00 -0.31 0.00 0.00 62.40 63.09 1eey h SER 42 CO 0.11 0.85 -0.54 0.00 -0.87 0.00 0.00 176.83 176.38 1eey n GLN 43 N -4.20 -4.79 -4.13 4.77 1.13 -1.25 -4.99 117.38 103.92 1eey n GLN 43 Ca 0.02 0.79 -0.10 0.00 -1.94 0.00 0.00 57.00 55.77 1eey n GLN 43 Cb 0.32 -5.43 -0.10 0.00 0.11 0.00 0.00 30.24 25.14 1eey n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1eey s ARG 44 N -5.66 0.72 0.28 -1.09 0.52 -1.26 -5.02 118.95 107.44 1eey s ARG 44 Ca 0.31 -1.21 -0.29 0.00 -0.52 0.00 0.00 55.73 54.02 1eey s ARG 44 Cb -0.14 -0.09 -0.10 0.00 0.52 0.00 0.00 34.95 35.15 1eey s ARG 44 CO 0.38 -0.04 1.24 1.41 0.02 0.00 0.00 175.30 178.32 1eey s MET 45 N -3.51 4.45 0.09 3.54 -2.45 -1.26 -4.67 119.30 115.49 1eey s MET 45 Ca 0.07 2.05 0.08 0.00 -1.25 0.00 0.00 55.69 56.64 1eey s MET 45 Cb 0.04 -3.14 -0.03 0.00 1.25 0.00 0.00 34.83 32.95 1eey s MET 45 CO -0.05 -0.08 -0.20 -1.21 1.05 0.00 0.00 175.02 174.52 1eey s GLU 46 N -1.29 1.11 0.25 4.11 2.02 0.64 -4.89 118.70 120.64 1eey s GLU 46 Ca 0.49 -1.11 -0.30 0.00 0.02 0.00 0.00 54.97 54.08 1eey s GLU 46 Cb -0.37 -1.32 -0.09 0.00 0.10 0.00 0.00 34.13 32.45 1eey s GLU 46 CO 0.46 0.31 1.01 -1.25 0.02 0.00 0.00 175.26 175.81 1eey s PRO 47 N -1.80 4.75 0.00 0.39 0.04 -1.26 -1.11 135.00 136.01 1eey s PRO 47 Ca 0.05 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1eey s PRO 47 Cb -0.10 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.19 1eey s PRO 47 CO 0.04 0.36 0.54 0.54 0.04 0.00 0.00 177.00 178.52 1eey n ARG 48 N 1.46 0.49 -4.11 4.56 5.12 0.76 -4.88 116.66 120.07 1eey n ARG 48 Ca -0.01 -0.68 -0.15 0.00 -1.93 0.00 0.00 57.85 55.07 1eey n ARG 48 Cb 0.46 -0.82 -0.14 0.00 -1.16 0.00 0.00 32.46 30.80 1eey n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1eey s ALA 49 N -0.28 0.36 0.24 7.54 0.00 -1.23 -4.70 121.76 123.69 1eey s ALA 49 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 51.96 51.74 1eey s ALA 49 Cb 0.00 -0.09 0.39 0.00 0.00 0.00 0.00 23.12 23.42 1eey s ALA 49 CO 0.00 0.09 1.81 -1.35 0.00 0.00 0.00 175.76 176.31 1eey h PRO 50 N 6.06 0.77 0.00 0.00 0.11 -1.94 -2.39 132.00 134.61 1eey h PRO 50 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1eey h PRO 50 Cb 1.19 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1eey h PRO 50 CO 0.50 0.51 0.00 -2.67 -0.21 0.00 0.00 178.00 176.13 1eey n TRP 51 N -4.74 0.04 0.64 0.65 4.27 -1.26 -1.91 117.44 115.13 1eey n TRP 51 Ca 0.13 0.02 0.10 0.00 -3.89 0.00 0.00 57.50 53.86 1eey n TRP 51 Cb 0.27 -0.53 -0.13 0.00 -1.36 0.00 0.00 31.31 29.56 1eey n TRP 51 CO 0.00 0.00 0.00 1.51 -2.29 0.00 0.00 177.69 176.91 1eey n ILE 52 N -1.54 0.00 0.30 -1.67 0.13 -0.90 -4.29 119.36 111.39 1eey n ILE 52 Ca 0.02 -0.18 0.18 0.00 -1.10 0.00 0.00 62.75 61.67 1eey n ILE 52 Cb 0.10 0.63 0.91 0.00 -0.84 0.00 0.00 39.64 40.44 1eey n ILE 52 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 1eey h GLU 53 N 0.00 0.00 0.00 9.51 5.08 -1.40 -2.54 114.58 125.24 1eey h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1eey h GLU 53 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1eey h GLU 53 CO 0.00 0.04 0.00 1.96 -1.00 0.00 0.00 179.01 180.01 1eey h GLN 54 N 0.00 0.00 -6.96 2.33 7.50 -1.75 -3.44 115.11 112.79 1eey h GLN 54 Ca -0.00 0.00 -0.54 0.00 0.50 0.00 0.00 58.65 58.61 1eey h GLN 54 Cb 0.25 0.00 0.11 0.00 0.05 0.00 0.00 27.48 27.89 1eey h GLN 54 CO 0.00 0.00 0.75 -1.21 -1.50 0.00 0.00 178.83 176.87 1eey s GLU 55 N -3.41 3.97 0.84 1.46 0.41 -0.96 -4.98 118.70 116.03 1eey s GLU 55 Ca 0.04 2.51 -0.14 0.00 -0.41 0.00 0.00 54.97 56.97 1eey s GLU 55 Cb 0.09 -2.86 0.20 0.00 -1.78 0.00 0.00 34.13 29.77 1eey s GLU 55 CO 0.53 -0.62 1.07 0.41 -0.49 0.00 0.00 175.26 176.16 1eey n GLY 56 N 0.51 -1.66 0.28 -1.39 0.00 -1.26 -4.87 105.19 96.81 1eey n GLY 56 Ca 0.02 -1.67 0.13 0.00 0.00 0.00 0.00 46.02 44.50 1eey n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1eey h PRO 57 N 0.00 0.00 -0.92 1.61 0.13 -1.98 -1.72 132.00 129.13 1eey h PRO 57 Ca -0.35 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.76 1eey h PRO 57 Cb 0.99 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.08 1eey h PRO 57 CO 0.25 0.01 0.53 1.49 -0.23 0.00 0.00 178.00 180.04 1eey h GLU 58 N 0.00 1.27 -0.08 0.86 4.22 -1.99 0.21 114.58 119.07 1eey h GLU 58 Ca -0.00 -0.13 -0.02 0.00 0.08 0.00 0.00 59.36 59.29 1eey h GLU 58 Cb 0.02 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.01 1eey h GLU 58 CO 0.00 0.91 -0.02 -0.92 -2.18 0.00 0.00 179.01 176.80 1eey h TYR 59 N 1.28 0.17 -0.39 0.92 5.03 -1.66 -1.72 116.97 120.61 1eey h TYR 59 Ca 0.33 -0.04 -0.12 0.00 2.58 0.00 0.00 58.73 61.48 1eey h TYR 59 Cb -0.01 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.22 1eey h TYR 59 CO 0.01 0.49 -0.25 -1.49 -1.32 0.00 0.00 178.16 175.60 1eey h TRP 60 N -0.20 0.91 -0.30 -3.82 4.06 -1.39 -0.05 115.95 115.16 1eey h TRP 60 Ca 0.02 -0.22 -0.05 0.00 2.06 0.00 0.00 58.89 60.70 1eey h TRP 60 Cb 0.44 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.38 1eey h TRP 60 CO 0.06 0.96 0.00 -0.44 -3.56 0.00 0.00 178.44 175.46 1eey h ASP 61 N 0.69 0.52 0.17 -3.49 5.19 -0.64 -1.28 116.42 117.57 1eey h ASP 61 Ca 0.09 -0.30 -0.01 0.00 -0.62 0.00 0.00 57.03 56.19 1eey h ASP 61 Cb 0.77 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.14 1eey h ASP 61 CO 0.06 0.70 -0.08 1.23 -3.12 0.00 0.00 179.24 178.03 1eey h GLY 62 N 0.33 -0.23 2.00 2.75 0.00 -1.17 -2.05 103.07 104.70 1eey h GLY 62 Ca 0.09 0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.45 1eey h GLY 62 CO 0.01 -0.08 -0.26 0.83 0.00 0.00 0.00 176.54 177.04 1eey h GLU 63 N -0.34 0.00 -0.29 4.80 4.39 -1.02 -1.06 114.58 121.05 1eey h GLU 63 Ca -0.02 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.61 1eey h GLU 63 Cb 0.27 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1eey h GLU 63 CO 0.04 0.26 -0.09 1.15 -1.16 0.00 0.00 179.01 179.21 1eey h THR 64 N 0.00 1.29 -0.25 1.13 2.02 -1.14 -0.83 112.91 115.13 1eey h THR 64 Ca -0.00 -1.14 -0.01 0.00 0.77 0.00 0.00 66.41 66.03 1eey h THR 64 Cb 0.51 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 1eey h THR 64 CO 0.03 0.36 0.12 -0.09 0.37 0.00 0.00 175.52 176.31 1eey h ARG 65 N 0.32 0.36 -0.25 6.66 2.43 -0.81 -2.00 114.38 121.09 1eey h ARG 65 Ca 0.07 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.06 1eey h ARG 65 Cb 0.58 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1eey h ARG 65 CO 0.03 0.37 -0.36 0.87 -1.51 0.00 0.00 179.97 179.37 1eey h LYS 66 N 0.27 0.56 -0.03 0.20 1.57 -1.19 -2.42 116.57 115.54 1eey h LYS 66 Ca 0.09 -0.27 -0.10 0.00 -1.87 0.00 0.00 60.65 58.50 1eey h LYS 66 Cb 0.13 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1eey h LYS 66 CO -0.01 0.84 -0.45 -0.24 -0.57 0.00 0.00 179.45 179.01 1eey h VAL 67 N 0.47 1.33 -0.15 0.50 3.04 -1.06 -1.64 116.25 118.74 1eey h VAL 67 Ca 0.05 -1.58 -0.13 0.00 -1.01 0.00 0.00 66.70 64.02 1eey h VAL 67 Cb 0.85 1.82 -0.01 0.00 -2.01 0.00 0.00 31.29 31.94 1eey h VAL 67 CO 0.07 0.46 -0.47 0.11 -1.01 0.00 0.00 177.57 176.73 1eey h LYS 68 N 0.05 0.37 -0.56 4.17 1.57 -1.18 -1.16 116.57 119.83 1eey h LYS 68 Ca 0.00 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.50 1eey h LYS 68 Cb 0.83 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 1eey h LYS 68 CO 0.06 0.77 0.06 0.00 -0.57 0.00 0.00 179.45 179.77 1eey h ALA 69 N 1.20 1.04 -0.31 3.86 0.00 -0.87 -1.28 119.26 122.89 1eey h ALA 69 Ca 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1eey h ALA 69 Cb 0.95 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1eey h ALA 69 CO 0.08 0.61 0.11 0.45 0.00 0.00 0.00 179.25 180.50 1eey h HIS 70 N 0.87 0.49 -0.51 0.00 3.86 -0.98 -1.90 115.15 116.98 1eey h HIS 70 Ca 0.17 -0.04 0.08 0.00 -1.16 0.00 0.00 60.37 59.42 1eey h HIS 70 Cb 0.43 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 28.69 1eey h HIS 70 CO 0.03 0.49 0.15 1.03 0.86 0.00 0.00 177.93 180.49 1eey h SER 71 N 0.35 0.11 -0.48 2.45 0.87 -0.74 -1.39 113.55 114.72 1eey h SER 71 Ca 0.10 0.07 -0.08 0.00 -1.23 0.00 0.00 61.79 60.66 1eey h SER 71 Cb 0.22 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 1eey h SER 71 CO -0.01 0.09 0.02 -0.61 -0.53 0.00 0.00 176.83 175.79 1eey h GLN 72 N 0.31 0.90 -0.38 2.24 5.75 -1.03 -2.03 115.11 120.87 1eey h GLN 72 Ca 0.25 -0.25 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1eey h GLN 72 Cb 0.30 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 1eey h GLN 72 CO -0.29 0.88 0.24 1.15 -2.65 0.00 0.00 178.83 178.16 1eey h THR 73 N 0.83 1.11 0.00 2.39 2.02 -0.51 -1.88 112.91 116.88 1eey h THR 73 Ca 0.16 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1eey h THR 73 Cb 0.47 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 1eey h THR 73 CO 0.02 0.11 0.00 0.45 0.37 0.00 0.00 175.52 176.47 1eey h HIS 74 N 0.50 0.00 0.05 3.16 3.86 -1.08 0.69 115.15 122.33 1eey h HIS 74 Ca 0.14 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.12 1eey h HIS 74 Cb -0.02 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 1eey h HIS 74 CO -0.04 0.00 -1.06 -0.09 0.86 0.00 0.00 177.93 177.60 1eey h ARG 75 N 0.00 0.16 0.05 2.45 2.43 -0.71 -2.45 114.38 116.31 1eey h ARG 75 Ca 0.00 -0.24 -0.27 0.00 -0.81 0.00 0.00 59.98 58.66 1eey h ARG 75 Cb 0.49 0.09 0.02 0.00 -0.42 0.00 0.00 29.97 30.15 1eey h ARG 75 CO 0.00 1.07 -1.10 0.28 -1.51 0.00 0.00 179.97 178.71 1eey h VAL 76 N 0.06 1.32 -0.75 0.20 2.07 -0.71 -3.29 116.25 115.15 1eey h VAL 76 Ca -0.07 -2.41 0.04 0.00 0.82 0.00 0.00 66.70 65.08 1eey h VAL 76 Cb 1.77 2.52 -0.05 0.00 -1.52 0.00 0.00 31.29 34.01 1eey h VAL 76 CO 0.16 0.73 0.47 0.44 0.02 0.00 0.00 177.57 179.39 1eey h ASP 77 N 0.30 0.76 -0.68 0.57 3.32 -0.86 -1.92 116.42 117.91 1eey h ASP 77 Ca -0.14 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.01 1eey h ASP 77 Cb 1.76 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 41.08 1eey h ASP 77 CO 0.21 0.51 0.32 -0.07 -1.72 0.00 0.00 179.24 178.49 1eey h LEU 78 N 0.90 0.40 -0.36 1.55 3.38 -1.50 -0.16 115.31 119.51 1eey h LEU 78 Ca 0.31 0.06 -0.17 0.00 0.09 0.00 0.00 57.88 58.17 1eey h LEU 78 Cb 0.06 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1eey h LEU 78 CO -0.13 0.23 -0.45 1.23 0.09 0.00 0.00 178.44 179.42 1eey h GLY 79 N 0.55 0.99 0.97 0.83 0.00 -1.56 -2.16 103.07 102.69 1eey h GLY 79 Ca 0.34 -1.07 -0.02 0.00 0.00 0.00 0.00 47.33 46.58 1eey h GLY 79 CO -0.28 0.96 -0.23 -0.84 0.00 0.00 0.00 176.54 176.15 1eey h THR 80 N 0.73 0.52 -0.93 4.70 2.02 -0.70 -1.84 112.91 117.41 1eey h THR 80 Ca 0.04 -0.07 0.09 0.00 0.77 0.00 0.00 66.41 67.24 1eey h THR 80 Cb 1.05 0.56 -0.07 0.00 -1.74 0.00 0.00 68.15 67.95 1eey h THR 80 CO 0.11 0.01 0.60 -0.07 0.37 0.00 0.00 175.52 176.54 1eey h LEU 81 N -0.69 0.89 -1.02 2.58 3.38 -1.10 0.21 115.31 119.55 1eey h LEU 81 Ca -0.07 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.97 1eey h LEU 81 Cb 0.52 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.04 1eey h LEU 81 CO 0.11 0.53 0.65 -0.09 0.09 0.00 0.00 178.44 179.73 1eey h ARG 82 N 0.98 1.20 -0.15 1.13 1.12 -1.13 -1.98 114.38 115.55 1eey h ARG 82 Ca 0.42 -0.07 -0.13 0.00 -1.11 0.00 0.00 59.98 59.09 1eey h ARG 82 Cb 0.33 -0.27 0.00 0.00 -0.01 0.00 0.00 29.97 30.02 1eey h ARG 82 CO -0.18 0.79 -0.41 0.78 -3.11 0.00 0.00 179.97 177.84 1eey h GLY 83 N 1.23 0.59 0.52 2.80 0.00 0.11 -0.85 103.07 107.47 1eey h GLY 83 Ca 0.41 -0.75 0.11 0.00 0.00 0.00 0.00 47.33 47.10 1eey h GLY 83 CO -0.14 0.67 0.63 -0.97 0.00 0.00 0.00 176.54 176.73 1eey h TYR 84 N 0.16 1.14 -0.58 5.60 0.05 -0.22 -1.96 116.97 121.17 1eey h TYR 84 Ca -0.01 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1eey h TYR 84 Cb 1.02 -0.36 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1eey h TYR 84 CO 0.10 0.48 0.00 0.66 -1.05 0.00 0.00 178.16 178.35 1eey n TYR 85 N -4.60 1.46 -3.83 4.88 4.01 -0.79 -4.94 117.16 113.35 1eey n TYR 85 Ca 0.18 -0.65 -0.29 0.00 -0.16 0.00 0.00 57.90 56.98 1eey n TYR 85 Cb 0.32 -0.28 0.01 0.00 -0.31 0.00 0.00 39.34 39.07 1eey n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1eey n ASN 86 N 0.84 -4.80 -4.68 7.72 4.13 -0.74 -4.96 115.26 112.77 1eey n ASN 86 Ca 0.25 -1.02 -0.26 0.00 1.68 0.00 0.00 54.58 55.24 1eey n ASN 86 Cb 0.91 -1.82 -0.07 0.00 -1.54 0.00 0.00 39.78 37.26 1eey n ASN 86 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1eey s GLN 87 N -5.46 2.47 0.42 3.52 -0.21 -0.37 -5.05 119.66 114.98 1eey s GLN 87 Ca 0.12 -1.14 -0.26 0.00 0.02 0.00 0.00 55.36 54.10 1eey s GLN 87 Cb -0.06 -2.36 -0.09 0.00 1.00 0.00 0.00 33.01 31.49 1eey s GLN 87 CO 0.91 0.44 1.41 0.45 -2.12 0.00 0.00 175.29 176.38 1eey s SER 88 N -3.15 6.12 -0.00 5.90 0.15 -1.26 -4.86 113.70 116.60 1eey s SER 88 Ca 0.29 2.89 0.01 0.00 0.70 0.00 0.00 55.95 59.84 1eey s SER 88 Cb -0.09 -2.65 0.03 0.00 -1.71 0.00 0.00 66.02 61.60 1eey s SER 88 CO 0.20 -1.01 1.01 1.21 1.20 0.00 0.00 173.24 175.85 1eey n GLU 89 N 0.08 1.07 -0.07 5.44 2.13 -1.26 -3.39 120.64 124.65 1eey n GLU 89 Ca 0.03 -0.11 -0.04 0.00 0.66 0.00 0.00 57.16 57.71 1eey n GLU 89 Cb 0.41 -1.04 -0.16 0.00 0.27 0.00 0.00 31.44 30.93 1eey n GLU 89 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1eey n ALA 90 N -0.40 1.90 -1.83 4.31 0.00 -1.26 -4.81 120.51 118.42 1eey n ALA 90 Ca 0.01 -1.06 -0.32 0.00 0.00 0.00 0.00 53.44 52.07 1eey n ALA 90 Cb 0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 1eey n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1eey s GLY 91 N -5.13 2.07 0.03 0.00 0.00 -1.22 -4.61 107.32 98.47 1eey s GLY 91 Ca -0.09 0.20 -0.19 0.00 0.00 0.00 0.00 44.72 44.64 1eey s GLY 91 CO 0.83 0.47 0.54 -0.45 0.00 0.00 0.00 173.10 174.49 1eey s SER 92 N -3.05 6.97 0.14 1.64 0.15 -1.26 -4.72 113.70 113.58 1eey s SER 92 Ca 0.59 1.15 0.04 0.00 0.70 0.00 0.00 55.95 58.43 1eey s SER 92 Cb -0.10 -2.34 -0.04 0.00 -1.71 0.00 0.00 66.02 61.83 1eey s SER 92 CO 0.31 0.22 -0.09 -1.00 1.20 0.00 0.00 173.24 173.89 1eey s HIS 93 N -0.74 1.22 -0.04 3.44 3.76 -1.26 -4.96 115.29 116.71 1eey s HIS 93 Ca 0.28 -0.81 0.04 0.00 -0.15 0.00 0.00 55.06 54.43 1eey s HIS 93 Cb -0.18 -0.64 -0.00 0.00 1.11 0.00 0.00 32.58 32.86 1eey s HIS 93 CO 0.17 0.02 -0.16 0.99 -0.85 0.00 0.00 174.74 174.91 1eey s THR 94 N -3.40 1.36 -0.02 1.30 2.01 -1.26 -1.74 115.64 113.89 1eey s THR 94 Ca 0.17 -0.69 0.05 0.00 0.31 0.00 0.00 61.69 61.53 1eey s THR 94 Cb 0.03 -1.16 -0.01 0.00 0.01 0.00 0.00 72.50 71.37 1eey s THR 94 CO 0.00 0.39 -0.18 0.68 -0.69 0.00 0.00 174.62 174.82 1eey s VAL 95 N -0.04 1.44 0.04 3.82 -7.23 -0.54 0.91 120.40 118.80 1eey s VAL 95 Ca -0.02 -0.76 0.04 0.00 -1.81 0.00 0.00 61.98 59.43 1eey s VAL 95 Cb -0.10 -1.21 -0.02 0.00 0.56 0.00 0.00 36.38 35.60 1eey s VAL 95 CO 0.01 0.41 -0.13 -1.10 -0.31 0.00 0.00 175.10 173.99 1eey s GLN 96 N -0.29 0.83 -0.01 4.82 -0.21 -0.57 -0.84 119.66 123.39 1eey s GLN 96 Ca 0.04 -0.74 -0.00 0.00 0.02 0.00 0.00 55.36 54.68 1eey s GLN 96 Cb -0.08 -0.81 0.01 0.00 1.00 0.00 0.00 33.01 33.13 1eey s GLN 96 CO 0.00 0.19 0.03 0.50 -2.12 0.00 0.00 175.29 173.89 1eey s ARG 97 N -1.19 0.00 -0.01 2.91 3.52 -0.18 -1.18 118.95 122.81 1eey s ARG 97 Ca -0.00 0.09 0.01 0.00 -0.13 0.00 0.00 55.73 55.70 1eey s ARG 97 Cb -0.08 -0.08 0.01 0.00 -1.56 0.00 0.00 34.95 33.24 1eey s ARG 97 CO 0.01 -0.06 -0.02 1.41 -0.81 0.00 0.00 175.30 175.82 1eey s MET 98 N 0.40 0.33 -0.01 5.12 1.75 -0.69 -0.56 119.30 125.65 1eey s MET 98 Ca -0.03 -0.06 -0.19 0.00 -1.25 0.00 0.00 55.69 54.16 1eey s MET 98 Cb -0.05 -0.39 0.03 0.00 2.84 0.00 0.00 34.83 37.27 1eey s MET 98 CO -0.01 -0.00 0.40 1.52 -0.65 0.00 0.00 175.02 176.28 1eey s TYR 99 N 0.35 -0.29 -2.08 4.11 -0.85 -0.98 -0.48 117.35 117.13 1eey s TYR 99 Ca -0.03 0.41 0.00 0.00 -0.52 0.00 0.00 57.07 56.92 1eey s TYR 99 Cb -0.06 0.18 0.00 0.00 0.38 0.00 0.00 41.96 42.46 1eey s TYR 99 CO -0.01 -0.48 0.00 0.41 -1.52 0.00 0.00 175.55 173.96 1eey n GLY 100 N 1.00 -1.44 3.09 5.49 0.00 -0.73 -1.17 105.19 111.42 1eey n GLY 100 Ca -0.20 -1.02 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 