#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nts s VAL 4 N 0.00 3.28 0.05 1.61 1.01 -1.26 -4.60 120.40 120.49 2nts s VAL 4 Ca 0.00 0.79 0.09 0.00 0.00 0.00 0.00 61.98 62.86 2nts s VAL 4 Cb 0.00 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 2nts s VAL 4 CO 0.00 0.02 -0.25 0.42 0.00 0.00 0.00 175.10 175.30 2nts s THR 5 N 2.02 2.30 0.07 3.92 -4.23 -1.01 -4.51 115.64 114.20 2nts s THR 5 Ca 0.68 -1.37 0.05 0.00 -1.18 0.00 0.00 61.69 59.87 2nts s THR 5 Cb -0.37 -1.92 -0.03 0.00 1.34 0.00 0.00 72.50 71.52 2nts s THR 5 CO 0.30 0.34 -0.13 -1.10 -0.54 0.00 0.00 174.62 173.49 2nts s GLN 6 N -1.34 0.77 -0.06 3.99 -0.21 -1.26 -1.48 119.66 120.06 2nts s GLN 6 Ca 0.13 -0.93 -0.12 0.00 0.02 0.00 0.00 55.36 54.45 2nts s GLN 6 Cb -0.10 -0.71 0.02 0.00 1.00 0.00 0.00 33.01 33.22 2nts s GLN 6 CO 0.03 0.15 0.29 0.95 -2.12 0.00 0.00 175.29 174.60 2nts s THR 7 N -1.36 0.03 0.95 -0.19 -4.23 -1.03 -4.49 115.64 105.33 2nts s THR 7 Ca -0.03 -0.26 -0.15 0.00 -1.18 0.00 0.00 61.69 60.06 2nts s THR 7 Cb -0.10 -0.51 0.18 0.00 1.34 0.00 0.00 72.50 73.41 2nts s THR 7 CO 0.02 -0.14 1.27 -2.16 -0.54 0.00 0.00 174.62 173.06 2nts s PRO 8 N -0.60 0.77 -0.09 3.99 0.04 -1.26 -0.19 135.00 137.66 2nts s PRO 8 Ca -0.07 -0.24 -0.16 0.00 0.04 0.00 0.00 61.00 60.56 2nts s PRO 8 Cb -0.04 -1.85 -0.28 0.00 0.04 0.00 0.00 34.50 32.37 2nts s PRO 8 CO 0.02 -2.35 0.61 0.00 0.04 0.00 0.00 177.00 175.32 2nts h ARG 9 N -1.60 0.26 -5.21 4.56 3.08 -1.85 -3.36 114.38 110.27 2nts h ARG 9 Ca -0.45 -0.45 -0.40 0.00 0.07 0.00 0.00 59.98 58.75 2nts h ARG 9 Cb 1.26 0.17 -0.23 0.00 0.08 0.00 0.00 29.97 31.25 2nts h ARG 9 CO 0.44 1.22 -0.78 0.71 -1.07 0.00 0.00 179.97 180.49 2nts s TYR 10 N -2.48 1.13 -0.17 3.04 1.51 -1.26 -0.21 117.35 118.91 2nts s TYR 10 Ca -0.19 -0.42 -0.12 0.00 -1.01 0.00 0.00 57.07 55.34 2nts s TYR 10 Cb 0.04 -0.65 0.05 0.00 -0.11 0.00 0.00 41.96 41.29 2nts s TYR 10 CO 0.78 0.03 0.42 -1.17 -1.11 0.00 0.00 175.55 174.50 2nts s LEU 11 N -1.47 0.12 -0.13 -1.29 2.96 0.03 -4.91 118.68 113.99 2nts s LEU 11 Ca -0.02 0.88 0.01 0.00 -0.22 0.00 0.00 54.13 54.79 2nts s LEU 11 Cb -0.09 1.41 -0.00 0.00 0.50 0.00 0.00 46.19 48.01 2nts s LEU 11 CO 0.02 -0.17 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.07 2nts s ILE 12 N 0.84 2.53 0.14 6.68 1.01 -1.26 -1.83 121.20 129.31 2nts s ILE 12 Ca -0.05 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.77 2nts s ILE 12 Cb -0.06 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 2nts s ILE 12 CO -0.07 0.53 0.03 -0.54 0.00 0.00 0.00 174.94 174.90 2nts s LYS 13 N 0.56 0.97 0.27 2.79 -0.14 -1.01 -5.01 119.74 118.17 2nts s LYS 13 Ca -0.11 -1.46 0.09 0.00 -1.36 0.00 0.00 55.97 53.13 2nts s LYS 13 Cb -0.16 0.05 -0.04 0.00 -1.68 0.00 0.00 37.83 35.99 2nts s LYS 13 CO 0.04 -0.20 0.08 0.95 -0.76 0.00 0.00 175.35 175.46 2nts s THR 14 N -3.89 3.77 0.39 2.17 -4.23 -1.26 -0.13 115.64 112.45 2nts s THR 14 Ca 0.23 -1.71 -0.27 0.00 -1.18 0.00 0.00 61.69 58.76 2nts s THR 14 Cb 0.07 -3.06 -0.11 0.00 1.34 0.00 0.00 72.50 70.75 2nts s THR 14 CO 0.02 -0.35 1.36 0.54 -0.54 0.00 0.00 174.62 175.65 2nts n ARG 15 N -1.02 2.25 0.00 3.99 1.74 -1.25 -2.48 116.66 119.88 2nts n ARG 15 Ca -0.07 0.79 0.00 0.00 -0.77 0.00 0.00 57.85 57.81 2nts n ARG 15 Cb 0.59 -2.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.54 2nts n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nts n GLY 16 N 0.66 3.22 2.32 -0.13 0.00 0.22 -4.89 105.19 106.60 2nts n GLY 16 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 2nts n GLY 16 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2nts n GLN 17 N -2.00 -1.30 -4.19 1.61 6.02 -1.03 -4.05 117.38 112.44 2nts n GLN 17 Ca 0.00 -1.21 -0.11 0.00 -0.01 0.00 0.00 57.00 55.66 2nts n GLN 17 Cb 0.00 -0.90 -0.10 0.00 1.02 0.00 0.00 30.24 30.26 2nts n GLN 17 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2nts s GLN 18 N -4.72 1.00 0.00 -1.09 -2.07 -1.26 -0.21 119.66 111.31 2nts s GLN 18 Ca 0.46 -1.48 0.00 0.00 -1.82 0.00 0.00 55.36 52.53 2nts s GLN 18 Cb -0.02 0.04 -0.00 0.00 -1.09 0.00 0.00 33.01 31.93 2nts s GLN 18 CO 0.33 -0.21 -0.01 0.54 -1.32 0.00 0.00 175.29 174.62 2nts s VAL 19 N -3.89 0.08 -0.13 3.63 0.11 -0.88 -5.01 120.40 114.31 2nts s VAL 19 Ca 0.24 -0.15 0.02 0.00 -2.93 0.00 0.00 61.98 59.16 2nts s VAL 19 Cb 0.07 -0.10 0.02 0.00 -1.53 0.00 0.00 36.38 34.84 2nts s VAL 19 CO 0.02 -0.04 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.69 2nts s THR 20 N -0.19 1.73 0.06 5.04 2.01 -1.26 -1.96 115.64 121.06 2nts s THR 20 Ca -0.02 -0.77 0.06 0.00 0.31 0.00 0.00 61.69 61.27 2nts s THR 20 Cb -0.01 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.89 2nts s THR 20 CO -0.00 0.49 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.55 2nts s LEU 21 N 1.06 3.02 0.24 4.42 1.02 0.60 -4.69 118.68 124.34 2nts s LEU 21 Ca -0.04 -0.31 0.11 0.00 0.02 0.00 0.00 54.13 53.92 2nts s LEU 21 Cb -0.15 -1.79 -0.05 0.00 0.02 0.00 0.00 46.19 44.23 2nts s LEU 21 CO -0.04 0.23 -0.20 -0.55 0.02 0.00 0.00 176.35 175.80 2nts s SER 22 N -1.82 3.61 -0.19 2.29 0.15 0.73 -0.40 113.70 118.07 2nts s SER 22 Ca 0.19 -0.92 -0.09 0.00 0.70 0.00 0.00 55.95 55.83 2nts s SER 22 Cb -0.11 -0.33 0.07 0.00 -1.71 0.00 0.00 66.02 63.94 2nts s SER 22 CO 0.10 0.07 0.43 0.00 1.20 0.00 0.00 173.24 175.05 2nts s SER 24 N 1.95 4.71 0.82 0.00 0.01 -0.55 -0.74 113.70 119.90 2nts s SER 24 Ca -0.06 -0.74 -0.11 0.00 1.31 0.00 0.00 55.95 56.35 2nts s SER 24 Cb -0.10 -1.78 0.09 0.00 0.21 0.00 0.00 66.02 64.44 2nts s SER 24 CO -0.13 -0.15 1.09 -2.16 0.41 0.00 0.00 173.24 172.31 2nts s PRO 25 N 1.42 1.85 0.22 12.44 0.04 -1.26 -2.41 135.00 147.30 2nts s PRO 25 Ca 0.02 1.07 -0.32 0.00 0.04 0.00 0.00 61.00 61.80 2nts s PRO 25 Cb -0.17 -1.86 -0.13 0.00 0.04 0.00 0.00 34.50 32.39 2nts s PRO 25 CO -0.01 -1.90 1.59 -0.89 0.04 0.00 0.00 177.00 175.83 2nts n ILE 26 N -3.68 0.43 -1.61 0.56 5.41 -1.26 -4.81 119.36 114.40 2nts n ILE 26 Ca 0.08 -0.11 -0.47 0.00 1.00 0.00 0.00 62.75 63.26 2nts n ILE 26 Cb 0.54 -1.75 -0.03 0.00 -0.71 0.00 0.00 39.64 37.69 2nts n ILE 26 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2nts n SER 27 N 3.02 1.73 0.00 4.38 3.41 -1.26 -0.50 113.62 124.40 2nts n SER 27 Ca 0.14 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.89 2nts n SER 27 Cb 0.33 -1.29 0.00 0.00 -0.26 0.00 0.00 64.21 62.99 2nts n SER 27 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nts n GLY 28 N 1.92 3.18 3.73 5.00 0.00 -1.26 -5.03 105.19 112.73 2nts n GLY 28 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2nts n GLY 28 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2nts s HIS 29 N -2.39 3.53 -0.24 1.61 4.02 0.35 -4.92 115.29 117.25 2nts s HIS 29 Ca 0.00 1.50 0.08 0.00 1.02 0.00 0.00 55.06 57.66 2nts s HIS 29 Cb 0.00 -3.33 -0.10 0.00 -1.02 0.00 0.00 32.58 28.13 2nts s HIS 29 CO 0.00 -0.85 0.27 0.54 1.02 0.00 0.00 174.74 175.72 2nts n ARG 30 N 2.76 2.87 -3.72 1.40 5.12 -1.01 -4.81 116.66 119.26 2nts n ARG 30 Ca 0.04 -0.03 -0.38 0.00 -1.93 0.00 0.00 57.85 55.56 2nts n ARG 30 Cb 0.46 -0.99 -0.12 0.00 -1.16 0.00 0.00 32.46 30.65 2nts n ARG 30 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2nts s SER 31 N -2.18 5.28 -0.10 0.55 0.15 -1.00 -4.12 113.70 112.28 2nts s SER 31 Ca 0.01 -0.62 0.01 0.00 0.70 0.00 0.00 55.95 56.05 2nts s SER 31 Cb 0.06 -1.93 -0.02 0.00 -1.71 0.00 0.00 66.02 62.42 2nts s SER 31 CO 0.33 -0.19 -0.13 -0.69 1.20 0.00 0.00 173.24 173.76 2nts s VAL 32 N 1.55 3.14 0.04 4.45 1.01 -0.28 -0.06 120.40 130.24 2nts s VAL 32 Ca 0.03 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.44 2nts s VAL 32 Cb -0.17 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 2nts s VAL 32 CO 0.04 0.55 -0.21 -0.44 0.00 0.00 0.00 175.10 175.04 2nts s SER 33 N -0.06 2.51 0.01 3.32 0.01 0.15 -0.09 113.70 119.54 2nts s SER 33 Ca -0.02 -0.52 0.05 0.00 1.31 0.00 0.00 55.95 56.77 2nts s SER 33 Cb -0.14 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.85 2nts s SER 33 CO 0.04 0.17 -0.12 0.26 0.41 0.00 0.00 173.24 174.00 2nts s TRP 34 N -0.79 2.74 0.02 2.43 0.52 0.20 -1.78 118.94 122.29 2nts s TRP 34 Ca 0.08 -0.13 0.00 0.00 0.02 0.00 0.00 