1eey n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1eey s ASP 102 N -2.18 3.60 0.09 0.00 1.01 0.23 -1.98 116.67 117.45 1eey s ASP 102 Ca -0.02 -0.40 0.08 0.00 0.71 0.00 0.00 52.55 52.91 1eey s ASP 102 Cb -0.03 -0.56 -0.03 0.00 1.01 0.00 0.00 42.92 43.30 1eey s ASP 102 CO -0.03 0.29 -0.20 0.68 0.21 0.00 0.00 175.17 176.12 1eey s VAL 103 N -0.80 1.66 0.00 -1.27 -7.23 -0.21 0.18 120.40 112.73 1eey s VAL 103 Ca 0.12 -1.47 0.00 0.00 -1.81 0.00 0.00 61.98 58.83 1eey s VAL 103 Cb -0.10 -1.50 0.00 0.00 0.56 0.00 0.00 36.38 35.34 1eey s VAL 103 CO 0.02 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1eey n GLY 104 N 1.23 -1.57 0.09 2.32 0.00 -0.26 -1.96 105.19 105.03 1eey n GLY 104 Ca -0.19 -1.58 0.10 0.00 0.00 0.00 0.00 46.02 44.35 1eey n GLY 104 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1eey n SER 105 N -2.56 0.42 -1.35 1.61 3.41 -1.25 -1.22 113.62 112.68 1eey n SER 105 Ca 0.00 0.61 0.09 0.00 -0.26 0.00 0.00 58.87 59.32 1eey n SER 105 Cb 0.00 -0.70 0.31 0.00 -0.26 0.00 0.00 64.21 63.56 1eey n SER 105 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1eey n ASP 106 N -1.98 3.96 -0.87 4.04 5.68 -1.26 -4.57 116.55 121.56 1eey n ASP 106 Ca 0.02 -2.23 -0.11 0.00 -0.50 0.00 0.00 54.79 51.97 1eey n ASP 106 Cb 0.19 -0.50 -0.05 0.00 -1.14 0.00 0.00 41.12 39.62 1eey n ASP 106 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1eey n TRP 107 N 1.17 -0.01 -3.71 2.11 7.02 -0.36 -4.96 117.44 118.70 1eey n TRP 107 Ca 0.23 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.36 1eey n TRP 107 Cb 0.70 -2.76 -0.05 0.00 -2.42 0.00 0.00 31.31 26.77 1eey n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1eey s ARG 108 N -2.92 3.63 -0.29 -0.99 0.52 -1.26 -4.76 118.95 112.88 1eey s ARG 108 Ca 0.00 -0.02 -0.42 0.00 -0.52 0.00 0.00 55.73 54.77 1eey s ARG 108 Cb 0.00 -3.04 -0.17 0.00 0.52 0.00 0.00 34.95 32.26 1eey s ARG 108 CO 0.00 0.61 1.60 0.34 0.02 0.00 0.00 175.30 177.87 1eey n PHE 109 N 0.96 1.79 -0.10 -0.53 7.35 -1.26 -1.10 117.46 124.57 1eey n PHE 109 Ca -0.09 0.78 -0.19 0.00 -0.76 0.00 0.00 57.45 57.19 1eey n PHE 109 Cb 0.53 -2.34 -0.08 0.00 0.35 0.00 0.00 39.48 37.93 1eey n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1eey n LEU 110 N 4.33 1.92 -3.52 -2.13 7.94 0.13 -4.80 117.00 120.88 1eey n LEU 110 Ca 0.27 0.13 -0.08 0.00 -1.11 0.00 0.00 56.01 55.22 1eey n LEU 110 Cb 0.07 -0.61 -0.02 0.00 0.53 0.00 0.00 43.42 43.39 1eey n LEU 110 CO 0.80 0.55 0.74 0.00 -1.11 0.00 0.00 177.39 178.37 1eey s ARG 111 N -2.37 0.74 0.12 1.96 1.70 -1.07 -4.97 118.95 115.06 1eey s ARG 111 Ca -0.27 -0.27 0.09 0.00 -0.47 0.00 0.00 55.73 54.81 1eey s ARG 111 Cb 0.09 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.78 1eey s ARG 111 CO 0.38 -0.32 -0.22 0.20 -1.08 0.00 0.00 175.30 174.25 1eey s GLY 112 N -2.43 1.35 0.06 3.88 0.00 -1.26 -0.60 107.32 108.32 1eey s GLY 112 Ca 0.06 -1.33 0.03 0.00 0.00 0.00 0.00 44.72 43.47 1eey s GLY 112 CO -0.08 -1.33 -0.09 -0.19 0.00 0.00 0.00 173.10 171.41 1eey s TYR 113 N -1.21 0.81 -0.33 1.90 1.51 0.50 -4.80 117.35 115.73 1eey s TYR 113 Ca 0.09 -0.57 0.03 0.00 -1.01 0.00 0.00 57.07 55.61 1eey s TYR 113 Cb -0.10 -0.47 0.19 0.00 -0.11 0.00 0.00 41.96 41.47 1eey s TYR 113 CO 0.05 -0.07 0.71 -1.58 -1.11 0.00 0.00 175.55 173.55 1eey s HIS 114 N -1.79 -1.50 0.18 2.71 2.46 -1.25 -1.77 115.29 114.34 1eey s HIS 114 Ca -0.04 0.63 0.10 0.00 0.47 0.00 0.00 55.06 56.21 1eey s HIS 114 Cb -0.07 0.26 -0.04 0.00 -0.13 0.00 0.00 32.58 32.60 1eey s HIS 114 CO -0.00 -0.93 -0.16 -0.65 -2.47 0.00 0.00 174.74 170.54 1eey s GLN 115 N 2.47 1.84 0.01 2.88 -0.21 0.37 -1.05 119.66 125.96 1eey s GLN 115 Ca 0.15 -1.36 0.00 0.00 0.02 0.00 0.00 55.36 54.17 1eey s GLN 115 Cb -0.06 -2.04 -0.01 0.00 1.00 0.00 0.00 33.01 31.91 1eey s GLN 115 CO -0.19 0.42 -0.02 -0.47 -2.12 0.00 0.00 175.29 172.91 1eey s TYR 116 N -1.65 0.19 0.02 0.91 6.14 0.69 -1.70 117.35 121.95 1eey s TYR 116 Ca 0.23 -0.18 0.00 0.00 0.64 0.00 0.00 57.07 57.75 1eey s TYR 116 Cb -0.09 -0.13 -0.02 0.00 0.42 0.00 0.00 41.96 42.15 1eey s TYR 116 CO 0.13 -0.05 -0.03 0.00 0.64 0.00 0.00 175.55 176.24 1eey s ALA 117 N -0.49 0.11 -0.14 3.97 0.00 -0.33 -1.14 121.76 123.75 1eey s ALA 117 Ca -0.04 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.46 1eey s ALA 117 Cb -0.04 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.22 1eey s ALA 117 CO -0.00 -0.12 -0.15 -0.47 0.00 0.00 0.00 175.76 175.02 1eey s TYR 118 N -1.12 2.17 -1.46 0.00 5.04 -0.53 -1.51 117.35 119.94 1eey s TYR 118 Ca -0.12 -1.19 -0.12 0.00 -2.44 0.00 0.00 57.07 53.21 1eey s TYR 118 Cb -0.08 -1.58 0.05 0.00 0.35 0.00 0.00 41.96 40.70 1eey s TYR 118 CO -0.01 -0.64 1.03 -0.25 -1.34 0.00 0.00 175.55 174.34 1eey n ASP 119 N 4.65 -5.48 0.00 4.32 8.00 0.26 -2.30 116.55 126.00 1eey n ASP 119 Ca -0.17 -0.65 0.00 0.00 0.71 0.00 0.00 54.79 54.67 1eey n ASP 119 Cb 0.50 -4.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.25 1eey n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1eey n GLY 120 N -1.79 0.95 3.54 0.44 0.00 -1.26 -5.00 105.19 102.07 1eey n GLY 120 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1eey n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1eey s LYS 121 N -0.09 2.60 0.22 1.61 1.02 -0.97 -5.07 119.74 119.04 1eey s LYS 121 Ca 0.00 -0.65 -0.31 0.00 0.02 0.00 0.00 55.97 55.03 1eey s LYS 121 Cb 0.00 -2.48 -0.15 0.00 -0.52 0.00 0.00 37.83 34.68 1eey s LYS 121 CO 0.00 0.63 1.09 -0.25 -0.92 0.00 0.00 175.35 175.90 1eey n ASP 122 N 2.11 1.26 0.04 2.83 9.92 -1.26 -1.45 116.55 129.99 1eey n ASP 122 Ca -0.17 1.15 -0.00 0.00 -0.53 0.00 0.00 54.79 55.24 1eey n ASP 122 Cb 0.53 -1.24 -0.00 0.00 -0.64 0.00 0.00 41.12 39.77 1eey n ASP 122 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1eey n TYR 123 N 1.01 0.00 -3.74 1.24 9.36 -0.29 -4.73 117.16 120.01 1eey n TYR 123 Ca 0.13 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.22 1eey n TYR 123 Cb 0.27 -0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 38.88 1eey n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1eey s ILE 124 N -1.88 0.02 0.01 2.97 2.07 -1.07 -0.91 121.20 122.40 1eey s ILE 124 Ca -0.00 -0.13 -0.06 0.00 -1.41 0.00 0.00 60.65 59.05 1eey s ILE 124 Cb 0.00 -0.57 -0.00 0.00 0.13 0.00 0.00 42.46 42.02 1eey s ILE 124 CO 0.00 -0.07 0.11 0.00 -1.91 0.00 0.00 174.94 173.07 1eey s ALA 125 N -0.25 -0.24 -0.05 1.50 0.00 -0.87 -0.22 121.76 121.63 1eey s ALA 125 Ca -0.04 -0.22 -0.25 0.00 0.00 0.00 0.00 51.96 51.45 1eey s ALA 125 Cb -0.03 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 1eey s ALA 125 CO 0.02 -0.20 0.78 -1.17 0.00 0.00 0.00 175.76 175.19 1eey s LEU 126 N -1.39 4.33 0.82 0.00 2.96 -0.22 -0.85 118.68 124.34 1eey s LEU 126 Ca -0.15 1.32 -0.11 0.00 -0.22 0.00 0.00 54.13 54.97 1eey s LEU 126 Cb -0.08 -3.22 0.09 0.00 0.50 0.00 0.00 46.19 43.48 1eey s LEU 126 CO 0.01 -0.16 1.09 -0.54 -1.32 0.00 0.00 176.35 175.43 1eey s LYS 127 N 0.88 1.85 0.63 1.98 1.02 0.01 -4.63 119.74 121.47 1eey s LYS 127 Ca 0.41 0.94 0.36 0.00 0.02 0.00 0.00 55.97 57.71 1eey s LYS 127 Cb -0.19 -1.87 2.08 0.00 -0.52 0.00 0.00 37.83 37.33 1eey s LYS 127 CO 0.21 -1.86 2.29 1.49 -0.92 0.00 0.00 175.35 176.56 1eey h GLU 128 N -1.28 0.00 0.00 1.68 4.81 -1.89 -0.20 114.58 117.71 1eey h GLU 128 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1eey h GLU 128 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1eey h GLU 128 CO 0.54 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.42 1eey n ASP 129 N -3.48 0.00 -2.45 1.04 5.68 -1.26 -4.79 116.55 111.29 1eey n ASP 129 Ca -0.03 -0.81 -0.11 0.00 -0.50 0.00 0.00 54.79 53.34 1eey n ASP 129 Cb 0.10 -0.02 -0.01 0.00 -1.14 0.00 0.00 41.12 40.06 1eey n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1eey n LEU 130 N -1.02 -1.07 0.00 -2.12 4.77 -0.09 -4.72 117.00 112.76 1eey n LEU 130 Ca 0.20 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1eey n LEU 130 Cb 0.10 -2.07 0.00 0.00 -2.33 0.00 0.00 43.42 39.12 