56.10 56.06 2nts s TRP 34 Cb -0.09 -1.56 -0.02 0.00 -1.15 0.00 0.00 33.47 30.65 2nts s TRP 34 CO 0.02 0.31 -0.03 0.71 0.02 0.00 0.00 176.95 177.97 2nts s TYR 35 N -0.94 0.30 -0.22 -1.98 2.02 0.02 -0.56 117.35 115.99 2nts s TYR 35 Ca 0.16 -0.57 -0.04 0.00 -0.37 0.00 0.00 57.07 56.25 2nts s TYR 35 Cb -0.11 -0.22 -0.01 0.00 -0.40 0.00 0.00 41.96 41.23 2nts s TYR 35 CO 0.06 -0.20 -0.05 -1.14 -1.57 0.00 0.00 175.55 172.65 2nts s GLN 36 N -1.67 3.33 -0.24 -0.62 0.74 -0.13 -0.27 119.66 120.79 2nts s GLN 36 Ca -0.14 -0.65 -0.06 0.00 0.05 0.00 0.00 55.36 54.56 2nts s GLN 36 Cb -0.08 -3.00 -0.02 0.00 1.10 0.00 0.00 33.01 31.01 2nts s GLN 36 CO -0.02 -0.21 0.03 -1.14 -0.55 0.00 0.00 175.29 173.40 2nts s GLN 37 N 1.46 3.54 0.12 1.67 0.74 0.19 -0.86 119.66 126.52 2nts s GLN 37 Ca 0.05 -0.54 0.05 0.00 0.05 0.00 0.00 55.36 54.97 2nts s GLN 37 Cb -0.14 -3.21 -0.04 0.00 1.10 0.00 0.00 33.01 30.72 2nts s GLN 37 CO -0.04 -0.20 -0.12 0.95 -0.55 0.00 0.00 175.29 175.33 2nts s THR 38 N 1.56 1.17 0.22 -0.34 -4.23 -0.56 -1.44 115.64 112.02 2nts s THR 38 Ca 0.06 -1.74 -0.07 0.00 -1.18 0.00 0.00 61.69 58.76 2nts s THR 38 Cb -0.15 -1.52 0.15 0.00 1.34 0.00 0.00 72.50 72.32 2nts s THR 38 CO 0.01 -0.51 1.77 1.55 -0.54 0.00 0.00 174.62 176.89 2nts h PRO 39 N 3.42 1.13 -0.10 3.99 0.13 -1.93 0.82 132.00 139.46 2nts h PRO 39 Ca -0.38 -0.23 -0.01 0.00 -0.87 0.00 0.00 66.00 64.51 2nts h PRO 39 Cb 1.19 -0.17 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 2nts h PRO 39 CO 0.53 0.95 0.04 0.78 -0.23 0.00 0.00 178.00 180.07 2nts h GLY 40 N 1.12 0.17 -0.65 1.56 0.00 -2.00 -3.34 103.07 99.92 2nts h GLY 40 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2nts h GLY 40 CO -0.01 0.09 0.00 -1.06 0.00 0.00 0.00 176.54 175.56 2nts n GLN 41 N -4.91 2.84 0.00 4.80 6.02 -1.23 -5.11 117.38 119.79 2nts n GLN 41 Ca -0.06 -1.89 0.00 0.00 -0.01 0.00 0.00 57.00 55.05 2nts n GLN 41 Cb 0.12 -1.20 0.00 0.00 1.02 0.00 0.00 30.24 30.18 2nts n GLN 41 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nts n GLY 42 N -0.12 0.88 3.53 1.08 0.00 0.28 -4.52 105.19 106.33 2nts n GLY 42 Ca 0.07 -0.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 2nts n GLY 42 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nts s LEU 43 N 0.00 4.13 -0.13 0.99 2.96 -1.26 -1.49 118.68 123.88 2nts s LEU 43 Ca 0.00 -0.21 -0.03 0.00 -0.22 0.00 0.00 54.13 53.67 2nts s LEU 43 Cb 0.00 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.73 2nts s LEU 43 CO 0.00 -1.12 -0.02 -1.10 -1.32 0.00 0.00 176.35 172.79 2nts s GLN 44 N 3.74 3.39 0.01 1.98 -1.52 -0.04 -4.94 119.66 122.28 2nts s GLN 44 Ca 0.31 -0.47 -0.30 0.00 -1.95 0.00 0.00 55.36 52.95 2nts s GLN 44 Cb -0.12 -2.87 -0.05 0.00 -0.22 0.00 0.00 33.01 29.75 2nts s GLN 44 CO 0.21 0.43 1.31 0.12 -0.25 0.00 0.00 175.29 177.12 2nts s PHE 45 N -0.15 3.10 -0.02 0.91 5.99 -1.26 -0.96 117.98 125.59 2nts s PHE 45 Ca 0.04 1.03 -0.02 0.00 0.00 0.00 0.00 56.93 57.98 2nts s PHE 45 Cb -0.13 -3.56 -0.01 0.00 0.00 0.00 0.00 43.02 39.33 2nts s PHE 45 CO 0.02 -1.92 -0.03 1.28 -0.00 0.00 0.00 175.22 174.57 2nts n LEU 46 N 4.87 0.27 -3.65 6.12 7.99 0.27 -3.79 117.00 129.08 2nts n LEU 46 Ca 0.12 0.22 -0.04 0.00 -0.01 0.00 0.00 56.01 56.29 2nts n LEU 46 Cb 0.45 -0.55 -0.01 0.00 -0.11 0.00 0.00 43.42 43.19 2nts n LEU 46 CO 0.57 -0.49 0.77 0.72 -1.51 0.00 0.00 177.39 177.46 2nts s PHE 47 N -1.21 -0.19 -0.03 -1.77 -0.12 -1.19 -0.24 117.98 113.23 2nts s PHE 47 Ca -0.03 -0.02 0.05 0.00 -0.05 0.00 0.00 56.93 56.88 2nts s PHE 47 Cb 0.00 0.59 -0.01 0.00 -0.63 0.00 0.00 43.02 42.97 2nts s PHE 47 CO 0.04 -0.63 -0.19 -2.00 -0.05 0.00 0.00 175.22 172.39 2nts s GLU 48 N -3.07 1.81 -0.02 1.99 -6.30 -0.07 -0.63 118.70 112.41 2nts s GLU 48 Ca 0.10 -0.70 0.06 0.00 -2.50 0.00 0.00 54.97 51.93 2nts s GLU 48 Cb -0.00 -1.64 -0.01 0.00 0.00 0.00 0.00 34.13 32.48 2nts s GLU 48 CO -0.03 0.35 -0.18 0.71 0.02 0.00 0.00 175.26 176.13 2nts s TYR 49 N -0.22 1.66 -0.21 5.30 1.51 0.87 -1.65 117.35 124.60 2nts s TYR 49 Ca 0.02 -0.33 -0.06 0.00 -1.01 0.00 0.00 57.07 55.69 2nts s TYR 49 Cb -0.10 -1.07 0.10 0.00 -0.11 0.00 0.00 41.96 40.78 2nts s TYR 49 CO 0.01 -0.04 0.43 0.12 -1.11 0.00 0.00 175.55 174.96 2nts s PHE 50 N -0.40 -0.85 -0.83 2.71 5.36 -0.78 -1.13 117.98 122.06 2nts s PHE 50 Ca 0.06 1.48 -0.05 0.00 -0.96 0.00 0.00 56.93 57.46 2nts s PHE 50 Cb -0.07 0.30 0.01 0.00 -0.34 0.00 0.00 43.02 42.91 2nts s PHE 50 CO -0.00 -0.53 0.69 -1.71 -1.46 0.00 0.00 175.22 172.20 2nts n ASN 51 N 5.39 -4.63 0.00 6.13 2.85 -1.26 -2.58 115.26 121.16 2nts n ASN 51 Ca -0.08 -0.31 0.00 0.00 -0.11 0.00 0.00 54.58 54.08 2nts n ASN 51 Cb 0.50 -3.23 0.00 0.00 1.24 0.00 0.00 39.78 38.29 2nts n ASN 51 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2nts n GLU 52 N -3.18 0.00 -4.94 1.20 1.02 -1.26 -4.96 120.64 108.51 2nts n GLU 52 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.82 2nts n GLU 52 Cb 0.54 -3.19 -0.13 0.00 -0.02 0.00 0.00 31.44 28.63 2nts n GLU 52 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2nts s THR 53 N -2.33 2.93 -0.13 2.62 -1.32 -1.07 -4.54 115.64 111.81 2nts s THR 53 Ca 0.00 -0.77 -0.29 0.00 -1.21 0.00 0.00 61.69 59.41 2nts s THR 53 Cb 0.00 -2.13 -0.01 0.00 -1.51 0.00 0.00 72.50 68.84 2nts s THR 53 CO 0.00 0.59 1.13 -1.58 -2.21 0.00 0.00 174.62 172.55 2nts s GLN 54 N -0.69 4.32 -0.22 7.08 0.74 -1.26 -1.86 119.66 127.78 2nts s GLN 54 Ca 0.11 1.54 0.07 0.00 0.05 0.00 0.00 55.36 57.12 2nts s GLN 54 Cb -0.11 -3.62 -0.18 0.00 1.10 0.00 0.00 33.01 30.20 2nts s GLN 54 CO 0.00 -0.51 -0.11 0.54 -0.55 0.00 0.00 175.29 174.67 2nts n ARG 55 N 5.69 0.73 -4.06 1.67 1.74 -0.66 -5.00 116.66 116.78 2nts n ARG 55 Ca 0.11 0.08 -0.13 0.00 -0.77 0.00 0.00 57.85 57.15 2nts n ARG 55 Cb 0.46 -1.48 -0.12 0.00 -1.02 0.00 0.00 32.46 30.31 2nts n ARG 55 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2nts s ASN 56 N -5.93 0.66 -0.01 0.55 2.47 -1.25 -5.01 114.94 106.42 2nts s ASN 56 Ca -0.24 -0.43 -0.02 0.00 0.42 0.00 0.00 52.86 52.59 2nts s ASN 56 Cb 0.07 0.03 -0.00 0.00 -1.45 0.00 0.00 41.25 39.90 2nts s ASN 56 CO 0.62 -0.16 0.05 -0.75 -3.72 0.00 0.00 177.10 173.15 2nts s LYS 57 N -1.22 0.18 0.00 0.43 2.20 -1.26 -0.89 119.74 119.18 2nts s LYS 57 Ca -0.08 -0.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.40 2nts s LYS 57 Cb -0.08 0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 2nts s LYS 57 CO 0.00 -0.03 0.00 0.41 -0.36 0.00 0.00 175.35 175.37 2nts n GLY 58 N 2.53 -0.54 1.71 5.54 0.00 0.67 -4.96 105.19 110.14 2nts n GLY 58 Ca -0.16 -1.67 0.08 0.00 0.00 0.00 0.00 46.02 44.27 2nts n GLY 58 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2nts n ASN 59 N -0.37 5.26 -4.78 1.61 3.02 -1.26 -5.00 115.26 113.74 2nts n ASN 59 Ca 0.00 -2.75 -0.36 0.00 -0.03 0.00 0.00 54.58 51.44 2nts n ASN 59 Cb 0.00 -0.63 -0.03 0.00 -0.61 0.00 0.00 39.78 38.51 2nts n ASN 59 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2nts s PHE 60 N -2.41 3.09 0.88 3.10 0.40 -1.26 -5.03 117.98 116.75 2nts s PHE 60 Ca 0.53 1.60 -0.11 0.00 -0.60 0.00 0.00 56.93 58.34 2nts s PHE 60 Cb 0.38 -3.21 0.12 0.00 0.51 0.00 0.00 43.02 40.81 2nts s PHE 60 CO 0.19 -0.97 1.09 -1.25 0.70 0.00 0.00 175.22 174.98 2nts s PRO 61 N -2.65 1.42 0.59 0.24 0.04 -1.26 -4.86 135.00 128.53 2nts s PRO 61 Ca 0.61 0.80 0.09 0.00 0.04 0.00 0.00 61.00 62.54 2nts s PRO 61 Cb -0.24 -1.83 0.50 0.00 0.04 0.00 0.00 34.50 32.97 2nts s PRO 61 CO 0.29 -2.12 1.24 0.78 0.04 0.00 0.00 177.00 177.23 2nts h GLY 62 N -1.46 0.00 2.00 0.56 0.00 -2.03 0.36 103.07 102.51 2nts h GLY 62 Ca -0.49 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 2nts h GLY 62 CO 0.55 0.00 -0.09 3.21 0.00 0.00 0.00 176.54 180.21 2nts h ARG 64 N 0.00 0.00 -5.10 4.80 3.08 -1.90 -3.40 114.38 111.86 2nts h ARG 64 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 2nts h ARG 64 Cb 1.46 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.36 2nts h ARG 64 CO 0.00 0.09 -0.36 -0.06 -1.07 0.00 0.00 179.97 178.57 2nts s PHE 65 N -4.20 3.26 0.25 3.04 0.40 0.11 -1.54 117.98 119.30 2nts s PHE 65 Ca -0.03 0.32 -0.09 0.00 -0.60 0.00 0.00 56.93 56.53 2nts s PHE 65 Cb 0.13 -2.46 -0.01 0.00 