1eey n LEU 130 CO 0.16 -0.12 -0.09 0.54 -1.33 0.00 0.00 177.39 176.54 1eey n ARG 131 N -2.78 3.29 -4.32 3.23 1.74 -1.26 -4.59 116.66 111.96 1eey n ARG 131 Ca -0.14 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.77 1eey n ARG 131 Cb 0.60 -0.45 -0.10 0.00 -1.02 0.00 0.00 32.46 31.49 1eey n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1eey s SER 132 N -0.51 1.78 0.18 0.55 1.04 -1.26 -4.95 113.70 110.52 1eey s SER 132 Ca 0.00 -1.22 0.11 0.00 0.48 0.00 0.00 55.95 55.32 1eey s SER 132 Cb 0.00 0.02 -0.04 0.00 0.10 0.00 0.00 66.02 66.10 1eey s SER 132 CO 0.00 -0.52 -0.23 0.26 0.98 0.00 0.00 173.24 173.73 1eey s TRP 133 N -3.44 2.18 -0.34 5.02 0.52 -1.26 -0.81 118.94 120.80 1eey s TRP 133 Ca 0.28 -0.38 -0.06 0.00 0.02 0.00 0.00 56.10 55.96 1eey s TRP 133 Cb 0.06 -1.09 0.04 0.00 -1.15 0.00 0.00 33.47 31.33 1eey s TRP 133 CO 0.08 0.44 0.10 0.99 0.02 0.00 0.00 176.95 178.59 1eey s THR 134 N -1.68 3.70 -0.26 2.01 2.01 -0.03 -4.90 115.64 116.49 1eey s THR 134 Ca 0.19 -1.18 -0.12 0.00 0.31 0.00 0.00 61.69 60.89 1eey s THR 134 Cb -0.08 -3.11 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 1eey s THR 134 CO 0.09 -0.19 0.21 0.00 -0.69 0.00 0.00 174.62 174.04 1eey s ALA 135 N 1.38 3.56 0.08 7.40 0.00 -1.26 -2.04 121.76 130.87 1eey s ALA 135 Ca -0.02 -0.97 -0.25 0.00 0.00 0.00 0.00 51.96 50.72 1eey s ALA 135 Cb -0.20 -2.47 -0.16 0.00 0.00 0.00 0.00 23.12 20.29 1eey s ALA 135 CO 0.02 -0.45 1.67 0.00 0.00 0.00 0.00 175.76 177.01 1eey h ALA 136 N 8.05 -0.16 -3.00 0.00 0.00 -1.31 -3.46 119.26 119.37 1eey h ALA 136 Ca -0.36 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1eey h ALA 136 Cb 1.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1eey h ALA 136 CO 0.60 -0.57 0.00 -0.40 0.00 0.00 0.00 179.25 178.88 1eey n ASP 137 N -5.14 0.16 -0.12 0.00 5.68 -1.26 -5.00 116.55 110.86 1eey n ASP 137 Ca -0.08 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.09 1eey n ASP 137 Cb 0.11 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.06 1eey n ASP 137 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 1eey h MET 138 N 0.00 0.77 -0.76 0.11 1.85 -1.99 -1.64 114.93 113.27 1eey h MET 138 Ca 0.00 -0.34 -0.01 0.00 -0.61 0.00 0.00 59.70 58.74 1eey h MET 138 Cb 0.00 -0.02 -0.04 0.00 0.43 0.00 0.00 31.60 31.98 1eey h MET 138 CO 0.00 0.96 0.43 0.00 -0.40 0.00 0.00 176.91 177.90 1eey h ALA 139 N 0.79 0.97 -0.31 0.39 0.00 -1.97 -2.07 119.26 117.05 1eey h ALA 139 Ca 0.08 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1eey h ALA 139 Cb 0.74 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1eey h ALA 139 CO 0.06 0.47 -0.10 0.00 0.00 0.00 0.00 179.25 179.68 1eey h ALA 140 N 1.22 1.25 -0.29 0.00 0.00 -1.82 -2.46 119.26 117.17 1eey h ALA 140 Ca 0.27 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1eey h ALA 140 Cb 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1eey h ALA 140 CO -0.05 0.49 -0.16 1.96 0.00 0.00 0.00 179.25 181.50 1eey h GLN 141 N 0.49 0.51 -0.62 0.00 4.20 -0.63 0.15 115.11 119.20 1eey h GLN 141 Ca 0.09 -0.16 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 1eey h GLN 141 Cb 0.46 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 1eey h GLN 141 CO 0.03 0.65 0.15 1.15 -0.67 0.00 0.00 178.83 180.13 1eey h THR 142 N 0.46 1.25 -0.10 -0.54 2.02 -0.97 -0.33 112.91 114.70 1eey h THR 142 Ca 0.08 -0.90 -0.16 0.00 0.77 0.00 0.00 66.41 66.20 1eey h THR 142 Cb 0.54 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1eey h THR 142 CO 0.03 0.34 -0.62 0.74 0.37 0.00 0.00 175.52 176.39 1eey h THR 143 N 0.94 1.37 -0.12 3.16 2.02 -1.08 -2.65 112.91 116.54 1eey h THR 143 Ca 0.20 -1.97 -0.00 0.00 0.77 0.00 0.00 66.41 65.41 1eey h THR 143 Cb 0.34 1.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 1eey h THR 143 CO 0.00 0.59 0.06 0.50 0.37 0.00 0.00 175.52 177.04 1eey h LYS 144 N 0.27 0.18 -0.68 6.66 3.64 -0.07 -0.48 116.57 126.08 1eey h LYS 144 Ca -0.01 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1eey h LYS 144 Cb 1.15 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 1eey h LYS 144 CO 0.10 0.25 0.42 0.45 -2.27 0.00 0.00 179.45 178.40 1eey h HIS 145 N 0.07 0.89 -0.24 1.91 3.86 -1.07 0.47 115.15 121.04 1eey h HIS 145 Ca 0.04 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1eey h HIS 145 Cb 0.13 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.29 1eey h HIS 145 CO -0.03 0.59 0.14 -0.22 0.86 0.00 0.00 177.93 179.28 1eey h LYS 146 N 0.92 0.29 0.00 2.45 3.64 -1.23 -0.09 116.57 122.54 1eey h LYS 146 Ca 0.24 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.54 1eey h LYS 146 Cb -0.04 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1eey h LYS 146 CO -0.05 0.19 -0.31 -1.49 -2.27 0.00 0.00 179.45 175.53 1eey h TRP 147 N 0.30 0.00 -0.07 1.91 4.06 -0.68 -1.72 115.95 119.75 1eey h TRP 147 Ca 0.09 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.00 1eey h TRP 147 Cb -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.15 1eey h TRP 147 CO -0.08 0.31 -0.12 0.93 -3.56 0.00 0.00 178.44 175.92 1eey h GLU 148 N 0.00 0.20 -0.46 0.49 5.08 -0.37 -0.96 114.58 118.57 1eey h GLU 148 Ca -0.00 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1eey h GLU 148 Cb 0.58 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 1eey h GLU 148 CO 0.04 0.71 0.30 0.00 -1.00 0.00 0.00 179.01 179.06 1eey h ALA 149 N 0.50 1.77 -0.35 3.43 0.00 -0.75 -0.61 119.26 123.25 1eey h ALA 149 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1eey h ALA 149 Cb 0.69 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1eey h ALA 149 CO 0.03 0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.46 1eey n ALA 150 N -2.48 2.46 -3.94 0.00 0.00 -0.67 -4.94 120.51 110.93 1eey n ALA 150 Ca 0.05 -0.68 -0.26 0.00 0.00 0.00 0.00 53.44 52.54 1eey n ALA 150 Cb 0.13 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 1eey n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1eey n HIS 151 N 0.64 -1.76 -0.07 0.00 -0.00 -0.24 -4.87 115.22 108.93 1eey n HIS 151 Ca 0.15 0.78 -0.15 0.00 -0.00 0.00 0.00 57.72 58.50 1eey n HIS 151 Cb 0.35 -3.77 -0.05 0.00 -0.00 0.00 0.00 29.99 26.52 1eey n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1eey h VAL 152 N -1.82 1.29 -0.87 1.59 2.07 -1.43 -3.18 116.25 113.90 1eey h VAL 152 Ca -0.62 -1.72 0.08 0.00 0.82 0.00 0.00 66.70 65.26 1eey h VAL 152 Cb 1.37 1.72 -0.07 0.00 -1.52 0.00 0.00 31.29 32.80 1eey h VAL 152 CO 0.64 0.55 0.53 0.00 0.02 0.00 0.00 177.57 179.31 1eey h ALA 153 N 0.65 1.23 -0.66 1.67 0.00 -1.90 -0.78 119.26 119.47 1eey h ALA 153 Ca 0.01 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1eey h ALA 153 Cb 1.14 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1eey h ALA 153 CO 0.12 0.22 0.32 0.93 0.00 0.00 0.00 179.25 180.84 1eey h GLU 154 N 0.93 0.95 -0.17 0.00 3.07 -1.80 -0.93 114.58 116.63 1eey h GLU 154 Ca 0.40 -0.14 -0.09 0.00 -0.50 0.00 0.00 59.36 59.03 1eey h GLU 154 Cb 0.27 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 1eey h GLU 154 CO -0.21 0.75 -0.29 1.96 -1.40 0.00 0.00 179.01 179.82 1eey h GLN 155 N 0.92 0.33 -0.28 2.33 4.20 -1.37 -2.97 115.11 118.27 1eey h GLN 155 Ca 0.23 -0.13 -0.16 0.00 0.06 0.00 0.00 58.65 58.65 1eey h GLN 155 Cb 0.12 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 1eey h GLN 155 CO -0.03 0.60 -0.49 -0.07 -0.67 0.00 0.00 178.83 178.17 1eey h LEU 156 N 0.29 0.82 -0.77 1.46 3.38 -0.48 -2.78 115.31 117.24 1eey h LEU 156 Ca 0.04 -0.41 -0.13 0.00 0.09 0.00 0.00 57.88 57.47 1eey h LEU 156 Cb 0.67 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1eey h LEU 156 CO 0.05 1.17 -0.43 0.08 0.09 0.00 0.00 178.44 179.40 1eey h ARG 157 N 0.59 0.41 -0.54 1.13 0.11 -1.09 0.60 114.38 115.60 1eey h ARG 157 Ca 0.03 -0.21 -0.03 0.00 0.10 0.00 0.00 59.98 59.86 1eey h ARG 157 Cb 1.06 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.12 1eey h ARG 157 CO 0.10 0.77 0.21 0.00 0.10 0.00 0.00 179.97 181.16 1eey h ALA 158 N 1.20 0.70 -0.13 0.08 0.00 -1.51 0.19 119.26 