0.51 0.00 0.00 43.02 41.19 2nts s PHE 65 CO 0.57 -0.13 0.39 -1.54 0.70 0.00 0.00 175.22 175.20 2nts s SER 66 N 1.51 0.08 0.13 1.36 1.04 -0.72 -4.89 113.70 112.20 2nts s SER 66 Ca 0.12 -1.11 -0.06 0.00 0.48 0.00 0.00 55.95 55.38 2nts s SER 66 Cb -0.15 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.53 2nts s SER 66 CO 0.09 -1.09 0.31 0.61 0.98 0.00 0.00 173.24 174.15 2nts n GLY 67 N -0.37 1.49 3.81 7.32 0.00 -1.26 -0.23 105.19 115.95 2nts n GLY 67 Ca -0.00 -1.08 -0.04 0.00 0.00 0.00 0.00 46.02 44.90 2nts n GLY 67 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2nts s ARG 68 N -2.03 1.39 -0.06 1.61 1.70 -0.64 -4.99 118.95 115.93 2nts s ARG 68 Ca 0.06 -0.83 -0.03 0.00 -0.47 0.00 0.00 55.73 54.46 2nts s ARG 68 Cb -0.02 0.43 0.04 0.00 -0.57 0.00 0.00 34.95 34.83 2nts s ARG 68 CO 0.04 -0.64 0.14 -1.14 -1.08 0.00 0.00 175.30 172.61 2nts s GLN 69 N -2.78 0.09 0.79 3.89 0.74 -1.26 -1.70 119.66 119.43 2nts s GLN 69 Ca 0.16 0.35 -0.12 0.00 0.05 0.00 0.00 55.36 55.80 2nts s GLN 69 Cb -0.02 -0.17 0.07 0.00 1.10 0.00 0.00 33.01 33.98 2nts s GLN 69 CO 0.05 -0.16 1.15 -0.06 -0.55 0.00 0.00 175.29 175.72 2nts s PHE 70 N 1.10 3.00 -0.04 1.67 0.08 0.06 -4.26 117.98 119.59 2nts s PHE 70 Ca -0.09 0.88 0.30 0.00 0.12 0.00 0.00 56.93 58.14 2nts s PHE 70 Cb -0.11 -3.34 1.42 0.00 -0.57 0.00 0.00 43.02 40.42 2nts s PHE 70 CO -0.05 -1.68 1.90 0.66 -0.10 0.00 0.00 175.22 175.95 2nts h SER 71 N -1.00 0.00 -0.35 1.36 4.64 -1.97 -0.25 113.55 115.97 2nts h SER 71 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2nts h SER 71 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2nts h SER 71 CO 0.64 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.14 2nts n ASN 72 N -2.61 2.19 0.00 4.97 0.23 -1.26 -4.90 115.26 113.87 2nts n ASN 72 Ca -0.00 -2.08 0.00 0.00 -0.53 0.00 0.00 54.58 51.97 2nts n ASN 72 Cb 0.16 -0.30 0.00 0.00 -2.08 0.00 0.00 39.78 37.56 2nts n ASN 72 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2nts n SER 73 N 0.52 0.00 -4.78 0.53 7.64 -0.11 -4.95 113.62 112.48 2nts n SER 73 Ca 0.12 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.68 2nts n SER 73 Cb 0.38 -0.43 0.05 0.00 -1.01 0.00 0.00 64.21 63.19 2nts n SER 73 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nts s ARG 74 N -0.05 2.81 0.10 1.43 1.70 -1.26 -4.65 118.95 119.03 2nts s ARG 74 Ca 0.00 1.33 0.03 0.00 -0.47 0.00 0.00 55.73 56.62 2nts s ARG 74 Cb 0.00 -1.96 -0.04 0.00 -0.57 0.00 0.00 34.95 32.39 2nts s ARG 74 CO 0.00 -1.23 -0.09 0.45 -1.08 0.00 0.00 175.30 173.35 2nts s SER 75 N -2.73 1.35 0.13 -2.89 0.15 0.08 -0.76 113.70 109.04 2nts s SER 75 Ca 0.66 -0.90 0.08 0.00 0.70 0.00 0.00 55.95 56.49 2nts s SER 75 Cb -0.19 0.04 -0.04 0.00 -1.71 0.00 0.00 66.02 64.12 2nts s SER 75 CO 0.43 -0.34 -0.20 -1.61 1.20 0.00 0.00 173.24 172.72 2nts s GLU 76 N -3.24 1.20 0.07 5.44 2.02 -0.69 -0.68 118.70 122.83 2nts s GLU 76 Ca 0.08 -1.28 0.05 0.00 0.02 0.00 0.00 54.97 53.84 2nts s GLU 76 Cb 0.00 -1.36 -0.03 0.00 0.10 0.00 0.00 34.13 32.84 2nts s GLU 76 CO -0.02 0.30 -0.15 1.41 0.02 0.00 0.00 175.26 176.82 2nts s MET 77 N -2.35 0.85 -0.04 1.61 1.75 0.46 -1.62 119.30 119.97 2nts s MET 77 Ca 0.11 -0.96 -0.03 0.00 -1.25 0.00 0.00 55.69 53.56 2nts s MET 77 Cb -0.08 -0.88 0.01 0.00 2.84 0.00 0.00 34.83 36.72 2nts s MET 77 CO 0.05 0.20 0.09 1.21 -0.65 0.00 0.00 175.02 175.93 2nts s ASN 78 N -1.70 -0.09 -0.17 1.11 3.84 0.68 -0.29 114.94 118.32 2nts s ASN 78 Ca -0.01 0.19 -0.00 0.00 0.21 0.00 0.00 52.86 53.25 2nts s ASN 78 Cb -0.10 0.18 0.04 0.00 -0.55 0.00 0.00 41.25 40.82 2nts s ASN 78 CO 0.02 -0.04 -0.08 -0.69 -2.79 0.00 0.00 177.10 173.52 2nts s VAL 79 N 0.16 1.28 0.30 -5.21 1.01 -0.83 -1.76 120.40 115.36 2nts s VAL 79 Ca -0.01 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.31 2nts s VAL 79 Cb -0.02 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 2nts s VAL 79 CO -0.00 0.20 0.47 -0.44 0.00 0.00 0.00 175.10 175.32 2nts s SER 80 N 1.57 6.30 -1.12 3.32 0.01 -0.59 -2.08 113.70 121.11 2nts s SER 80 Ca 0.01 0.28 -0.22 0.00 1.31 0.00 0.00 55.95 57.33 2nts s SER 80 Cb -0.15 -1.95 0.01 0.00 0.21 0.00 0.00 66.02 64.14 2nts s SER 80 CO -0.08 -0.20 0.75 0.41 0.41 0.00 0.00 173.24 174.52 2nts n THR 81 N -1.62 -4.95 -1.57 1.44 -1.04 -1.00 -4.81 114.28 100.73 2nts n THR 81 Ca -0.07 -0.75 -0.45 0.00 -2.04 0.00 0.00 64.05 60.74 2nts n THR 81 Cb 0.57 -3.76 -0.02 0.00 -1.82 0.00 0.00 70.33 65.30 2nts n THR 81 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2nts n LEU 82 N -4.20 1.55 -4.58 -4.42 4.77 0.71 -4.51 117.00 106.32 2nts n LEU 82 Ca -0.11 1.17 -0.25 0.00 -0.03 0.00 0.00 56.01 56.79 2nts n LEU 82 Cb 0.59 -1.25 -0.09 0.00 -2.33 0.00 0.00 43.42 40.33 2nts n LEU 82 CO 0.68 -1.49 -0.36 -1.61 -1.33 0.00 0.00 177.39 173.29 2nts s GLU 83 N -1.31 1.95 0.23 3.23 2.02 -1.26 -0.61 118.70 122.95 2nts s GLU 83 Ca 0.61 -1.77 -0.08 0.00 0.02 0.00 0.00 54.97 53.75 2nts s GLU 83 Cb -0.74 -1.86 0.22 0.00 0.10 0.00 0.00 34.13 31.85 2nts s GLU 83 CO 0.58 0.20 1.90 -0.07 0.02 0.00 0.00 175.26 177.88 2nts h LEU 84 N 1.96 0.97 0.00 1.80 3.38 -1.96 -1.89 115.31 119.58 2nts h LEU 84 Ca -0.42 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2nts h LEU 84 Cb 1.25 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2nts h LEU 84 CO 0.66 0.69 0.00 0.61 0.09 0.00 0.00 178.44 180.49 2nts n GLY 85 N -1.34 -0.41 0.01 0.83 0.00 -1.26 -2.42 105.19 100.60 2nts n GLY 85 Ca 0.10 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.23 2nts n GLY 85 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nts n ASP 86 N -0.52 0.63 -4.69 1.61 8.00 -0.71 -4.88 116.55 115.99 2nts n ASP 86 Ca 0.00 -0.39 -0.45 0.00 0.71 0.00 0.00 54.79 54.67 2nts n ASP 86 Cb 0.00 0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 41.56 2nts n ASP 86 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2nts n SER 87 N -1.60 3.25 0.00 -2.24 7.64 -1.01 -4.89 113.62 114.77 2nts n SER 87 Ca 0.05 1.10 0.00 0.00 1.01 0.00 0.00 58.87 61.03 2nts n SER 87 Cb 0.35 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.08 2nts n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nts n ALA 88 N 3.01 0.00 -2.70 -0.43 0.00 0.47 -4.89 120.51 115.97 2nts n ALA 88 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.17 2nts n ALA 88 Cb 0.31 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.66 2nts n ALA 88 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2nts s LEU 89 N 0.00 5.03 -0.25 0.00 2.96 -0.52 -1.18 118.68 124.72 2nts s LEU 89 Ca 0.00 -1.03 -0.23 0.00 -0.22 0.00 0.00 54.13 52.65 2nts s LEU 89 Cb 0.00 -2.10 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 2nts s LEU 89 CO 0.00 -0.46 0.75 -0.31 -1.32 0.00 0.00 176.35 175.01 2nts s TYR 90 N 1.61 3.30 0.06 5.38 2.02 -0.95 -0.64 117.35 128.13 2nts s TYR 90 Ca 0.04 1.00 0.04 0.00 -0.37 0.00 0.00 57.07 57.78 2nts s TYR 90 Cb -0.20 -2.97 -0.04 0.00 -0.40 0.00 0.00 41.96 38.35 2nts s TYR 90 CO 0.08 -0.38 -0.03 -0.51 -1.57 0.00 0.00 175.55 173.15 2nts s LEU 91 N 2.71 3.36 0.00 -1.29 1.43 0.63 -1.97 118.68 123.55 2nts s LEU 91 Ca 0.31 -0.17 0.08 0.00 -1.03 0.00 0.00 54.13 53.32 2nts s LEU 91 Cb -0.15 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 2nts s LEU 91 CO 0.08 0.21 -0.25 0.00 0.23 0.00 0.00 176.35 176.62 2nts s ALA 93 N -0.69 -0.01 0.16 0.00 0.00 -0.73 0.08 121.76 120.56 2nts s ALA 93 Ca 0.11 0.34 0.08 0.00 0.00 0.00 0.00 51.96 52.48 2nts s ALA 93 Cb -0.10 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 2nts s ALA 93 CO 0.00 -0.10 -0.06 -1.54 0.00 0.00 0.00 175.76 174.06 2nts s SER 94 N 0.90 4.50 0.13 0.00 1.04 0.42 -0.68 113.70 120.02 2nts s SER 94 Ca -0.07 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 55.89 2nts s SER 94 Cb -0.10 -0.87 -0.04 0.00 0.10 0.00 0.00 66.02 65.11 2nts s SER 94 CO -0.03 0.12 0.05 -0.55 0.98 0.00 0.00 173.24 173.81 2nts s SER 95 N -2.73 0.36 0.11 7.02 0.15 0.91 -1.28 113.70 118.23 2nts s SER 95 Ca 0.25 -1.20 -0.23 0.00 0.70 0.00 0.00 55.95 55.47 2nts s SER 95 Cb -0.10 0.29 -0.10 0.00 -1.71 0.00 0.00 66.02 64.40 2nts s SER 95 CO 0.16 -0.72 1.71 0.25 1.20 0.00 0.00 173.24 175.84 2nts h LEU 96 N 2.86 -0.21 -0.24 3.45 6.46 -1.87 -2.56 115.31 123.20 2nts h LEU 96 Ca -0.35 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.44 2nts h LEU 96 Cb 1.20 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 41.22 2nts h LEU 96 CO 0.59 -0.11 -0.00 0.00 -0.62 0.00 0.00 178.44 178.31 2nts n ALA 97 N -2.30 1.22 -3.93 1.25 0.00 -1.26 -2.85 120.51 112.65 2nts n ALA 97 Ca -0.06 -0.01 -0.26 0.00 0.00 0.00 0.00 53.44 53.12 2nts n ALA 97 Cb 0.12 -0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.55 2nts n ALA 97 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2nts n ASP 98 N 0.00 -0.69 -4.33 0.00 -0.08 -1.26 -4.86 116.55 105.32 2nts n ASP 98 Ca 0.00 -1.01 -0.19 0.00 -1.51 0.00 0.00 54.79 52.08 2nts n ASP 98 Cb 0.50 -3.09 -0.10 0.00 2.34 0.00 0.00 41.12 40.77 2nts n ASP 98 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 2nts s ARG 99 N -6.51 1.56 0.00 -0.67 3.52 -1.26 -4.77 118.95 110.82 2nts s ARG 99 Ca 0.04 -1.86 0.00 0.00 -0.13 0.00 0.00 55.73 53.77 2nts s ARG 99 Cb -0.01 -0.51 0.00 0.00 -1.56 0.00 0.00 34.95 32.87 2nts s ARG 99 CO 0.89 -0.28 0.00 1.33 -0.81 0.00 0.00 175.30 176.42 2nts n VAL 100 N -0.59 0.00 -3.02 7.11 0.24 -1.26 0.03 118.33 120.83 2nts n VAL 100 Ca -0.01 0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.23 2nts n VAL 100 Cb 0.66 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 33.04 2nts n VAL 100 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2nts n ASN 101 N -0.35 -7.13 -4.97 -1.34 2.85 -1.26 -5.04 115.26 98.02 2nts n ASN 101 Ca 0.00 0.72 -0.21 0.00 -0.11 0.00 0.00 54.58 54.99 2nts n ASN 101 Cb 0.18 -3.40 0.02 0.00 1.24 0.00 0.00 39.78 37.82 2nts n ASN 101 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2nts s THR 102 N -1.48 2.30 -0.01 -0.44 -1.32 0.10 -5.09 115.64 109.71 2nts s THR 102 Ca 0.08 -1.18 -0.30 0.00 -1.21 0.00 0.00 61.69 59.08 2nts s THR 102 Cb -0.01 -2.47 -0.03 0.00 -1.51 0.00 0.00 72.50 68.47 2nts s THR 102 CO 0.49 0.00 1.07 -0.70 -2.21 0.00 0.00 174.62 173.27 2nts s GLU 103 N -4.42 4.48 -0.16 7.08 2.12 -1.26 -4.90 118.70 121.64 2nts s GLU 103 Ca 0.52 1.54 -0.17 0.00 0.36 0.00 0.00 54.97 57.22 2nts s GLU 103 Cb -0.05 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 2nts s GLU 103 CO 0.32 -0.19 0.42 0.00 -0.54 0.00 0.00 175.26 175.27 2nts s ALA 106 N 1.31 3.53 -0.19 6.30 0.00 -1.26 -4.49 121.76 126.97 2nts s ALA 106 Ca 0.54 -0.38 -0.04 0.00 0.00 0.00 0.00 51.96 52.08 2nts s ALA 106 Cb -0.23 -2.62 -0.02 0.00 0.00 0.00 0.00 23.12 20.25 2nts s ALA 106 CO 0.26 -0.14 -0.04 -0.06 0.00 0.00 0.00 175.76 175.78 2nts s PHE 107 N 0.96 2.98 0.06 0.00 0.08 -0.41 -4.94 117.98 116.70 2nts s PHE 107 Ca 0.22 -0.60 -0.04 0.00 0.12 0.00 0.00 56.93 56.63 2nts s PHE 107 Cb -0.15 -2.03 -0.05 0.00 -0.57 0.00 0.00 43.02 40.23 2nts s PHE 107 CO 0.08 -0.29 0.28 -0.06 -0.10 0.00 0.00 175.22 175.13 2nts s PHE 108 N 0.93 3.53 0.15 0.36 0.40 -1.26 -0.44 117.98 121.65 2nts s PHE 108 Ca -0.00 0.47 0.00 0.00 -0.60 0.00 0.00 56.93 56.80 2nts s PHE 108 Cb -0.15 -1.92 0.03 0.00 0.51 0.00 0.00 43.02 41.49 2nts s PHE 108 CO 0.01 0.56 0.21 0.41 0.70 0.00 0.00 175.22 177.11 2nts n GLY 109 N 0.60 0.78 0.25 4.36 0.00 0.11 -4.74 105.19 106.55 2nts n GLY 109 Ca -0.07 -1.98 0.13 0.00 0.00 0.00 0.00 46.02 44.10 2nts n GLY 109 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2nts n GLN 110 N -1.38 0.88 -1.04 1.61 6.02 -1.26 -4.75 117.38 117.46 2nts n GLN 110 Ca 0.03 -0.51 0.13 0.00 -0.01 0.00 0.00 57.00 56.65 2nts n GLN 110 Cb 0.12 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 29.85 2nts n GLN 110 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nts n GLY 111 N 1.33 -2.40 3.34 1.08 0.00 -1.26 -4.84 105.19 102.43 2nts n GLY 111 Ca 0.13 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 2nts n GLY 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2nts s THR 112 N -2.83 3.10 -0.44 2.61 -4.23 -0.83 -4.72 115.64 108.30 2nts s THR 112 Ca 0.00 -0.62 -0.25 0.00 -1.18 0.00 0.00 61.69 59.64 2nts s THR 112 Cb 0.00 -2.34 0.02 0.00 1.34 0.00 0.00 72.50 71.53 2nts s THR 112 CO 0.00 0.50 0.90 -0.60 -0.54 0.00 0.00 174.62 174.87 2nts s ARG 113 N 0.73 3.57 -0.17 3.99 6.06 0.71 -2.24 118.95 131.59 2nts s ARG 113 Ca -0.05 0.19 -0.04 0.00 -2.50 0.00 0.00 55.73 53.32 2nts s ARG 113 Cb -0.15 -3.91 -0.03 0.00 0.06 0.00 0.00 34.95 30.93 2nts s ARG 113 CO 0.02 -1.15 -0.02 -1.17 -2.50 0.00 0.00 175.30 170.47 2nts s LEU 114 N 3.62 3.30 -0.15 -0.88 2.96 -0.32 -0.79 118.68 126.42 2nts s LEU 114 Ca 0.36 -0.13 -0.00 0.00 -0.22 0.00 0.00 54.13 54.14 2nts s LEU 114 Cb -0.11 -1.81 0.03 0.00 0.50 0.00 0.00 46.19 44.80 2nts s LEU 114 CO 0.24 0.14 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.43 2nts s THR 115 N 0.52 1.30 -0.27 3.68 2.01 -0.76 -0.40 115.64 121.72 2nts s THR 115 Ca -0.02 -0.55 -0.12 0.00 0.31 0.00 0.00 61.69 61.30 2nts s THR 115 Cb -0.14 -1.31 -0.05 0.00 0.01 0.00 0.00 72.50 71.01 2nts s THR 115 CO 0.02 0.33 0.25 0.68 -0.69 0.00 0.00 174.62 175.21 2nts s VAL 116 N 1.58 5.27 0.20 3.82 -7.23 -1.26 -2.39 120.40 120.40 2nts s VAL 116 Ca 0.03 0.32 -0.07 0.00 -1.81 0.00 0.00 61.98 60.46 2nts s VAL 116 Cb -0.14 -3.58 -0.06 0.00 0.56 0.00 0.00 36.38 33.16 2nts s VAL 116 CO -0.09 0.24 0.47 0.68 -0.31 0.00 0.00 175.10 176.09 2nts s VAL 117 N 1.72 5.05 -0.61 1.32 -7.23 0.81 -4.77 120.40 116.69 2nts s VAL 117 Ca 0.10 0.19 0.25 0.00 -1.81 0.00 0.00 61.98 60.71 2nts s VAL 117 Cb -0.15 -3.64 0.30 0.00 0.56 0.00 0.00 36.38 33.45 2nts s VAL 117 CO 0.10 -0.07 1.73 1.05 -0.31 0.00 0.00 175.10 177.59 2nts h GLU 118 N 2.49 0.00 -1.99 4.82 4.11 -1.93 -3.34 114.58 118.75 2nts h GLU 118 Ca -0.47 0.00 0.01 0.00 0.07 0.00 0.00 59.36 58.98 2nts h GLU 118 Cb 1.17 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.21 2nts h GLU 118 CO 0.70 0.00 0.05 0.34 0.07 0.00 0.00 179.01 180.17 2nts s ASP 119 N -5.06 -0.91 0.29 3.06 3.68 -1.26 -4.93 116.67 111.54 2nts s ASP 119 Ca 0.09 1.49 0.24 0.00 2.13 0.00 0.00 52.55 56.50 2nts s ASP 119 Cb 0.10 1.39 1.03 0.00 -1.45 0.00 0.00 42.92 44.00 2nts s ASP 119 CO 0.61 -0.24 1.73 -0.07 0.13 0.00 0.00 175.17 177.33 2nts h LEU 120 N 6.70 0.00 -0.47 -1.34 4.07 -1.96 -2.50 115.31 119.81 2nts h LEU 120 Ca -0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2nts h LEU 120 Cb 1.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.96 2nts h LEU 120 CO 0.15 0.00 -0.12 2.29 -1.08 0.00 0.00 178.44 179.68 2nts n LYS 121 N -2.30 1.00 -0.16 1.13 2.85 -1.26 -3.19 118.16 116.22 2nts n LYS 121 Ca 0.02 -0.47 0.07 0.00 -1.05 0.00 0.00 58.31 56.88 2nts n LYS 121 Cb 0.22 -1.49 0.20 0.00 -0.65 0.00 0.00 35.03 33.31 2nts n LYS 121 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2nts n ASN 122 N -0.59 1.88 -4.60 -5.58 3.02 -0.94 -4.85 115.26 103.60 2nts n ASN 122 Ca 0.16 -1.94 -0.40 0.00 -0.03 0.00 0.00 54.58 52.37 2nts n ASN 122 Cb 0.30 -0.21 -0.08 0.00 -0.61 0.00 0.00 39.78 39.18 2nts n ASN 122 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2nts s VAL 123 N -1.57 5.06 0.04 2.41 1.01 -1.19 -4.73 120.40 121.43 2nts s VAL 123 Ca 0.26 0.72 0.04 0.00 0.00 0.00 0.00 61.98 63.00 2nts s VAL 123 Cb 0.14 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2nts s VAL 123 CO 0.18 0.02 -0.12 -0.36 0.00 0.00 0.00 175.10 174.82 2nts s PHE 124 N 2.31 1.09 0.62 5.22 0.08 -0.07 -4.68 117.98 122.54 2nts s PHE 124 Ca 0.20 -0.35 -0.05 0.00 0.12 0.00 0.00 56.93 56.84 2nts s PHE 124 Cb -0.16 -0.65 0.03 0.00 -0.57 0.00 0.00 43.02 41.68 2nts s PHE 124 CO 0.10 0.02 0.92 -1.25 -0.10 0.00 0.00 175.22 174.91 2nts s PRO 125 N -1.12 2.65 0.54 0.24 0.04 -1.26 -1.31 135.00 134.77 2nts s PRO 125 Ca -0.00 -0.17 -0.13 0.00 0.04 0.00 0.00 61.00 60.74 2nts s PRO 125 Cb -0.08 -2.27 -0.06 0.00 0.04 0.00 0.00 34.50 32.14 2nts s PRO 125 CO 0.01 -0.87 0.96 -1.25 0.04 0.00 0.00 177.00 175.90 2nts s PRO 126 N -5.04 3.77 -0.14 0.56 0.04 -1.26 -4.24 135.00 128.69 2nts s PRO 126 Ca 0.56 0.77 -0.06 0.00 0.04 0.00 0.00 61.00 62.31 2nts s PRO 126 Cb -0.11 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2nts s PRO 126 CO 0.44 -0.35 0.09 -2.00 0.04 0.00 0.00 177.00 175.22 2nts s GLU 127 N -4.50 3.55 -0.08 4.56 2.56 0.26 -4.89 118.70 120.16 2nts