119.78 1eey h ALA 158 Ca 0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1eey h ALA 158 Cb 0.90 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1eey h ALA 158 CO 0.08 0.31 -0.07 -0.92 0.00 0.00 0.00 179.25 178.64 1eey h TYR 159 N 0.73 0.33 -0.44 0.00 3.20 -1.22 -0.49 116.97 119.08 1eey h TYR 159 Ca 0.18 -0.08 -0.07 0.00 3.14 0.00 0.00 58.73 61.89 1eey h TYR 159 Cb 0.20 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1eey h TYR 159 CO 0.01 0.63 -0.01 -0.07 -1.64 0.00 0.00 178.16 177.07 1eey h LEU 160 N -0.06 0.69 0.00 2.82 3.38 -0.75 0.49 115.31 121.88 1eey h LEU 160 Ca 0.03 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1eey h LEU 160 Cb 0.55 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1eey h LEU 160 CO 0.02 0.77 -1.13 -0.62 0.09 0.00 0.00 178.44 177.57 1eey n GLU 161 N -4.22 0.57 0.00 1.13 1.02 0.65 -4.03 120.64 115.76 1eey n GLU 161 Ca 0.02 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1eey n GLU 161 Cb 0.29 -1.76 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 1eey n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1eey n GLY 162 N 1.21 0.19 0.34 0.62 0.00 -0.19 -4.63 105.19 102.72 1eey n GLY 162 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1eey n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1eey h THR 163 N 0.00 0.11 -0.14 2.61 2.02 -1.57 -0.40 112.91 115.55 1eey h THR 163 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1eey h THR 163 Cb 0.00 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.47 1eey h THR 163 CO 0.00 0.00 -0.14 0.00 0.37 0.00 0.00 175.52 175.75 1eey h VAL 165 N -0.16 1.27 -0.19 0.00 2.07 -1.52 -1.88 116.25 115.84 1eey h VAL 165 Ca 0.09 -1.30 -0.01 0.00 0.82 0.00 0.00 66.70 66.31 1eey h VAL 165 Cb 0.30 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1eey h VAL 165 CO -0.24 0.44 0.09 -0.33 0.02 0.00 0.00 177.57 177.55 1eey h GLU 166 N 0.67 0.27 -0.00 1.57 5.08 -0.60 -1.96 114.58 119.61 1eey h GLU 166 Ca 0.10 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 1eey h GLU 166 Cb 0.70 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1eey h GLU 166 CO 0.05 0.29 -0.70 -1.49 -1.00 0.00 0.00 179.01 176.16 1eey h TRP 167 N 0.18 0.02 0.22 4.33 4.06 -1.12 -2.27 115.95 121.37 1eey h TRP 167 Ca 0.07 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.99 1eey h TRP 167 Cb 0.11 -0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.27 1eey h TRP 167 CO -0.03 0.71 -0.10 1.25 -3.56 0.00 0.00 178.44 176.71 1eey h LEU 168 N 0.01 -0.25 -0.49 -4.49 5.85 -1.19 0.17 115.31 114.92 1eey h LEU 168 Ca -0.01 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.80 1eey h LEU 168 Cb 1.24 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 42.27 1eey h LEU 168 CO 0.09 -0.17 0.10 0.03 -0.34 0.00 0.00 178.44 178.15 1eey h ARG 169 N -0.30 0.22 -0.42 1.25 3.08 -1.29 0.29 114.38 117.21 1eey h ARG 169 Ca -0.03 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.05 1eey h ARG 169 Cb 0.23 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 1eey h ARG 169 CO 0.05 0.15 0.19 -0.09 -1.07 0.00 0.00 179.97 179.19 1eey h ARG 170 N 0.23 0.37 -0.58 0.04 2.43 -1.00 -0.11 114.38 115.75 1eey h ARG 170 Ca 0.25 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1eey h ARG 170 Cb 0.33 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 1eey h ARG 170 CO -0.32 0.25 0.33 1.88 -1.51 0.00 0.00 179.97 180.59 1eey h TYR 171 N 0.38 0.79 -0.88 2.20 0.05 0.69 0.12 116.97 120.33 1eey h TYR 171 Ca 0.19 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.98 1eey h TYR 171 Cb 0.12 -0.25 -0.05 0.00 1.01 0.00 0.00 36.73 37.56 1eey h TYR 171 CO -0.12 0.56 0.57 -0.07 -1.05 0.00 0.00 178.16 178.06 1eey h LEU 172 N 0.79 0.97 0.47 3.88 3.38 0.11 0.84 115.31 125.74 1eey h LEU 172 Ca 0.21 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 1eey h LEU 172 Cb 0.02 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1eey h LEU 172 CO -0.04 0.68 -0.23 -0.33 0.09 0.00 0.00 178.44 178.62 1eey h GLU 173 N 1.13 -0.61 -0.70 1.13 5.08 -0.52 -0.78 114.58 119.31 1eey h GLU 173 Ca 0.34 0.04 0.12 0.00 -1.00 0.00 0.00 59.36 58.86 1eey h GLU 173 Cb -0.04 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 1eey h GLU 173 CO -0.10 -0.31 0.47 -0.91 -1.00 0.00 0.00 179.01 177.16 1eey h ASN 174 N -1.02 0.43 -0.70 1.42 2.35 -0.66 -0.84 115.58 116.55 1eey h ASN 174 Ca -0.06 0.02 -0.28 0.00 -0.55 0.00 0.00 56.30 55.43 1eey h ASN 174 Cb 0.58 -0.07 -0.16 0.00 0.05 0.00 0.00 38.32 38.71 1eey h ASN 174 CO 0.11 0.24 0.29 0.61 -1.65 0.00 0.00 177.43 177.03 1eey n GLY 175 N -1.51 4.16 0.33 2.83 0.00 0.28 -4.77 105.19 106.51 1eey n GLY 175 Ca 0.12 -1.07 -0.03 0.00 0.00 0.00 0.00 46.02 45.04 1eey n GLY 175 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1eey n LYS 176 N -0.65 -0.25 -0.32 1.61 5.02 -0.30 -0.74 118.16 122.53 1eey n LYS 176 Ca 0.43 1.28 0.11 0.00 -2.02 0.00 0.00 58.31 58.11 1eey n LYS 176 Cb 1.36 -1.89 0.32 0.00 -0.02 0.00 0.00 35.03 34.81 1eey n LYS 176 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1eey h GLU 177 N 0.00 0.78 0.00 1.97 9.09 -1.86 -0.83 114.58 123.73 1eey h GLU 177 Ca 0.24 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.61 1eey h GLU 177 Cb 0.45 -0.18 0.00 0.00 -1.65 0.00 0.00 28.75 27.38 1eey h GLU 177 CO -0.82 0.52 0.00 2.41 0.05 0.00 0.00 179.01 181.17 1eey n THR 178 N -4.62 0.00 -0.23 -1.06 -1.04 0.08 -4.23 114.28 103.17 1eey n THR 178 Ca 0.19 0.46 0.07 0.00 -2.04 0.00 0.00 64.05 62.73 1eey n THR 178 Cb 0.46 -1.41 0.33 0.00 -1.82 0.00 0.00 70.33 67.88 1eey n THR 178 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1eey h LEU 179 N 0.00 0.73 -2.30 -4.42 3.38 -1.18 -2.59 115.31 108.93 1eey h LEU 179 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1eey h LEU 179 Cb 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1eey h LEU 179 CO 0.00 0.45 0.00 0.00 0.09 0.00 0.00 178.44 178.98 1eey n GLN 180 N -4.50 2.99 -3.42 1.13 6.02 -0.32 -4.91 117.38 114.37 1eey n GLN 180 Ca 0.13 -1.84 -0.26 0.00 -0.01 0.00 0.00 57.00 55.01 1eey n GLN 180 Cb 0.27 -1.79 -0.02 0.00 1.02 0.00 0.00 30.24 29.72 1eey n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1eey s ARG 181 N -1.87 3.54 -0.21 -1.09 1.70 -0.98 -4.97 118.95 115.08 1eey s ARG 181 Ca 0.33 -0.21 -0.03 0.00 -0.47 0.00 0.00 55.73 55.34 1eey s ARG 181 Cb 0.23 -2.69 0.07 0.00 -0.57 0.00 0.00 34.95 31.98 1eey s ARG 181 CO 0.13 0.22 0.06 0.95 -1.08 0.00 0.00 175.30 175.57 1eey s THR 182 N -2.15 0.40 -0.48 4.99 -4.23 -1.26 -4.51 115.64 108.40 1eey s THR 182 Ca 0.41 -0.57 -0.18 0.00 -1.18 0.00 0.00 61.69 60.17 1eey s THR 182 Cb -0.10 -1.00 0.05 0.00 1.34 0.00 0.00 72.50 72.79 1eey s THR 182 CO 0.33 -0.30 0.56 -1.81 -0.54 0.00 0.00 174.62 172.86 1eey s ASP 183 N 1.91 6.22 0.39 3.99 1.01 0.20 -4.83 116.67 125.56 1eey s ASP 183 Ca 0.01 -0.85 -0.27 0.00 0.71 0.00 0.00 52.55 52.15 1eey s ASP 183 Cb -0.17 -2.27 -0.10 0.00 1.01 0.00 0.00 42.92 41.40 1eey s ASP 183 CO -0.11 -0.78 1.39 0.00 0.21 0.00 0.00 175.17 175.87 1eey s ALA 184 N 2.43 3.41 0.46 5.23 0.00 -1.26 -1.30 121.76 130.73 1eey s ALA 184 Ca 0.14 1.41 -0.24 0.00 0.00 0.00 0.00 51.96 53.27 1eey s ALA 184 Cb -0.19 -3.55 -0.07 0.00 0.00 0.00 0.00 23.12 19.31 1eey s ALA 184 CO 0.12 -0.95 1.31 -1.25 0.00 0.00 0.00 175.76 174.99 1eey s PRO 185 N -2.15 3.67 -0.11 0.00 0.04 -1.26 -4.60 135.00 130.59 1eey s PRO 185 Ca 0.55 2.14 -0.21 0.00 0.04 0.00 0.00 61.00 63.52 1eey s PRO 185 Cb -0.43 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.54 1eey s PRO 185 CO 0.56 -0.74 0.62 0.15 0.04 0.00 0.00 177.00 177.64 1eey s LYS 186 N -2.53 4.36 0.15 4.56 3.01 0.79 -4.80 119.74 125.28 1eey s LYS 186 Ca 0.63 0.70 0.10 0.00 -1.01 0.00 0.00 55.97 56.39 1eey s LYS 186 Cb -0.38 -3.47 -0.04 0.00 -1.01 0.00 0.00 37.83 32.93 1eey s LYS 186 CO 0.47 0.02 -0.23 0.95 0.51 0.00 0.00 175.35 177.07 1eey s THR 187 N 0.99 2.10 0.03 2.17 -4.23 -1.26 -0.64 115.64 114.80 1eey s THR 187 Ca 0.32 -1.82 -0.28 0.00 -1.18 