s GLU 127 Ca 0.56 -0.25 0.02 0.00 0.00 0.00 0.00 54.97 55.30 2nts s GLU 127 Cb -0.10 -3.13 0.01 0.00 2.00 0.00 0.00 34.13 32.91 2nts s GLU 127 CO 0.41 0.59 -0.14 0.08 -0.56 0.00 0.00 175.26 175.63 2nts s VAL 128 N -0.51 1.32 0.08 3.70 1.01 -1.26 -0.54 120.40 124.20 2nts s VAL 128 Ca 0.11 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.56 2nts s VAL 128 Cb -0.12 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 2nts s VAL 128 CO 0.02 0.40 -0.13 0.00 0.00 0.00 0.00 175.10 175.39 2nts s ALA 129 N 0.66 1.15 -0.07 5.51 0.00 -0.62 -4.51 121.76 123.88 2nts s ALA 129 Ca -0.14 -1.05 0.05 0.00 0.00 0.00 0.00 51.96 50.82 2nts s ALA 129 Cb -0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 2nts s ALA 129 CO 0.04 0.10 -0.25 0.08 0.00 0.00 0.00 175.76 175.74 2nts s VAL 130 N -1.61 2.07 -0.09 0.00 1.01 -1.26 -1.49 120.40 119.04 2nts s VAL 130 Ca 0.00 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 60.94 2nts s VAL 130 Cb -0.08 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2nts s VAL 130 CO 0.02 0.57 -0.09 -0.36 0.00 0.00 0.00 175.10 175.23 2nts s PHE 131 N -0.02 2.87 0.59 5.22 0.40 0.22 -4.95 117.98 122.30 2nts s PHE 131 Ca -0.08 -0.21 -0.18 0.00 -0.60 0.00 0.00 56.93 55.86 2nts s PHE 131 Cb -0.15 -1.76 -0.04 0.00 0.51 0.00 0.00 43.02 41.58 2nts s PHE 131 CO 0.05 0.12 1.12 -1.21 0.70 0.00 0.00 175.22 176.01 2nts s GLU 132 N -0.36 3.14 0.18 0.44 2.02 -1.26 -0.90 118.70 121.96 2nts s GLU 132 Ca 0.04 1.51 -0.14 0.00 0.02 0.00 0.00 54.97 56.41 2nts s GLU 132 Cb -0.12 -1.99 0.13 0.00 0.10 0.00 0.00 34.13 32.25 2nts s GLU 132 CO 0.02 -1.00 1.77 -1.35 0.02 0.00 0.00 175.26 174.73 2nts h PRO 133 N 0.73 0.42 -3.29 0.39 0.11 -1.94 -3.45 132.00 124.97 2nts h PRO 133 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2nts h PRO 133 Cb 1.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2nts h PRO 133 CO 0.56 0.28 -0.50 0.43 -0.21 0.00 0.00 178.00 178.56 2nts n SER 134 N -4.93 -4.75 -2.26 -2.05 7.64 -1.26 -4.81 113.62 101.20 2nts n SER 134 Ca 0.04 0.90 -0.23 0.00 1.01 0.00 0.00 58.87 60.59 2nts n SER 134 Cb 0.15 -3.42 -0.01 0.00 -1.01 0.00 0.00 64.21 59.92 2nts n SER 134 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2nts n GLU 135 N -0.32 0.00 0.00 1.43 0.00 -1.26 -3.92 120.64 116.57 2nts n GLU 135 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2nts n GLU 135 Cb 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 31.44 30.92 2nts n GLU 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2nts n ALA 136 N -0.34 0.00 -0.06 -1.84 0.00 -1.26 -4.82 120.51 112.19 2nts n ALA 136 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.38 2nts n ALA 136 Cb 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.59 2nts n ALA 136 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2nts n GLU 137 N -0.01 0.33 0.00 0.00 2.13 -1.25 -4.38 120.64 117.46 2nts n GLU 137 Ca 0.00 0.14 0.02 0.00 0.66 0.00 0.00 57.16 57.98 2nts n GLU 137 Cb 0.00 -1.07 0.12 0.00 0.27 0.00 0.00 31.44 30.76 2nts n GLU 137 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2nts n ILE 138 N -3.86 0.00 -3.14 6.31 5.41 -1.22 -2.18 119.36 120.68 2nts n ILE 138 Ca -0.23 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.33 2nts n ILE 138 Cb 0.57 -0.91 -0.03 0.00 -0.71 0.00 0.00 39.64 38.55 2nts n ILE 138 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2nts n SER 139 N -0.98 0.25 0.00 4.38 2.88 -1.26 -3.77 113.62 115.13 2nts n SER 139 Ca 0.03 -2.96 0.00 0.00 -1.33 0.00 0.00 58.87 54.61 2nts n SER 139 Cb 0.01 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 2nts n SER 139 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2nts n HIS 140 N 0.72 0.00 -0.04 0.66 -0.00 -1.03 -4.65 115.22 110.88 2nts n HIS 140 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.94 2nts n HIS 140 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.61 2nts n HIS 140 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 2nts n THR 141 N -0.00 0.00 -0.80 3.57 -2.24 -0.93 -5.02 114.28 108.86 2nts n THR 141 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2nts n THR 141 Cb 0.00 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 2nts n THR 141 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nts n GLN 142 N 0.00 -0.63 -3.24 -0.78 1.13 -1.09 -4.97 117.38 107.79 2nts n GLN 142 Ca 0.00 0.16 -0.31 0.00 -1.94 0.00 0.00 57.00 54.91 2nts n GLN 142 Cb 0.00 -4.15 -0.05 0.00 0.11 0.00 0.00 30.24 26.15 2nts n GLN 142 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2nts s LYS 143 N -1.03 3.80 -0.06 -1.09 -0.14 -1.26 -0.27 119.74 119.69 2nts s LYS 143 Ca 0.00 0.33 0.02 0.00 -1.36 0.00 0.00 55.97 54.96 2nts s LYS 143 Cb 0.00 -2.56 0.02 0.00 -1.68 0.00 0.00 37.83 33.61 2nts s LYS 143 CO 0.00 0.20 -0.09 0.00 -0.76 0.00 0.00 175.35 174.70 2nts s ALA 144 N -2.00 1.07 -0.28 5.17 0.00 -1.26 -3.37 121.76 121.08 2nts s ALA 144 Ca 0.49 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 52.10 2nts s ALA 144 Cb -0.11 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.48 2nts s ALA 144 CO 0.24 0.02 0.02 0.99 0.00 0.00 0.00 175.76 177.02 2nts s THR 145 N 0.86 3.45 0.43 0.00 2.01 -1.26 -0.89 115.64 120.25 2nts s THR 145 Ca -0.11 -0.89 -0.20 0.00 0.31 0.00 0.00 61.69 60.79 2nts s THR 145 Cb -0.15 -2.79 -0.11 0.00 0.01 0.00 0.00 72.50 69.46 2nts s THR 145 CO 0.01 0.10 0.94 -0.76 -0.69 0.00 0.00 174.62 174.23 2nts s LEU 146 N 1.41 3.92 -0.06 4.42 1.02 0.40 -3.55 118.68 126.23 2nts s LEU 146 Ca 0.01 1.66 0.05 0.00 0.02 0.00 0.00 54.13 55.87 2nts s LEU 146 Cb -0.17 -4.52 -0.01 0.00 0.02 0.00 0.00 46.19 41.51 2nts s LEU 146 CO -0.01 -0.37 -0.23 -0.69 0.02 0.00 0.00 176.35 175.07 2nts s VAL 147 N -2.21 1.89 -0.12 -1.59 1.01 -0.08 -1.25 120.40 118.05 2nts s VAL 147 Ca 0.61 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.64 2nts s VAL 147 Cb -0.09 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 2nts s VAL 147 CO 0.15 0.53 -0.18 0.00 0.00 0.00 0.00 175.10 175.60 2nts s LEU 149 N 0.39 1.67 -0.22 0.00 2.96 -0.55 -0.54 118.68 122.38 2nts s LEU 149 Ca -0.14 -0.43 -0.04 0.00 -0.22 0.00 0.00 54.13 53.30 2nts s LEU 149 Cb -0.17 -1.09 -0.01 0.00 0.50 0.00 0.00 46.19 45.42 2nts s LEU 149 CO 0.06 -0.01 -0.02 0.00 -1.32 0.00 0.00 176.35 175.05 2nts s ALA 150 N 1.17 2.88 0.29 5.97 0.00 0.18 -1.58 121.76 130.66 2nts s ALA 150 Ca -0.03 -1.13 0.06 0.00 0.00 0.00 0.00 51.96 50.86 2nts s ALA 150 Cb -0.14 -1.75 -0.06 0.00 0.00 0.00 0.00 23.12 21.17 2nts s ALA 150 CO -0.04 -0.38 -0.05 0.95 0.00 0.00 0.00 175.76 176.23 2nts s THR 151 N 1.41 1.62 -1.85 0.00 -4.23 0.30 -0.58 115.64 112.31 2nts s THR 151 Ca 0.05 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 2nts s THR 151 Cb -0.14 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.21 2nts s THR 151 CO -0.01 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.40 2nts n GLY 152 N -0.60 0.01 3.87 3.99 0.00 -0.72 -0.57 105.19 111.17 2nts n GLY 152 Ca -0.05 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 2nts n GLY 152 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nts s PHE 153 N -2.97 3.31 -0.29 1.61 -0.71 -1.16 -4.51 117.98 113.26 2nts s PHE 153 Ca 0.00 0.04 -0.17 0.00 -1.04 0.00 0.00 56.93 55.76 2nts s PHE 153 Cb 0.00 -1.58 0.13 0.00 -1.21 0.00 0.00 43.02 40.36 2nts s PHE 153 CO 0.00 0.52 0.92 -0.47 -1.34 0.00 0.00 175.22 174.84 2nts s TYR 154 N -1.76 -0.67 0.54 3.49 5.04 -0.43 -0.60 117.35 122.95 2nts s TYR 154 Ca 0.33 1.37 -0.09 0.00 -2.44 0.00 0.00 57.07 56.23 2nts s TYR 154 Cb -0.10 0.41 0.13 0.00 0.35 0.00 0.00 41.96 42.74 2nts s TYR 154 CO 0.26 -0.33 0.69 -0.35 -1.34 0.00 0.00 175.55 174.48 2nts n PRO 155 N 3.70 -0.92 -0.97 4.97 -0.04 -1.26 -0.89 135.00 139.59 2nts n PRO 155 Ca -0.18 -1.08 -0.12 0.00 -0.04 0.00 0.00 63.50 62.08 2nts n PRO 155 Cb 0.58 -0.76 -0.16 0.00 -0.04 0.00 0.00 33.50 33.12 2nts n PRO 155 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2nts n ASP 156 N -3.54 5.11 -4.08 3.54 2.03 -1.26 -4.70 116.55 113.65 2nts n ASP 156 Ca 0.09 -2.45 -0.39 0.00 0.52 0.00 0.00 54.79 52.56 2nts n ASP 156 Cb 0.31 -1.38 -0.03 0.00 -0.72 0.00 0.00 41.12 39.30 2nts n ASP 156 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2nts n HIS 157 N 2.53 4.05 -4.12 -0.67 8.25 -1.26 -5.03 115.22 118.98 2nts n HIS 157 Ca 0.42 -3.77 -0.11 0.00 -0.26 0.00 0.00 57.72 54.00 2nts n HIS 157 Cb 0.88 -1.25 -0.10 0.00 1.12 0.00 0.00 29.99 30.64 2nts n HIS 157 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2nts s VAL 158 N -1.76 0.57 -0.19 1.59 -7.23 -1.26 -1.80 120.40 110.32 2nts s VAL 158 Ca 0.30 -1.62 -0.03 0.00 -1.81 0.00 0.00 61.98 58.82 2nts s VAL 158 Cb -0.03 -1.28 0.06 0.00 0.56 0.00 0.00 36.38 35.69 2nts s VAL 158 CO -0.06 -0.72 0.04 -1.61 -0.31 0.00 0.00 175.10 172.44 2nts s GLU 159 N -3.07 0.58 -0.12 4.82 2.02 -0.32 -4.97 118.70 117.66 2nts s GLU 159 Ca 0.04 -0.36 -0.13 0.00 0.02 0.00 0.00 54.97 54.53 2nts s GLU 159 Cb 0.00 -2.03 -0.05 0.00 0.10 0.00 0.00 34.13 32.15 2nts s GLU 159 CO -0.04 -0.63 0.30 -1.17 0.02 0.00 0.00 175.26 173.74 2nts s LEU 160 N 1.90 4.32 0.02 1.80 0.20 -1.26 -1.36 118.68 124.31 2nts s LEU 160 Ca -0.00 0.61 -0.08 0.00 0.69 0.00 0.00 54.13 55.35 2nts s LEU 160 Cb -0.17 -2.38 0.00 0.00 -0.43 0.00 0.00 46.19 43.21 2nts s LEU 160 CO -0.08 0.20 0.16 -0.94 -0.29 0.00 0.00 176.35 175.40 2nts s SER 161 N -0.14 0.05 -0.09 3.68 1.04 0.16 -5.00 113.70 113.41 2nts s SER 161 Ca 0.18 -0.33 -0.00 0.00 0.48 0.00 0.00 55.95 56.28 2nts s SER 161 Cb -0.14 0.24 -0.03 0.00 0.10 0.00 0.00 66.02 66.20 2nts s SER 161 CO 0.06 -0.47 -0.06 0.26 0.98 0.00 0.00 173.24 174.01 2nts s TRP 162 N -2.08 2.96 -0.10 5.02 0.52 -1.26 -0.09 118.94 123.91 2nts s TRP 162 Ca -0.09 -0.08 0.03 0.00 0.02 0.00 0.00 56.10 55.98 2nts s TRP 162 Cb -0.04 -1.78 0.01 0.00 -1.15 0.00 0.00 33.47 30.51 2nts s TRP 162 CO -0.02 0.23 -0.18 -1.58 0.02 0.00 0.00 176.95 175.42 2nts s TRP 163 N -0.49 2.13 -0.20 -1.98 0.52 0.65 -1.34 118.94 118.23 2nts s TRP 163 Ca 0.07 -0.91 0.02 0.00 0.02 0.00 0.00 56.10 55.30 2nts s TRP 163 Cb -0.12 -1.48 0.03 0.00 -1.15 0.00 0.00 33.47 30.76 2nts s TRP 163 CO 0.02 -0.41 -0.17 0.08 0.02 0.00 0.00 176.95 176.49 2nts s VAL 164 N 0.64 2.04 -1.38 4.03 1.01 0.13 -0.84 120.40 126.02 2nts s VAL 164 Ca -0.14 -1.12 -0.04 0.00 0.00 0.00 0.00 61.98 60.68 2nts s VAL 164 Cb -0.16 -1.95 0.03 0.00 0.00 0.00 0.00 36.38 34.30 2nts s VAL 164 CO 0.04 0.35 0.80 0.59 0.00 0.00 0.00 175.10 176.88 2nts n ASN 165 N 4.58 -2.38 0.00 3.32 3.02 -0.38 -1.76 115.26 121.66 2nts n ASN 165 Ca -0.18 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 2nts n ASN 165 Cb 0.48 -4.03 0.00 0.00 -0.61 0.00 0.00 39.78 35.62 2nts n ASN 165 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2nts n GLY 166 N -1.62 0.89 3.46 7.41 0.00 -1.26 -5.02 105.19 109.04 2nts n GLY 166 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 2nts n GLY 166 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nts s LYS 167 N -0.10 2.41 0.11 1.61 1.02 -0.72 -5.10 119.74 118.97 2nts s LYS 167 Ca 0.00 -0.76 -0.30 0.00 0.02 0.00 0.00 55.97 54.93 2nts s LYS 167 Cb 0.00 -2.32 -0.06 0.00 -0.52 0.00 0.00 37.83 34.93 2nts s LYS 167 CO 0.00 0.61 1.01 -2.00 -0.92 0.00 0.00 175.35 174.05 2nts s GLU 168 N -0.82 4.64 0.13 1.68 2.12 -1.26 0.19 118.70 125.39 2nts s GLU 168 Ca 0.12 1.53 0.06 0.00 0.36 0.00 0.00 54.97 57.04 2nts s GLU 168 Cb -0.11 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 2nts s GLU 168 CO 0.01 0.12 0.02 0.14 -0.54 0.00 0.00 175.26 175.02 2nts s VAL 169 N 0.12 3.99 0.00 3.70 -7.23 -0.45 -4.91 120.40 115.63 2nts s VAL 169 Ca 0.49 -1.17 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 2nts s VAL 169 Cb -0.25 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.73 2nts s VAL 169 CO 0.31 -0.01 0.00 1.41 -0.31 0.00 0.00 175.10 176.50 2nts n HIS 170 N 0.15 0.00 -2.23 2.82 -0.00 -1.26 -4.50 115.22 110.20 2nts n HIS 170 Ca -0.10 0.00 -0.39 0.00 -0.00 0.00 0.00 57.72 57.23 2nts n HIS 170 Cb 0.54 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.51 2nts n HIS 170 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 2nts s SER 171 N -3.83 6.57 -0.05 0.41 0.01 -1.26 -3.00 113.70 112.55 2nts s SER 171 Ca 0.00 2.45 0.00 0.00 1.31 0.00 0.00 55.95 59.71 2nts s SER 171 Cb 0.00 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.61 2nts s SER 171 CO 0.00 -0.65 0.00 0.61 0.41 0.00 0.00 173.24 173.61 2nts n GLY 172 N 0.71 0.39 3.53 3.44 0.00 -1.26 -4.87 105.19 107.13 2nts n GLY 172 Ca 0.03 -0.06 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 2nts n GLY 172 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nts s VAL 173 N -1.74 4.39 -0.15 1.61 1.01 -1.16 -0.05 120.40 124.30 2nts s VAL 173 Ca 0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 61.98 61.81 2nts s VAL 173 Cb 0.00 -3.00 0.03 0.00 0.00 0.00 0.00 36.38 33.42 2nts s VAL 173 CO 0.00 0.42 -0.07 -0.55 0.00 0.00 0.00 175.10 174.90 2nts s SER 174 N 0.86 2.70 -0.08 3.32 0.15 0.42 -4.99 113.70 116.09 2nts s SER 174 Ca 0.03 -0.57 0.02 0.00 0.70 0.00 0.00 55.95 56.12 2nts s SER 174 Cb -0.14 -0.96 -0.02 0.00 -1.71 0.00 0.00 66.02 63.19 2nts s SER 174 CO 0.02 -0.15 -0.13 -0.89 1.20 0.00 0.00 173.24 173.30 2nts s THR 175 N 1.61 3.15 0.02 6.45 2.01 -1.26 0.71 115.64 128.33 2nts s THR 175 Ca 0.02 -0.67 -0.39 0.00 0.31 0.00 0.00 61.69 60.97 2nts s THR 175 Cb -0.14 -2.27 -0.18 0.00 0.01 0.00 0.00 72.50 69.91 2nts s THR 175 CO -0.08 0.57 1.21 0.47 -0.69 0.00 0.00 174.62 176.10 2nts n ASP 176 N 2.73 0.79 0.20 3.53 8.00 -0.43 -4.80 116.55 126.57 2nts n ASP 176 Ca -0.18 1.14 0.14 0.00 0.71 0.00 0.00 54.79 56.61 2nts n ASP 176 Cb 0.52 -1.04 0.54 0.00 -0.02 0.00 0.00 41.12 41.12 2nts n ASP 176 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2nts h PRO 177 N 3.80 0.00 -2.85 -0.24 0.13 -1.97 -3.44 132.00 127.44 2nts h PRO 177 Ca -0.49 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.49 2nts h PRO 177 Cb 1.39 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.25 2nts h PRO 177 CO 0.72 0.00 -0.34 -1.14 -0.23 0.00 0.00 178.00 177.00 2nts s GLN 178 N -3.44 0.36 0.56 0.86 0.74 -1.26 -5.15 119.66 112.32 2nts s GLN 178 Ca 0.04 0.59 -0.18 0.00 0.05 0.00 0.00 55.36 55.86 2nts s GLN 178 Cb 0.09 0.06 -0.05 0.00 1.10 0.00 0.00 33.01 34.21 2nts s GLN 178 CO 0.51 -0.11 1.08 -1.25 -0.55 0.00 0.00 175.29 174.97 2nts s PRO 179 N 0.79 3.41 -0.31 1.67 0.04 -1.26 -4.96 135.00 134.38 2nts s PRO 179 Ca -0.05 1.37 -0.18 0.00 0.04 0.00 0.00 61.00 62.18 2nts s PRO 179 Cb -0.06 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 2nts s PRO 179 CO -0.06 -0.76 0.53 -0.51 0.04 0.00 0.00 177.00 176.24 2nts s LEU 180 N -4.07 4.20 -0.33 -3.56 1.43 0.55 -4.88 118.68 112.02 2nts s LEU 180 Ca 0.67 0.24 -0.29 0.00 -1.03 0.00 0.00 54.13 53.72 2nts s LEU 180 Cb -0.19 -2.64 0.02 0.00 0.03 0.00 0.00 46.19 43.41 2nts s LEU 180 CO 0.30 -0.41 1.08 -0.75 0.23 0.00 0.00 176.35 176.80 2nts s LYS 181 N 2.40 4.03 0.21 1.70 2.20 -1.26 -2.19 119.74 126.83 2nts s LYS 181 Ca 0.20 1.02 -0.11 0.00 -0.36 0.00 0.00 55.97 56.73 2nts s LYS 181 Cb -0.15 -3.75 0.16 0.00 -1.51 0.00 0.00 37.83 32.57 2nts s LYS 181 CO 0.12 -0.94 1.87 0.93 -0.36 0.00 0.00 175.35 176.97 2nts h GLU 182 N 8.19 0.93 -3.04 4.03 5.08 -1.75 -3.36 114.58 124.66 2nts h GLU 182 Ca -0.21 -0.06 -0.62 0.00 -1.00 0.00 0.00 59.36 57.48 2nts h GLU 182 Cb 1.06 -0.21 -0.40 0.00 0.50 0.00 0.00 28.75 29.70 2nts h GLU 182 CO 1.04 0.61 -0.72 -0.65 -1.00 0.00 0.00 179.01 178.30 2nts s GLN 183 N -6.13 1.47 0.47 2.33 -0.21 -1.26 -4.99 119.66 111.33 2nts s GLN 183 Ca -0.13 -2.20 0.30 0.00 0.02 0.00 0.00 55.36 53.34 2nts s GLN 183 Cb 0.15 -2.54 1.38 0.00 1.00 0.00 0.00 33.01 33.00 2nts s GLN 183 CO 0.77 -1.17 1.74 -1.35 -2.12 0.00 0.00 175.29 173.17 2nts h PRO 184 N 6.56 0.15 0.00 2.91 0.11 -1.98 -0.90 132.00 138.85 2nts h PRO 184 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2nts h PRO 184 Cb 0.91 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2nts h PRO 184 CO 0.53 0.10 -0.02 0.00 -0.21 0.00 0.00 178.00 178.40 2nts n ALA 185 N -2.63 2.33 -2.80 -0.75 0.00 -1.26 -4.83 120.51 110.58 2nts n ALA 185 Ca 0.29 -0.06 -0.36 0.00 0.00 0.00 0.00 53.44 53.31 2nts n ALA 185 Cb 1.20 -1.46 -0.08 0.00 0.00 0.00 0.00 19.45 19.11 2nts n ALA 185 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2nts s LEU 