0.00 0.00 61.69 58.73 1eey s THR 187 Cb -0.16 -1.92 0.09 0.00 1.34 0.00 0.00 72.50 71.85 1eey s THR 187 CO 0.14 -0.07 1.02 -1.38 -0.54 0.00 0.00 174.62 173.80 1eey s HIS 188 N -1.42 -0.18 0.17 3.99 -3.43 -1.14 -5.00 115.29 108.27 1eey s HIS 188 Ca 0.15 -0.00 0.08 0.00 -0.80 0.00 0.00 55.06 54.49 1eey s HIS 188 Cb -0.09 0.58 -0.04 0.00 -1.43 0.00 0.00 32.58 31.60 1eey s HIS 188 CO 0.07 -0.57 -0.18 -1.64 -2.00 0.00 0.00 174.74 170.43 1eey s MET 189 N -2.98 1.27 0.10 -0.38 -1.94 -1.26 -0.53 119.30 113.58 1eey s MET 189 Ca 0.10 -1.42 0.07 0.00 -1.71 0.00 0.00 55.69 52.73 1eey s MET 189 Cb -0.00 -1.29 -0.03 0.00 2.01 0.00 0.00 34.83 35.52 1eey s MET 189 CO -0.03 0.26 -0.19 0.95 -0.01 0.00 0.00 175.02 176.00 1eey s THR 190 N -2.15 1.56 -0.09 2.05 -4.23 -0.43 -4.97 115.64 107.39 1eey s THR 190 Ca 0.16 -1.52 0.01 0.00 -1.18 0.00 0.00 61.69 59.17 1eey s THR 190 Cb -0.05 -1.46 0.02 0.00 1.34 0.00 0.00 72.50 72.35 1eey s THR 190 CO 0.06 -0.13 -0.11 -2.28 -0.54 0.00 0.00 174.62 171.62 1eey s HIS 191 N -1.28 1.56 -0.04 3.99 2.46 -1.26 -1.42 115.29 119.30 1eey s HIS 191 Ca 0.05 -0.67 -0.01 0.00 0.47 0.00 0.00 55.06 54.89 1eey s HIS 191 Cb -0.10 -1.18 0.03 0.00 -0.13 0.00 0.00 32.58 31.20 1eey s HIS 191 CO 0.04 -0.39 0.04 -1.01 -2.47 0.00 0.00 174.74 170.95 1eey s HIS 192 N 1.04 0.18 -0.28 3.88 3.76 -0.46 -4.97 115.29 118.43 1eey s HIS 192 Ca -0.07 0.14 -0.29 0.00 -0.15 0.00 0.00 55.06 54.69 1eey s HIS 192 Cb -0.15 -0.48 0.01 0.00 1.11 0.00 0.00 32.58 33.07 1eey s HIS 192 CO -0.01 -0.18 1.16 0.00 -0.85 0.00 0.00 174.74 174.86 1eey s ALA 193 N 1.80 3.51 0.04 -1.40 0.00 -1.26 0.79 121.76 125.23 1eey s ALA 193 Ca 0.01 0.09 -0.04 0.00 0.00 0.00 0.00 51.96 52.02 1eey s ALA 193 Cb -0.12 -3.68 -0.28 0.00 0.00 0.00 0.00 23.12 19.03 1eey s ALA 193 CO -0.03 -1.47 0.99 -0.39 0.00 0.00 0.00 175.76 174.86 1eey h VAL 194 N 5.73 1.32 -1.78 0.00 -1.51 -1.77 -3.48 116.25 114.75 1eey h VAL 194 Ca -0.23 -2.92 0.00 0.00 -1.23 0.00 0.00 66.70 62.33 1eey h VAL 194 Cb 1.08 2.85 0.00 0.00 -2.13 0.00 0.00 31.29 33.09 1eey h VAL 194 CO 1.02 0.85 0.00 -1.54 -1.23 0.00 0.00 177.57 176.67 1eey n SER 195 N -3.50 0.00 0.01 4.19 3.41 -1.10 -5.01 113.62 111.62 1eey n SER 195 Ca -0.13 -0.78 0.13 0.00 -0.26 0.00 0.00 58.87 57.84 1eey n SER 195 Cb 1.04 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 65.49 1eey n SER 195 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1eey n ASP 196 N -1.94 0.21 0.00 4.04 5.75 -1.26 -3.91 116.55 119.43 1eey n ASP 196 Ca 0.00 0.31 0.00 0.00 -0.01 0.00 0.00 54.79 55.09 1eey n ASP 196 Cb 0.00 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.77 1eey n ASP 196 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1eey n HIS 197 N -1.58 0.00 -3.88 2.11 1.44 -1.26 -4.88 115.22 107.16 1eey n HIS 197 Ca 0.06 -0.14 -0.11 0.00 -2.01 0.00 0.00 57.72 55.53 1eey n HIS 197 Cb 0.35 -0.01 -0.10 0.00 0.12 0.00 0.00 29.99 30.35 1eey n HIS 197 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1eey s GLU 198 N -0.27 0.53 0.03 -1.40 2.02 -1.25 -1.85 118.70 116.50 1eey s GLU 198 Ca 0.00 -0.50 -0.09 0.00 0.02 0.00 0.00 54.97 54.41 1eey s GLU 198 Cb 0.00 0.22 0.00 0.00 0.10 0.00 0.00 34.13 34.45 1eey s GLU 198 CO 0.00 -0.13 0.17 0.00 0.02 0.00 0.00 175.26 175.32 1eey s ALA 199 N -1.75 -0.32 -0.21 5.21 0.00 0.80 -2.13 121.76 123.36 1eey s ALA 199 Ca -0.12 -0.27 -0.12 0.00 0.00 0.00 0.00 51.96 51.45 1eey s ALA 199 Cb -0.06 0.23 -0.05 0.00 0.00 0.00 0.00 23.12 23.25 1eey s ALA 199 CO -0.00 -0.32 0.22 0.99 0.00 0.00 0.00 175.76 176.66 1eey s THR 200 N -2.27 5.33 -0.24 0.00 2.01 0.24 0.40 115.64 121.11 1eey s THR 200 Ca -0.07 0.35 -0.03 0.00 0.31 0.00 0.00 61.69 62.24 1eey s THR 200 Cb -0.03 -3.56 0.01 0.00 0.01 0.00 0.00 72.50 68.93 1eey s THR 200 CO -0.02 0.35 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.00 1eey s LEU 201 N 0.87 3.10 -0.12 4.42 2.96 -0.69 -1.36 118.68 127.86 1eey s LEU 201 Ca 0.11 -0.62 -0.00 0.00 -0.22 0.00 0.00 54.13 53.41 1eey s LEU 201 Cb -0.13 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1eey s LEU 201 CO 0.04 -0.08 -0.12 -0.60 -1.32 0.00 0.00 176.35 174.27 1eey s ARG 202 N 1.42 3.28 -0.22 1.98 3.52 -0.51 -1.84 118.95 126.58 1eey s ARG 202 Ca 0.03 -0.66 -0.07 0.00 -0.13 0.00 0.00 55.73 54.91 1eey s ARG 202 Cb -0.15 -2.63 -0.03 0.00 -1.56 0.00 0.00 34.95 30.57 1eey s ARG 202 CO -0.03 0.29 0.04 0.00 -0.81 0.00 0.00 175.30 174.79 1eey s TRP 204 N 1.20 3.18 -0.20 0.00 0.52 0.31 -1.66 118.94 122.29 1eey s TRP 204 Ca 0.04 0.18 -0.01 0.00 0.02 0.00 0.00 56.10 56.34 1eey s TRP 204 Cb -0.14 -1.76 0.05 0.00 -1.15 0.00 0.00 33.47 30.47 1eey s TRP 204 CO 0.03 0.50 -0.03 0.00 0.02 0.00 0.00 176.95 177.47 1eey s ALA 205 N -1.00 1.49 0.20 0.98 0.00 -0.50 -2.88 121.76 120.05 1eey s ALA 205 Ca 0.17 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.25 1eey s ALA 205 Cb -0.12 -1.24 -0.05 0.00 0.00 0.00 0.00 23.12 21.72 1eey s ALA 205 CO 0.07 -1.04 -0.16 -0.51 0.00 0.00 0.00 175.76 174.12 1eey s LEU 206 N 1.62 2.52 -1.46 0.00 1.43 0.18 -1.95 118.68 121.03 1eey s LEU 206 Ca -0.02 -0.96 -0.11 0.00 -1.03 0.00 0.00 54.13 52.01 1eey s LEU 206 Cb -0.17 -0.77 0.07 0.00 0.03 0.00 0.00 46.19 45.35 1eey s LEU 206 CO -0.07 -0.10 0.76 -0.24 0.23 0.00 0.00 176.35 176.93 1eey n SER 207 N -0.16 -4.76 -4.86 2.29 2.88 -0.95 -0.15 113.62 107.91 1eey n SER 207 Ca -0.10 -0.56 -0.28 0.00 -1.33 0.00 0.00 58.87 56.61 1eey n SER 207 Cb 0.59 -3.84 -0.05 0.00 -0.75 0.00 0.00 64.21 60.16 1eey n SER 207 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1eey s PHE 208 N -3.16 3.33 -0.19 0.66 -0.12 -1.10 -4.67 117.98 112.73 1eey s PHE 208 Ca 0.52 0.09 -0.14 0.00 -0.05 0.00 0.00 56.93 57.34 1eey s PHE 208 Cb -0.26 -1.62 0.06 0.00 -0.63 0.00 0.00 43.02 40.57 1eey s PHE 208 CO 0.64 0.53 0.49 -0.47 -0.05 0.00 0.00 175.22 176.35 1eey s TYR 209 N -1.65 -0.64 1.17 3.49 5.04 -0.42 -1.29 117.35 123.05 1eey s TYR 209 Ca 0.33 1.42 -0.20 0.00 -2.44 0.00 0.00 57.07 56.18 1eey s TYR 209 Cb -0.11 0.28 0.28 0.00 0.35 0.00 0.00 41.96 42.76 1eey s TYR 209 CO 0.26 -0.33 1.19 -1.25 -1.34 0.00 0.00 175.55 174.07 1eey s PRO 210 N 0.91 -1.00 0.38 4.97 0.04 -1.26 0.63 135.00 139.66 1eey s PRO 210 Ca -0.05 -0.30 0.14 0.00 0.04 0.00 0.00 61.00 60.83 1eey s PRO 210 Cb -0.06 -1.64 0.75 0.00 0.04 0.00 0.00 34.50 33.59 1eey s PRO 210 CO -0.08 -3.52 1.82 0.00 0.04 0.00 0.00 177.00 175.27 1eey h ALA 211 N -2.44 1.31 -2.38 8.56 0.00 -1.96 -3.45 119.26 118.89 1eey h ALA 211 Ca -0.43 -0.33 -0.57 0.00 0.00 0.00 0.00 54.91 53.58 1eey h ALA 211 Cb 1.26 -0.06 0.06 0.00 0.00 0.00 0.00 17.79 19.05 1eey h ALA 211 CO 0.29 0.46 0.85 -1.91 0.00 0.00 0.00 179.25 178.94 1eey n GLU 212 N -3.98 2.32 -3.52 0.00 4.07 -1.26 -4.96 120.64 113.31 1eey n GLU 212 Ca -0.02 0.84 -0.10 0.00 -0.06 0.00 0.00 57.16 57.82 1eey n GLU 212 Cb 0.42 -2.62 -0.03 0.00 -0.06 0.00 0.00 31.44 29.14 1eey n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1eey s ILE 213 N 0.93 0.00 -0.13 6.31 2.07 -1.26 -4.67 121.20 124.45 1eey s ILE 213 Ca 0.77 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 60.02 1eey s ILE 213 Cb -0.63 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 40.98 1eey s ILE 213 CO 0.37 0.00 -0.14 -0.89 -1.91 0.00 0.00 174.94 172.37 1eey s THR 214 N -2.40 1.48 -0.17 4.00 2.01 -0.53 -4.99 115.64 115.05 1eey s THR 214 Ca 0.01 -0.60 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 1eey s THR 214 Cb -0.01 -1.39 0.05 0.00 0.01 0.00 0.00 72.50 71.16 1eey s THR 214 CO -0.04 0.44 0.00 -0.22 -0.69 0.00 0.00 174.62 174.11 1eey s LEU 215 N 1.33 1.25 0.20 4.42 2.96 -1.26 -0.83 118.68 126.76 1eey s LEU 215 Ca 0.01 -0.67 0.01 0.00 -0.22 0.00 0.00 54.13 53.26 1eey s LEU 215 Cb -0.14 -0.67 -0.05 0.00 0.50 0.00 0.00 46.19 45.84 1eey s LEU 215 CO -0.07 -0.25 0.05 0.42 -1.32 0.00 0.00 176.35 175.17 1eey s THR 216 N 1.80 0.54 0.01 3.68 -4.23 -0.61 -4.92 115.64 111.91 1eey s THR 216 Ca 0.00 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.61 