186 N -3.92 4.01 0.20 0.00 1.43 -0.34 -5.00 118.68 115.05 2nts s LEU 186 Ca 0.12 0.26 -0.06 0.00 -1.03 0.00 0.00 54.13 53.42 2nts s LEU 186 Cb 0.15 -1.97 0.13 0.00 0.03 0.00 0.00 46.19 44.52 2nts s LEU 186 CO 0.58 0.32 1.60 -1.13 0.23 0.00 0.00 176.35 177.95 2nts h ASN 187 N 5.59 0.87 -0.66 2.29 -0.73 -1.88 -3.08 115.58 117.98 2nts h ASN 187 Ca -0.48 -0.32 -0.30 0.00 1.87 0.00 0.00 56.30 57.07 2nts h ASN 187 Cb 1.20 -0.24 -0.18 0.00 0.27 0.00 0.00 38.32 39.37 2nts h ASN 187 CO 0.62 1.05 0.38 0.47 -0.37 0.00 0.00 177.43 179.58 2nts n ASP 188 N -4.11 3.71 -4.77 1.15 9.92 -1.26 -4.96 116.55 116.23 2nts n ASP 188 Ca 0.00 -3.06 -0.39 0.00 -0.53 0.00 0.00 54.79 50.81 2nts n ASP 188 Cb 0.44 -0.72 0.00 0.00 -0.64 0.00 0.00 41.12 40.20 2nts n ASP 188 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 2nts s SER 189 N -0.63 6.13 0.89 -2.24 0.15 -1.17 -5.00 113.70 111.83 2nts s SER 189 Ca 0.40 2.72 -0.14 0.00 0.70 0.00 0.00 55.95 59.64 2nts s SER 189 Cb 0.33 -2.64 0.14 0.00 -1.71 0.00 0.00 66.02 62.14 2nts s SER 189 CO 0.09 -0.98 1.23 -0.13 1.20 0.00 0.00 173.24 174.65 2nts s ARG 190 N -2.35 1.31 0.22 5.44 0.52 -1.26 -4.84 118.95 117.99 2nts s ARG 190 Ca 0.59 -0.09 0.02 0.00 -0.52 0.00 0.00 55.73 55.74 2nts s ARG 190 Cb -0.39 -1.89 -0.05 0.00 0.52 0.00 0.00 34.95 33.13 2nts s ARG 190 CO 0.50 -2.01 0.02 0.71 0.02 0.00 0.00 175.30 174.54 2nts s TYR 191 N -3.67 1.47 0.02 -0.53 2.02 0.23 -2.08 117.35 114.80 2nts s TYR 191 Ca 0.67 -1.02 0.03 0.00 -0.37 0.00 0.00 57.07 56.39 2nts s TYR 191 Cb -0.08 -0.85 -0.02 0.00 -0.40 0.00 0.00 41.96 40.61 2nts s TYR 191 CO 0.51 -0.16 -0.10 -1.12 -1.57 0.00 0.00 175.55 173.11 2nts s SER 192 N -3.27 1.11 -0.18 2.29 0.01 -0.93 -1.76 113.70 110.97 2nts s SER 192 Ca 0.30 -0.35 -0.10 0.00 1.31 0.00 0.00 55.95 57.10 2nts s SER 192 Cb 0.06 -0.06 0.06 0.00 0.21 0.00 0.00 66.02 66.29 2nts s SER 192 CO 0.09 -0.01 0.43 -0.22 0.41 0.00 0.00 173.24 173.94 2nts s LEU 193 N -0.87 -0.09 0.30 2.44 2.96 0.26 -0.33 118.68 123.35 2nts s LEU 193 Ca -0.01 0.93 0.10 0.00 -0.22 0.00 0.00 54.13 54.92 2nts s LEU 193 Cb -0.06 1.43 -0.06 0.00 0.50 0.00 0.00 46.19 48.00 2nts s LEU 193 CO 0.00 -0.19 -0.13 -0.94 -1.32 0.00 0.00 176.35 173.77 2nts s SER 194 N 1.26 3.42 0.00 3.68 1.04 -1.26 0.47 113.70 122.32 2nts s SER 194 Ca -0.08 -1.12 -0.13 0.00 0.48 0.00 0.00 55.95 55.10 2nts s SER 194 Cb -0.07 -0.28 0.02 0.00 0.10 0.00 0.00 66.02 65.78 2nts s SER 194 CO -0.11 -0.13 0.27 -0.55 0.98 0.00 0.00 173.24 173.69 2nts s SER 195 N -3.52 -0.12 -0.04 7.02 0.15 0.29 -1.31 113.70 116.17 2nts s SER 195 Ca 0.30 -0.04 0.05 0.00 0.70 0.00 0.00 55.95 56.96 2nts s SER 195 Cb -0.00 0.30 -0.01 0.00 -1.71 0.00 0.00 66.02 64.59 2nts s SER 195 CO 0.14 -0.47 -0.20 -0.13 1.20 0.00 0.00 173.24 173.79 2nts s ARG 196 N -1.61 2.00 -0.28 5.44 0.52 0.22 -0.76 118.95 124.49 2nts s ARG 196 Ca -0.12 -0.71 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 2nts s ARG 196 Cb -0.05 -1.74 0.05 0.00 0.52 0.00 0.00 34.95 33.74 2nts s ARG 196 CO 0.02 0.30 -0.06 -1.17 0.02 0.00 0.00 175.30 174.42 2nts s LEU 197 N -0.07 3.60 -0.41 2.53 2.96 -0.38 -0.43 118.68 126.47 2nts s LEU 197 Ca -0.03 -1.27 -0.15 0.00 -0.22 0.00 0.00 54.13 52.46 2nts s LEU 197 Cb -0.12 -1.64 0.02 0.00 0.50 0.00 0.00 46.19 44.96 2nts s LEU 197 CO 0.02 -0.21 0.32 -0.60 -1.32 0.00 0.00 176.35 174.56 2nts s ARG 198 N 1.20 2.98 0.00 1.98 3.52 0.93 -0.46 118.95 129.10 2nts s ARG 198 Ca -0.06 -1.00 0.00 0.00 -0.13 0.00 0.00 55.73 54.54 2nts s ARG 198 Cb -0.19 -3.98 0.00 0.00 -1.56 0.00 0.00 34.95 29.21 2nts s ARG 198 CO -0.03 -0.77 0.00 1.33 -0.81 0.00 0.00 175.30 175.01 2nts n VAL 199 N 5.19 0.00 -3.52 7.11 0.24 -0.06 -4.60 118.33 122.69 2nts n VAL 199 Ca -0.11 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.06 2nts n VAL 199 Cb 0.47 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.79 2nts n VAL 199 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2nts s SER 200 N -0.40 -0.53 0.02 -1.34 1.04 -1.26 -4.26 113.70 106.97 2nts s SER 200 Ca 0.00 0.43 -0.30 0.00 0.48 0.00 0.00 55.95 56.56 2nts s SER 200 Cb 0.00 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 2nts s SER 200 CO 0.00 -0.58 1.11 0.00 0.98 0.00 0.00 173.24 174.75 2nts s ALA 201 N -1.78 3.32 0.00 5.32 0.00 0.62 -1.03 121.76 128.21 2nts s ALA 201 Ca -0.05 0.69 0.00 0.00 0.00 0.00 0.00 51.96 52.60 2nts s ALA 201 Cb -0.00 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2nts s ALA 201 CO 0.02 -0.40 0.00 2.41 0.00 0.00 0.00 175.76 177.79 2nts n THR 202 N 4.02 0.00 -0.02 0.00 -1.04 -1.26 -4.78 114.28 111.20 2nts n THR 202 Ca 0.08 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.98 2nts n THR 202 Cb 0.48 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.94 2nts n THR 202 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 2nts h PHE 203 N 0.00 0.17 -0.40 -1.42 3.57 -1.86 0.71 116.94 117.71 2nts h PHE 203 Ca 0.00 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.37 2nts h PHE 203 Cb 0.00 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 2nts h PHE 203 CO 0.00 0.12 -0.30 2.35 -2.23 0.00 0.00 178.31 178.25 2nts h TRP 204 N 0.17 1.02 0.00 0.41 2.91 -1.39 -2.56 115.95 116.50 2nts h TRP 204 Ca 0.05 -0.27 0.00 0.00 1.13 0.00 0.00 58.89 59.80 2nts h TRP 204 Cb -0.01 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 28.42 2nts h TRP 204 CO -0.07 1.06 0.00 1.04 -1.03 0.00 0.00 178.44 179.44 2nts n GLN 205 N -4.08 0.20 -2.43 2.65 6.02 -0.88 -0.96 117.38 117.90 2nts n GLN 205 Ca -0.01 0.43 -0.42 0.00 -0.01 0.00 0.00 57.00 56.99 2nts n GLN 205 Cb 0.49 -1.88 -0.02 0.00 1.02 0.00 0.00 30.24 29.84 2nts n GLN 205 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2nts s ASN 206 N -4.26 6.31 0.05 1.08 3.84 0.24 -3.86 114.94 118.33 2nts s ASN 206 Ca 0.04 0.48 0.03 0.00 0.21 0.00 0.00 52.86 53.62 2nts s ASN 206 Cb 0.09 -2.55 0.18 0.00 -0.55 0.00 0.00 41.25 38.43 2nts s ASN 206 CO 0.39 -1.53 1.10 -2.65 -2.79 0.00 0.00 177.10 171.63 2nts n PRO 207 N 8.32 0.02 0.17 0.43 -0.02 -1.25 -1.52 135.00 141.16 2nts n PRO 207 Ca 0.13 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 2nts n PRO 207 Cb 0.49 -1.57 0.11 0.00 -0.02 0.00 0.00 33.50 32.50 2nts n PRO 207 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2nts h ARG 208 N 0.00 0.00 -6.39 -0.52 2.47 -1.89 -3.40 114.38 104.65 2nts h ARG 208 Ca 0.00 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.19 2nts h ARG 208 Cb 0.00 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.29 2nts h ARG 208 CO 0.00 0.00 0.25 -0.80 0.56 0.00 0.00 179.97 179.98 2nts s ASN 209 N -5.86 7.32 -0.18 7.04 0.01 -0.57 -4.97 114.94 117.73 2nts s ASN 209 Ca 0.04 1.58 -0.02 0.00 -0.71 0.00 0.00 52.86 53.75 2nts s ASN 209 Cb 0.07 -2.52 -0.01 0.00 0.41 0.00 0.00 41.25 39.20 2nts s ASN 209 CO 0.72 -0.04 -0.08 -2.28 -1.51 0.00 0.00 177.10 173.91 2nts s HIS 210 N 0.10 2.91 -0.05 2.20 5.65 -1.26 -1.54 115.29 123.31 2nts s HIS 210 Ca 0.43 -0.77 0.03 0.00 0.25 0.00 0.00 55.06 55.00 2nts s HIS 210 Cb -0.21 -1.99 -0.03 0.00 -1.18 0.00 0.00 32.58 29.17 2nts s HIS 210 CO 0.26 -0.37 -0.12 -0.06 -0.65 0.00 0.00 174.74 173.80 2nts s PHE 211 N 0.93 2.76 -0.11 3.88 0.40 -0.61 -1.25 117.98 123.98 2nts s PHE 211 Ca -0.01 -0.11 -0.06 0.00 -0.60 0.00 0.00 56.93 56.14 2nts s PHE 211 Cb -0.15 -1.64 0.04 0.00 0.51 0.00 0.00 43.02 41.79 2nts s PHE 211 CO 0.00 0.24 0.27 0.50 0.70 0.00 0.00 175.22 176.93 2nts s ARG 212 N -0.84 0.24 -0.24 0.44 3.52 -0.02 -1.64 118.95 120.42 2nts s ARG 212 Ca 0.12 0.54 -0.10 0.00 -0.13 0.00 0.00 55.73 56.16 2nts s ARG 212 Cb -0.11 -0.07 -0.05 0.00 -1.56 0.00 0.00 34.95 33.16 2nts s ARG 212 CO 0.01 -0.14 0.15 0.00 -0.81 0.00 0.00 175.30 174.51 2nts s GLN 214 N 1.06 3.17 -0.27 0.00 0.74 0.87 -2.04 119.66 123.19 2nts s GLN 214 Ca 0.07 -0.80 0.02 0.00 0.05 0.00 0.00 55.36 54.71 2nts s GLN 214 Cb -0.14 -2.48 0.07 0.00 1.10 0.00 0.00 33.01 31.57 2nts s GLN 214 CO 0.04 0.12 -0.06 0.08 -0.55 0.00 0.00 175.29 174.93 2nts s VAL 215 N 0.53 1.96 -0.12 1.34 1.01 -0.24 -0.66 120.40 124.21 2nts s VAL 215 Ca -0.12 -1.64 -0.27 0.00 0.00 0.00 0.00 61.98 59.95 2nts s VAL 215 Cb -0.16 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 2nts s VAL 215 CO 0.04 -0.18 0.88 -1.58 0.00 0.00 0.00 175.10 174.27 2nts s GLN 216 N 1.16 4.37 0.06 2.72 2.00 -0.46 -1.44 119.66 128.07 2nts s GLN 216 Ca -0.04 1.15 0.05 0.00 -2.00 0.00 0.00 55.36 54.52 2nts s GLN 216 Cb -0.19 -3.54 -0.04 0.00 0.80 0.00 0.00 33.01 30.04 2nts s GLN 216 CO -0.07 -0.25 -0.06 0.12 -0.50 0.00 0.00 175.29 174.53 2nts s PHE 217 N 1.85 2.87 -0.29 1.67 5.36 0.30 -1.17 117.98 128.56 2nts s PHE 217 Ca 0.42 -0.07 0.03 0.00 -0.96 0.00 0.00 56.93 56.35 2nts s PHE 217 Cb -0.18 -1.54 0.08 0.00 -0.34 0.00 0.00 43.02 41.05 2nts s PHE 217 CO 0.16 0.42 -0.01 0.71 -1.46 0.00 0.00 175.22 175.04 2nts s TYR 218 N -1.15 3.14 0.00 10.12 1.51 -0.75 -1.42 117.35 128.80 2nts s TYR 218 Ca 0.21 -2.44 0.00 0.00 -1.01 0.00 0.00 57.07 53.83 2nts s TYR 218 Cb -0.11 -2.26 0.00 0.00 -0.11 0.00 0.00 41.96 39.48 2nts s TYR 218 CO 0.12 -0.89 0.00 0.41 -1.11 0.00 0.00 175.55 174.08 2nts n GLY 219 N 4.45 1.55 3.88 0.71 0.00 -1.26 -4.74 105.19 109.77 2nts n GLY 219 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 2nts n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nts s LEU 220 N 0.00 4.27 0.00 0.99 1.43 0.36 -4.70 118.68 121.03 2nts s LEU 220 Ca 0.00 0.77 0.00 0.00 -1.03 0.00 0.00 54.13 53.87 2nts s LEU 220 Cb 0.00 -3.31 0.00 0.00 0.03 0.00 0.00 46.19 42.91 2nts s LEU 220 CO 0.00 0.06 0.00 -1.54 0.23 0.00 0.00 176.35 175.10 2nts n SER 221 N 0.33 0.00 -0.05 2.29 3.41 -1.26 -3.24 113.62 115.11 2nts n SER 221 Ca -0.04 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.49 2nts n SER 221 Cb 0.52 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.43 2nts n SER 221 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2nts n GLU 222 N 0.00 0.21 -3.36 4.33 4.07 -1.26 -4.90 120.64 119.73 2nts n GLU 222 Ca 0.00 0.07 -0.26 0.00 -0.06 0.00 0.00 57.16 56.91 2nts n GLU 222 Cb 0.00 -0.98 -0.08 0.00 -0.06 0.00 0.00 31.44 30.32 2nts n GLU 222 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2nts n ASN 223 N -3.12 2.93 -0.01 4.31 4.13 -1.26 -4.30 115.26 117.95 2nts n ASN 223 Ca -0.17 -3.27 0.01 0.00 1.68 0.00 0.00 54.58 52.83 2nts n ASN 223 Cb 0.64 -0.66 -0.03 0.00 -1.54 0.00 0.00 39.78 38.19 2nts n ASN 223 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2nts n ASP 224 N 0.95 4.12 -1.28 6.41 9.92 -1.26 -5.11 116.55 130.31 2nts n ASP 224 Ca 0.28 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.54 2nts n ASP 224 Cb 0.44 1.03 0.00 0.00 -0.64 0.00 0.00 41.12 41.95 2nts n ASP 224 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2nts n GLU 225 N -1.76 -3.45 -3.87 -1.24 -0.58 -1.26 -5.01 120.64 103.47 2nts n GLU 225 Ca -0.02 2.64 -0.28 0.00 -0.42 0.00 0.00 57.16 59.09 2nts n GLU 225 Cb 0.23 -3.20 -0.17 0.00 -0.57 0.00 0.00 31.44 27.74 2nts n GLU 225 CO 0.00 0.00 0.00 -0.46 -0.48 0.00 0.00 177.13 176.19 2nts s TRP 226 N -4.53 1.55 -0.43 -0.32 -0.11 -1.26 -5.02 118.94 108.83 2nts s TRP 226 Ca 0.00 -0.96 0.04 0.00 1.22 0.00 0.00 56.10 56.41 2nts s TRP 226 Cb 0.00 -1.25 0.45 0.00 -1.50 0.00 0.00 33.47 31.17 2nts s TRP 226 CO 0.00 -0.58 1.42 0.25 -4.62 0.00 0.00 176.95 173.42 2nts n THR 227 N 4.92 2.82 -4.34 5.86 -2.24 -1.26 -4.97 114.28 115.07 2nts n THR 227 Ca -0.11 -4.03 -0.20 0.00 -2.27 0.00 0.00 64.05 57.44 2nts n THR 227 Cb 0.48 -1.17 -0.08 0.00 -2.10 0.00 0.00 70.33 67.46 2nts n THR 227 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2nts s GLN 228 N -3.67 1.72 -0.29 -0.78 -1.52 -1.26 -5.13 119.66 108.72 2nts s GLN 228 Ca 0.54 -2.00 -0.01 0.00 -1.95 0.00 0.00 55.36 51.94 2nts s GLN 228 Cb 0.43 0.02 0.18 0.00 -0.22 0.00 0.00 33.01 33.42 2nts s GLN 228 CO -0.03 -0.55 0.55 -0.51 -0.25 0.00 0.00 175.29 174.51 2nts s ASP 229 N -3.41 -1.07 -0.20 5.90 1.11 -1.26 -4.90 116.67 112.85 2nts s ASP 229 Ca 0.36 0.71 -0.16 0.00 0.18 0.00 0.00 52.55 53.64 2nts s ASP 229 Cb 0.03 1.95 0.05 0.00 1.07 0.00 0.00 42.92 46.03 2nts s ASP 229 CO 0.21 -0.27 0.51 0.00 1.18 0.00 0.00 175.17 176.81 2nts s ARG 230 N 2.79 0.57 0.88 8.23 1.70 -1.26 -5.09 118.95 126.77 2nts s ARG 230 Ca 0.19 0.78 -0.15 0.00 -0.47 0.00 0.00 55.73 56.08 2nts s ARG 230 Cb -0.15 0.22 -0.02 0.00 -0.57 0.00 0.00 34.95 34.43 2nts s ARG 230 CO -0.20 -0.09 0.23 0.00 -1.08 0.00 0.00 175.30 174.15 2nts n ALA 231 N 3.20 -2.77 -1.79 7.88 0.00 -1.26 -4.85 120.51 120.92 2nts n ALA 231 Ca -0.16 -0.49 -0.42 0.00 0.00 0.00 0.00 53.44 52.37 2nts n ALA 231 Cb 0.56 -1.69 -0.02 0.00 0.00 0.00 0.00 19.45 18.30 2nts n ALA 231 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2nts s LYS 232 N -3.02 4.15 -1.37 0.00 2.20 -1.26 -4.89 119.74 115.55 2nts s LYS 232 Ca 0.57 2.53 -0.14 0.00 -0.36 0.00 0.00 55.97 58.56 2nts s LYS 232 Cb -0.26 -3.08 0.08 0.00 -1.51 0.00 0.00 37.83 33.06 2nts s LYS 232 CO 0.67 -0.66 1.99 -0.35 -0.36 0.00 0.00 175.35 176.63 2nts n PRO 233 N 3.30 3.10 -2.16 4.03 -0.04 -1.26 -4.96 135.00 137.01 2nts n PRO 233 Ca 0.12 -3.02 -0.28 0.00 -0.04 0.00 0.00 63.50 60.29 2nts n PRO 233 Cb 0.37 -3.27 0.05 0.00 -0.04 0.00 0.00 33.50 30.61 2nts n PRO 233 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2nts s VAL 234 N 2.90 3.29 0.15 0.52 -7.23 -1.26 -0.49 120.40 118.28 2nts s VAL 234 Ca 0.47 0.13 -0.33 0.00 -1.81 0.00 0.00 61.98 60.45 2nts s VAL 234 Cb 0.09 -3.37 -0.12 0.00 0.56 0.00 0.00 36.38 33.54 2nts s VAL 234 CO -0.02 -0.42 1.71 0.41 -0.31 0.00 0.00 175.10 176.46 2nts n THR 235 N -2.83 0.13 -3.81 5.32 -1.04 -1.20 -4.32 114.28 106.53 2nts n THR 235 Ca 0.06 -0.02 -0.05 0.00 -2.04 0.00 0.00 64.05 61.99 2nts n THR 235 Cb 0.58 -1.84 -0.02 0.00 -1.82 0.00 0.00 70.33 67.23 2nts n THR 235 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2nts s GLN 236 N 1.67 1.53 -0.13 -2.82 -2.07 -0.51 -4.90 119.66 112.43 2nts s GLN 236 Ca 0.79 -0.85 -0.02 0.00 -1.82 0.00 0.00 55.36 53.47 2nts s GLN 236 Cb -0.58 0.52 -0.02 0.00 -1.09 0.00 0.00 33.01 31.84 2nts s GLN 236 CO 0.37 -0.70 -0.08 0.42 -1.32 0.00 0.00 175.29 173.98 2nts s ILE 237 N -3.64 3.52 -0.12 3.63 1.01 -1.26 0.11 121.20 124.44 2nts s ILE 237 Ca 0.12 -0.50 0.03 0.00 0.00 0.00 0.00 60.65 60.30 2nts s ILE 237 Cb -0.04 -2.51 0.01 0.00 0.01 0.00 0.00 42.46 39.93 2nts s ILE 237 CO 0.05 0.52 -0.22 -0.69 0.00 0.00 0.00 174.94 174.60 2nts s VAL 238 N 0.20 2.01 0.29 2.92 1.01 -0.52 -4.97 120.40 121.33 2nts s VAL 238 Ca -0.05 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.01 2nts s VAL 238 Cb -0.14 -1.76 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 2nts s VAL 238 CO 0.04 0.54 0.02 -0.44 0.00 0.00 0.00 175.10 175.26 2nts s SER 239 N 0.67 2.31 -0.06 3.32 0.01 -1.26 -1.08 113.70 117.60 2nts s SER 239 Ca -0.11 -1.30 -0.06 0.00 1.31 0.00 0.00 55.95 55.79 2nts s SER 239 Cb -0.16 -0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.01 2nts s SER 239 CO 0.02 -0.53 0.18 0.00 0.41 0.00 0.00 173.24 173.31 2nts s ALA 240 N -3.27 -0.43 0.38 1.44 0.00 -0.86 -4.81 121.76 114.20 2nts s ALA 240 Ca 0.33 0.46 0.04 0.00 0.00 0.00 0.00 51.96 52.79 2nts s ALA 240 Cb 0.07 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 2nts s ALA 240 CO 0.13 -0.09 0.05 -1.21 0.00 0.00 0.00 175.76 174.64 2nts s GLU 241 N -0.01 1.83 -0.30 0.00 2.02 -1.26 -1.08 118.70 119.90 2nts s GLU 241 Ca -0.01 -2.06 -0.14 0.00 0.02 0.00 0.00 54.97 52.78 2nts s GLU 241 Cb -0.02 -1.07 0.15 0.00 0.10 0.00 0.00 34.13 33.30 2nts s GLU 241 CO 0.00 -0.23 0.92 0.00 0.02 0.00 0.00 175.26 175.98 2nts s ALA 242 N -3.11 -2.51 0.22 5.21 0.00 -0.65 -4.80 121.76 116.13 2nts s ALA 242 Ca 0.30 2.13 -0.13 0.00 0.00 0.00 0.00 51.96 54.27 2nts s ALA 242 Cb 0.07 -1.94 -0.08 0.00 0.00 0.00 0.00 23.12 21.17 2nts s ALA 242 CO 0.14 -0.85 0.60 -1.58 0.00 0.00 0.00 175.76 174.07 2nts s TRP 243 N 2.35 3.48 0.79 0.00 0.52 -1.26 -1.57 118.94 123.26 2nts s TRP 243 Ca -0.04 1.03 -0.11 0.00 0.02 0.00 0.00 56.10 57.00 2nts s TRP 243 Cb -0.07 -2.37 0.07 0.00 -1.15 0.00 0.00 33.47 29.95 2nts s TRP 243 CO -0.17 0.29 1.10 0.20 0.02 0.00 0.00 176.95 178.38 2nts s GLY 244 N -2.10 1.62 0.00 0.98 0.00 -0.59 -4.97 107.32 102.26 2nts s GLY 244 Ca 0.46 -0.20 0.00 0.00 0.00 0.00 0.00 44.72 44.98 2nts s GLY 244 CO 0.20 0.23 0.00 0.54 0.00 0.00 0.00 173.10 174.06