1eey s THR 216 Cb -0.16 -2.33 -0.02 0.00 1.34 0.00 0.00 72.50 71.33 1eey s THR 216 CO -0.07 -0.27 -0.24 0.26 -0.54 0.00 0.00 174.62 173.76 1eey s TRP 217 N -3.76 2.38 0.08 3.99 0.52 -1.26 -0.39 118.94 120.51 1eey s TRP 217 Ca 0.30 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 56.09 1eey s TRP 217 Cb 0.07 -1.47 -0.03 0.00 -1.15 0.00 0.00 33.47 30.89 1eey s TRP 217 CO 0.08 0.07 -0.15 -0.65 0.02 0.00 0.00 176.95 176.32 1eey s GLN 218 N -0.92 0.88 -0.19 4.98 -0.21 0.12 -2.65 119.66 121.66 1eey s GLN 218 Ca 0.11 -1.03 0.01 0.00 0.02 0.00 0.00 55.36 54.47 1eey s GLN 218 Cb -0.10 -0.88 0.03 0.00 1.00 0.00 0.00 33.01 33.05 1eey s GLN 218 CO 0.01 0.19 -0.18 0.50 -2.12 0.00 0.00 175.29 173.69 1eey s ARG 219 N -1.95 2.89 -1.54 2.91 3.52 -0.11 -1.12 118.95 123.56 1eey s ARG 219 Ca 0.01 -0.90 -0.04 0.00 -0.13 0.00 0.00 55.73 54.67 1eey s ARG 219 Cb -0.09 -2.64 0.01 0.00 -1.56 0.00 0.00 34.95 30.68 1eey s ARG 219 CO 0.03 -0.26 0.42 -0.25 -0.81 0.00 0.00 175.30 174.42 1eey n ASP 220 N 4.60 -5.64 0.00 -2.12 8.00 0.49 -1.00 116.55 120.88 1eey n ASP 220 Ca -0.20 -0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.09 1eey n ASP 220 Cb 0.49 -4.60 0.00 0.00 -0.02 0.00 0.00 41.12 36.98 1eey n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1eey n GLY 221 N -1.32 0.73 3.84 0.44 0.00 -1.26 -5.02 105.19 102.60 1eey n GLY 221 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1eey n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1eey s GLU 222 N -0.18 3.38 0.45 1.61 0.41 -0.17 -5.00 118.70 119.20 1eey s GLU 222 Ca 0.00 -0.18 -0.25 0.00 -0.41 0.00 0.00 54.97 54.13 1eey s GLU 222 Cb 0.00 -3.13 -0.09 0.00 -1.78 0.00 0.00 34.13 29.13 1eey s GLU 222 CO 0.00 0.75 1.30 -0.25 -0.49 0.00 0.00 175.26 176.57 1eey n ASP 223 N 2.05 2.66 -0.66 -0.19 8.00 -1.26 -0.93 116.55 126.22 1eey n ASP 223 Ca -0.20 1.09 0.06 0.00 0.71 0.00 0.00 54.79 56.45 1eey n ASP 223 Cb 0.55 -1.52 0.19 0.00 -0.02 0.00 0.00 41.12 40.31 1eey n ASP 223 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1eey n GLN 224 N -0.14 1.42 -0.28 -1.24 1.13 -1.08 -4.80 117.38 112.39 1eey n GLN 224 Ca 0.07 -3.14 0.00 0.00 -1.94 0.00 0.00 57.00 51.99 1eey n GLN 224 Cb 0.41 -1.45 0.05 0.00 0.11 0.00 0.00 30.24 29.35 1eey n GLN 224 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1eey n THR 225 N -0.97 -0.37 1.23 5.09 -1.04 -1.26 -0.13 114.28 116.82 1eey n THR 225 Ca 0.18 1.72 0.14 0.00 -2.04 0.00 0.00 64.05 64.05 1eey n THR 225 Cb 0.73 -2.29 0.69 0.00 -1.82 0.00 0.00 70.33 67.64 1eey n THR 225 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1eey n GLN 226 N -5.11 0.24 -0.30 -2.82 6.02 -1.26 -2.98 117.38 111.17 1eey n GLN 226 Ca 0.08 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.15 1eey n GLN 226 Cb 0.31 -1.50 0.20 0.00 1.02 0.00 0.00 30.24 30.27 1eey n GLN 226 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1eey n ASP 227 N -1.38 3.35 -4.45 1.08 8.00 0.82 -4.97 116.55 119.00 1eey n ASP 227 Ca 0.11 -2.65 -0.33 0.00 0.71 0.00 0.00 54.79 52.63 1eey n ASP 227 Cb 0.28 -0.41 -0.13 0.00 -0.02 0.00 0.00 41.12 40.84 1eey n ASP 227 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1eey s THR 228 N -2.16 3.32 -0.40 -3.53 2.01 -0.86 -4.47 115.64 109.55 1eey s THR 228 Ca 0.33 -0.59 -0.15 0.00 0.31 0.00 0.00 61.69 61.58 1eey s THR 228 Cb 0.25 -2.38 0.01 0.00 0.01 0.00 0.00 72.50 70.39 1eey s THR 228 CO 0.10 0.55 0.34 -0.70 -0.69 0.00 0.00 174.62 174.22 1eey s GLU 229 N -0.09 3.12 -0.19 4.92 2.12 0.52 -4.93 118.70 124.17 1eey s GLU 229 Ca -0.01 -0.84 -0.01 0.00 0.36 0.00 0.00 54.97 54.47 1eey s GLU 229 Cb -0.14 -3.94 0.00 0.00 0.26 0.00 0.00 34.13 30.32 1eey s GLU 229 CO 0.03 -0.73 -0.12 -1.17 -0.54 0.00 0.00 175.26 172.73 1eey s LEU 230 N 1.86 2.54 0.39 2.70 2.96 -1.26 -0.82 118.68 127.04 1eey s LEU 230 Ca 0.08 -0.49 -0.05 0.00 -0.22 0.00 0.00 54.13 53.45 1eey s LEU 230 Cb -0.18 -1.61 -0.05 0.00 0.50 0.00 0.00 46.19 44.86 1eey s LEU 230 CO 0.11 0.02 0.68 0.68 -1.32 0.00 0.00 176.35 176.53 1eey s VAL 231 N 1.20 4.95 0.42 1.68 -7.23 -1.13 -5.04 120.40 115.26 1eey s VAL 231 Ca 0.02 0.13 -0.26 0.00 -1.81 0.00 0.00 61.98 60.06 1eey s VAL 231 Cb -0.14 -3.80 -0.09 0.00 0.56 0.00 0.00 36.38 32.90 1eey s VAL 231 CO -0.05 -0.60 1.42 -0.70 -0.31 0.00 0.00 175.10 174.86 1eey s GLU 232 N -4.18 3.87 0.32 4.82 2.12 -1.26 -4.66 118.70 119.72 1eey s GLU 232 Ca 0.46 2.41 -0.29 0.00 0.36 0.00 0.00 54.97 57.91 1eey s GLU 232 Cb -0.10 -2.77 -0.11 0.00 0.26 0.00 0.00 34.13 31.41 1eey s GLU 232 CO 0.37 -0.67 1.52 0.99 -0.54 0.00 0.00 175.26 176.93 1eey s THR 233 N -1.19 2.19 0.07 -1.70 2.01 -1.26 -4.83 115.64 110.94 1eey s THR 233 Ca 0.58 0.17 0.05 0.00 0.31 0.00 0.00 61.69 62.80 1eey s THR 233 Cb -0.43 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 1eey s THR 233 CO 0.57 0.03 -0.13 0.00 -0.69 0.00 0.00 174.62 174.40 1eey s ARG 234 N -1.09 0.79 0.09 4.92 1.70 -0.34 -4.96 118.95 120.05 1eey s ARG 234 Ca 0.58 -0.94 -0.30 0.00 -0.47 0.00 0.00 55.73 54.60 1eey s ARG 234 Cb -0.46 -0.76 -0.06 0.00 -0.57 0.00 0.00 34.95 33.10 1eey s ARG 234 CO 0.53 0.16 1.12 -1.25 -1.08 0.00 0.00 175.30 174.78 1eey s PRO 235 N -1.77 4.51 0.43 3.89 0.04 -1.26 -0.68 135.00 140.15 1eey s PRO 235 Ca -0.02 1.68 0.23 0.00 0.04 0.00 0.00 61.00 62.93 1eey s PRO 235 Cb -0.10 -3.35 0.52 0.00 0.04 0.00 0.00 34.50 31.62 1eey s PRO 235 CO 0.02 -0.11 1.66 0.00 0.04 0.00 0.00 177.00 178.61 1eey h ALA 236 N 6.26 0.94 0.00 8.56 0.00 -1.40 -3.47 119.26 130.15 1eey h ALA 236 Ca -0.42 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1eey h ALA 236 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1eey h ALA 236 CO 0.77 0.16 0.00 0.41 0.00 0.00 0.00 179.25 180.59 1eey n GLY 237 N 0.84 1.70 0.84 0.00 0.00 -1.26 -4.92 105.19 102.39 1eey n GLY 237 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1eey n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1eey n ASP 238 N 0.00 3.70 0.00 1.61 5.68 -1.26 -4.93 116.55 121.35 1eey n ASP 238 Ca 0.00 -2.85 0.00 0.00 -0.50 0.00 0.00 54.79 51.44 1eey n ASP 238 Cb 0.00 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 39.49 1eey n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1eey n GLY 239 N -0.36 0.90 3.98 6.12 0.00 -1.26 -5.06 105.19 109.50 1eey n GLY 239 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 1eey n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1eey s THR 240 N -2.25 2.12 0.26 2.61 -4.23 -1.26 -4.91 115.64 107.98 1eey s THR 240 Ca 0.00 -1.18 0.03 0.00 -1.18 0.00 0.00 61.69 59.36 1eey s THR 240 Cb 0.00 -2.31 -0.06 0.00 1.34 0.00 0.00 72.50 71.48 1eey s THR 240 CO 0.00 0.00 0.03 -0.36 -0.54 0.00 0.00 174.62 173.75 1eey s PHE 241 N -2.65 1.69 0.17 3.99 0.08 -0.41 -1.04 117.98 119.79 1eey s PHE 241 Ca 0.51 -0.97 -0.02 0.00 0.12 0.00 0.00 56.93 56.57 1eey s PHE 241 Cb -0.05 -1.02 -0.04 0.00 -0.57 0.00 0.00 43.02 41.35 1eey s PHE 241 CO 0.32 -0.07 0.13 -0.65 -0.10 0.00 0.00 175.22 174.85 1eey s GLN 242 N -3.90 1.09 -0.27 0.44 -0.21 0.14 -2.25 119.66 114.71 1eey s GLN 242 Ca 0.32 -1.48 -0.28 0.00 0.02 0.00 0.00 55.36 53.95 1eey s GLN 242 Cb 0.07 0.28 0.17 0.00 1.00 0.00 0.00 33.01 34.53 1eey s GLN 242 CO 0.12 -0.35 1.29 0.21 -2.12 0.00 0.00 175.29 174.44 1eey s LYS 243 N -4.08 0.19 0.10 2.91 2.20 -0.82 -1.20 119.74 119.03 1eey s LYS 243 Ca 0.29 0.10 -0.02 0.00 -0.36 0.00 0.00 55.97 55.99 1eey s LYS 243 Cb 0.06 0.09 -0.04 0.00 -1.51 0.00 0.00 37.83 36.44 1eey s LYS 243 CO 0.06 -0.05 0.04 1.67 -0.36 0.00 0.00 175.35 176.71 1eey s TRP 244 N -0.62 0.66 -0.01 4.03 1.48 -1.26 -1.40 118.94 121.82 1eey s TRP 244 Ca 0.06 -1.11 -0.01 0.00 -1.06 0.00 0.00 56.10 53.98 1eey s TRP 244 Cb -0.02 -0.40 0.00 0.00 -1.16 0.00 0.00 33.47 31.89 1eey s TRP 244 CO -0.08 -0.47 0.02 0.00 -4.06 0.00 0.00 176.95 172.35 1eey s ALA 245 N -3.98 -0.05 0.05 2.67 0.00 -0.66 -2.82 121.76 116.97 1eey s ALA 245 Ca 0.16 0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.20 1eey s ALA 245 Cb 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.12 1eey s ALA 245 CO -0.04 -0.01 -0.06 0.00 0.00 0.00 0.00 175.76 175.64 1eey s ALA 246 N 0.05 0.57 0.01 0.00 0.00 -0.00 0.29 121.76 122.68 1eey s ALA 246 Ca -0.00 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1eey s ALA 246 Cb -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.20 1eey s ALA 246 CO -0.00 -0.10 -0.02 0.14 0.00 0.00 0.00 175.76 175.77 1eey s VAL 247 N -1.95 0.14 -0.33 0.00 -7.23 -0.77 -0.36 120.40 109.91 1eey s VAL 247 Ca -0.06 -0.44 -0.20 0.00 -1.81 0.00 0.00 61.98 59.47 1eey s VAL 247 Cb -0.06 -0.19 -0.00 0.00 0.56 0.00 0.00 36.38 36.68 1eey s VAL 247 CO -0.01 -0.19 0.60 -0.69 -0.31 0.00 0.00 175.10 174.49 1eey s VAL 248 N -0.65 4.94 -0.14 1.32 1.01 -1.26 -1.70 120.40 123.92 1eey s VAL 248 Ca -0.06 0.65 -0.05 0.00 0.00 0.00 0.00 61.98 62.51 1eey s VAL 248 Cb -0.05 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 1eey s VAL 248 CO -0.00 -0.21 0.04 -0.69 0.00 0.00 0.00 175.10 174.24 1eey s VAL 249 N 2.58 4.65 0.05 2.92 1.01 0.16 -4.91 120.40 126.88 1eey s VAL 249 Ca 0.23 -0.10 -0.31 0.00 0.00 0.00 0.00 61.98 61.81 1eey s VAL 249 Cb -0.15 -3.04 -0.07 0.00 0.00 0.00 0.00 36.38 33.12 1eey s VAL 249 CO 0.13 0.53 1.49 -2.84 0.00 0.00 0.00 175.10 174.42 1eey s PRO 250 N -0.24 4.26 0.14 2.72 0.02 -1.26 -0.14 135.00 140.49 1eey s PRO 250 Ca 0.07 2.13 -0.34 0.00 0.02 0.00 0.00 61.00 62.88 1eey s PRO 250 Cb -0.12 -3.49 -0.16 0.00 0.02 0.00 0.00 34.50 30.75 1eey s PRO 250 CO 0.02 -0.61 1.28 0.43 -0.33 0.00 0.00 177.00 177.79 1eey n SER 251 N 5.10 1.66 0.00 2.53 7.64 -0.77 -0.95 113.62 128.83 1eey n SER 251 Ca 0.14 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.15 1eey n SER 251 Cb 0.42 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 1eey n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1eey n GLY 252 N 2.32 0.48 0.61 0.23 0.00 -1.26 -4.92 105.19 102.67 1eey n GLY 252 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1eey n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1eey n GLN 253 N -1.85 2.85 -0.35 1.61 6.02 -0.12 -4.72 117.38 120.82 1eey n GLN 253 Ca 0.00 -2.20 0.10 0.00 -0.01 0.00 0.00 57.00 54.89 1eey n GLN 253 Cb 0.00 -1.39 0.28 0.00 1.02 0.00 0.00 30.24 30.15 1eey n GLN 253 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1eey h GLU 254 N 1.69 0.87 0.00 -1.09 3.07 -1.92 -1.93 114.58 115.28 1eey h GLU 254 Ca 0.00 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1eey h GLU 254 Cb 0.89 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1eey h GLU 254 CO 0.05 0.57 -0.00 -0.56 -1.40 0.00 0.00 179.01 177.67 1eey h GLN 255 N 0.89 0.00 0.00 2.33 3.07 -1.85 -2.40 115.11 117.16 1eey h GLN 255 Ca 0.53 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.27 1eey h GLN 255 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.22 1eey h GLN 255 CO -0.30 0.00 0.00 0.00 0.09 0.00 0.00 178.83 178.62 1eey h ARG 256 N 0.00 0.00 -5.96 0.06 3.08 -1.71 -3.46 114.38 106.39 1eey h ARG 256 Ca -0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 1eey h ARG 256 Cb 0.10 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.10 1eey h ARG 256 CO 0.00 0.00 -0.35 0.71 -1.07 0.00 0.00 179.97 179.26 1eey s TYR 257 N -3.12 3.58 -0.00 3.04 1.51 -0.90 -0.38 117.35 121.07 1eey s TYR 257 Ca 0.10 0.63 0.00 0.00 -1.01 0.00 0.00 57.07 56.79 1eey s TYR 257 Cb 0.11 -2.04 0.00 0.00 -0.11 0.00 0.00 41.96 39.92 1eey s TYR 257 CO 0.61 0.59 -0.00 0.95 -1.11 0.00 0.00 175.55 176.59 1eey s THR 258 N -1.32 0.01 -0.12 -0.71 -4.23 -0.27 -4.30 115.64 104.69 1eey s THR 258 Ca 0.29 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.71 1eey s THR 258 Cb -0.13 -0.02 -0.04 0.00 1.34 0.00 0.00 72.50 73.64 1eey s THR 258 CO 0.16 0.00 0.17 0.00 -0.54 0.00 0.00 174.62 174.42 1eey s HIS 260 N -0.75 2.39 -0.07 0.00 3.76 0.47 0.16 115.29 121.24 1eey s HIS 260 Ca 0.15 -0.83 0.02 0.00 -0.15 0.00 0.00 55.06 54.25 1eey s HIS 260 Cb -0.12 -1.58 0.01 0.00 1.11 0.00 0.00 32.58 31.99 1eey s HIS 260 CO 0.04 -0.30 -0.14 0.08 -0.85 0.00 0.00 174.74 173.57 1eey s VAL 261 N 0.09 1.29 -0.06 -0.90 1.01 -0.19 -1.57 120.40 120.07 1eey s VAL 261 Ca -0.10 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.33 1eey s VAL 261 Cb -0.15 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.07 1eey s VAL 261 CO 0.06 0.39 -0.13 -1.10 0.00 0.00 0.00 175.10 174.32 1eey s GLN 262 N 0.64 1.76 -0.13 2.72 -0.21 -0.01 -1.17 119.66 123.26 1eey s GLN 262 Ca -0.15 -0.46 -0.29 0.00 0.02 0.00 0.00 55.36 54.49 1eey s GLN 262 Cb -0.16 -1.45 0.09 0.00 1.00 0.00 0.00 33.01 32.48 1eey s GLN 262 CO 0.04 0.06 0.78 -1.58 -2.12 0.00 0.00 175.29 172.47 1eey s HIS 263 N 0.57 -0.61 0.57 0.91 2.46 -1.26 -1.45 115.29 116.47 1eey s HIS 263 Ca -0.13 1.19 0.28 0.00 0.47 0.00 0.00 55.06 56.86 1eey s HIS 263 Cb -0.15 0.39 1.49 0.00 -0.13 0.00 0.00 32.58 34.18 1eey s HIS 263 CO 0.04 -0.48 1.97 1.49 -2.47 0.00 0.00 174.74 175.29 1eey h GLU 264 N 3.39 0.00 0.00 2.88 4.81 -1.94 0.12 114.58 123.83 1eey h GLU 264 Ca -0.26 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 1eey h GLU 264 Cb 1.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1eey h GLU 264 CO 0.29 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.98 1eey n GLY 265 N -1.54 -1.09 3.15 1.92 0.00 -1.26 -4.66 105.19 101.71 1eey n GLY 265 Ca 0.08 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1eey n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1eey s LEU 266 N -2.19 4.10 0.38 0.99 1.43 0.40 -4.45 118.68 119.33 1eey s LEU 266 Ca 0.41 -1.43 0.13 0.00 -1.03 0.00 0.00 54.13 52.21 1eey s LEU 266 Cb 0.21 -1.71 0.96 0.00 0.03 0.00 0.00 46.19 45.68 1eey s LEU 266 CO 0.40 -0.30 1.85 1.55 0.23 0.00 0.00 176.35 180.08 1eey h PRO 267 N 7.97 0.53 -4.80 1.29 0.13 -1.83 -3.40 132.00 131.89 1eey h PRO 267 Ca -0.19 -0.03 -0.47 0.00 -0.87 0.00 0.00 66.00 64.44 1eey h PRO 267 Cb 1.06 -0.12 -0.31 0.00 0.13 0.00 0.00 31.00 31.76 1eey h PRO 267 CO 0.55 0.35 -0.80 -1.59 -0.23 0.00 0.00 178.00 176.27 1eey s LYS 268 N -5.56 1.22 0.44 0.86 -2.85 -1.26 -5.12 119.74 107.47 1eey s LYS 268 Ca -0.09 -0.40 -0.24 0.00 -1.00 0.00 0.00 55.97 54.25 1eey s LYS 268 Cb 0.23 -1.10 -0.10 0.00 -2.06 0.00 0.00 37.83 34.80 1eey s LYS 268 CO 0.79 0.15 1.08 -2.30 0.10 0.00 0.00 175.35 175.16 1eey n PRO 269 N 3.26 1.45 -3.47 1.78 -0.02 -1.26 -4.97 135.00 131.76 1eey n PRO 269 Ca -0.18 0.52 -0.34 0.00 -2.02 0.00 0.00 63.50 61.48 1eey n PRO 269 Cb 0.54 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 1eey n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1eey s LEU 270 N -1.06 4.30 -0.10 2.45 1.43 -0.32 -4.93 118.68 120.45 1eey s LEU 270 Ca 0.64 0.90 -0.01 0.00 -1.03 0.00 0.00 54.13 54.63 1eey s LEU 270 Cb -0.52 -3.26 0.03 0.00 0.03 0.00 0.00 46.19 42.46 1eey s LEU 270 CO 0.56 0.08 -0.01 -0.89 0.23 0.00 0.00 176.35 176.32 1eey s THR 271 N -1.54 0.57 0.10 5.49 2.01 -1.26 -1.02 115.64 120.00 1eey s THR 271 Ca 0.38 -0.10 0.09 0.00 0.31 0.00 0.00 61.69 62.37 1eey s THR 271 Cb -0.14 -0.75 -0.04 0.00 0.01 0.00 0.00 72.50 71.58 1eey s THR 271 CO 0.20 0.21 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.38 1eey s LEU 272 N 1.88 2.63 -0.06 4.42 1.43 0.12 -4.91 118.68 124.19 1eey s LEU 272 Ca 0.04 -0.55 -0.03 0.00 -1.03 0.00 0.00 54.13 52.55 1eey s LEU 272 Cb -0.13 -1.50 0.03 0.00 0.03 0.00 0.00 46.19 44.62 1eey s LEU 272 CO -0.06 0.20 0.14 -0.60 0.23 0.00 0.00 176.35 176.25 1eey s ARG 273 N -1.98 0.11 -0.15 1.70 3.52 -1.26 0.63 118.95 121.52 1eey s ARG 273 Ca 0.17 0.30 -0.29 0.00 -0.13 0.00 0.00 55.73 55.77 1eey s ARG 273 Cb -0.10 -0.08 -0.02 0.00 -1.56 0.00 0.00 34.95 33.19 1eey s ARG 273 CO 0.09 -0.11 1.27 -0.46 -0.81 0.00 0.00 175.30 175.28 1eey s TRP 274 N 0.74 2.85 0.00 5.12 -0.11 -1.26 -5.06 118.94 121.22 1eey s TRP 274 Ca -0.06 0.99 0.00 0.00 1.22 0.00 0.00 56.10 58.26 1eey s TRP 274 Cb -0.07 -3.51 0.00 0.00 -1.50 0.00 0.00 33.47 28.38 1eey s TRP 274 CO -0.04 -1.75 0.00 -0.85 -4.62 0.00 0.00 176.95 169.69