#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ies s LEU 3 N 0.00 4.11 0.49 0.99 1.43 -1.26 -0.49 118.68 123.94 2ies s LEU 3 Ca 0.00 0.75 -0.24 0.00 -1.03 0.00 0.00 54.13 53.61 2ies s LEU 3 Cb 0.00 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.61 2ies s LEU 3 CO 0.00 -0.13 1.42 -1.61 0.23 0.00 0.00 176.35 176.26 2ies s GLU 4 N -3.25 3.48 0.32 1.70 2.02 0.12 -4.66 118.70 118.44 2ies s GLU 4 Ca 0.44 2.39 0.05 0.00 0.02 0.00 0.00 54.97 57.88 2ies s GLU 4 Cb -0.11 -2.52 -0.06 0.00 0.10 0.00 0.00 34.13 31.54 2ies s GLU 4 CO 0.27 -0.97 0.00 0.15 0.02 0.00 0.00 175.26 174.73 2ies s LYS 5 N -2.61 1.66 0.23 1.61 1.02 -1.26 -2.38 119.74 118.01 2ies s LYS 5 Ca 0.65 -1.89 -0.22 0.00 0.02 0.00 0.00 55.97 54.52 2ies s LYS 5 Cb -0.43 -1.11 0.05 0.00 -0.52 0.00 0.00 37.83 35.82 2ies s LYS 5 CO 0.54 -0.07 0.86 -0.08 -0.92 0.00 0.00 175.35 175.68 2ies s THR 6 N -3.09 0.00 0.32 2.17 -1.32 -1.06 -1.64 115.64 111.03 2ies s THR 6 Ca 0.33 -0.81 -0.24 0.00 -1.21 0.00 0.00 61.69 59.76 2ies s THR 6 Cb 0.07 -2.18 -0.10 0.00 -1.51 0.00 0.00 72.50 68.78 2ies s THR 6 CO 0.14 0.00 0.90 0.68 -2.21 0.00 0.00 174.62 174.14 2ies s VAL 7 N -3.29 4.31 0.21 5.08 -7.23 -1.26 0.87 120.40 119.09 2ies s VAL 7 Ca 0.13 1.66 -0.10 0.00 -1.81 0.00 0.00 61.98 61.87 2ies s VAL 7 Cb -0.04 -3.91 0.16 0.00 0.56 0.00 0.00 36.38 33.15 2ies s VAL 7 CO 0.05 0.07 1.86 0.11 -0.31 0.00 0.00 175.10 176.89 2ies h LYS 8 N 3.00 0.92 -3.28 4.82 1.57 -1.17 -3.44 116.57 118.99 2ies h LYS 8 Ca -0.47 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.23 2ies h LYS 8 Cb 1.19 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 33.24 2ies h LYS 8 CO 0.64 0.61 0.11 -1.83 -0.57 0.00 0.00 179.45 178.42 2ies s GLU 9 N -6.12 1.88 0.18 3.15 -1.05 -1.26 -5.03 118.70 110.45 2ies s GLU 9 Ca -0.13 -1.27 -0.33 0.00 -0.15 0.00 0.00 54.97 53.09 2ies s GLU 9 Cb 0.15 0.56 -0.14 0.00 -0.44 0.00 0.00 34.13 34.27 2ies s GLU 9 CO 0.78 -0.84 1.44 1.63 0.95 0.00 0.00 175.26 179.21 2ies n LYS 10 N -0.47 1.88 -5.00 -4.83 5.02 -1.26 -4.80 118.16 108.69 2ies n LYS 10 Ca -0.04 0.67 -0.27 0.00 -2.02 0.00 0.00 58.31 56.65 2ies n LYS 10 Cb 0.60 -2.35 -0.16 0.00 -0.02 0.00 0.00 35.03 33.10 2ies n LYS 10 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2ies s LEU 11 N 0.50 2.03 0.07 -0.35 1.43 -0.91 -4.97 118.68 116.49 2ies s LEU 11 Ca 0.75 -0.37 0.04 0.00 -1.03 0.00 0.00 54.13 53.51 2ies s LEU 11 Cb -0.72 -1.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 2ies s LEU 11 CO 0.45 0.24 -0.12 -0.94 0.23 0.00 0.00 176.35 176.22 2ies s SER 12 N -0.43 1.41 0.03 2.29 1.04 -1.26 0.15 113.70 116.93 2ies s SER 12 Ca 0.07 -0.62 -0.05 0.00 0.48 0.00 0.00 55.95 55.83 2ies s SER 12 Cb -0.08 -0.02 -0.01 0.00 0.10 0.00 0.00 66.02 66.01 2ies s SER 12 CO -0.00 -0.14 0.07 -0.36 0.98 0.00 0.00 173.24 173.79 2ies s PHE 13 N -1.45 0.21 0.06 5.02 0.40 -0.73 -4.97 117.98 116.53 2ies s PHE 13 Ca -0.03 -0.50 -0.19 0.00 -0.60 0.00 0.00 56.93 55.60 2ies s PHE 13 Cb -0.09 -0.16 0.04 0.00 0.51 0.00 0.00 43.02 43.32 2ies s PHE 13 CO 0.01 -0.33 0.44 -1.83 0.70 0.00 0.00 175.22 174.21 2ies s GLU 14 N -2.38 0.98 0.00 0.44 -1.05 -1.26 0.19 118.70 115.63 2ies s GLU 14 Ca -0.07 -0.41 0.00 0.00 -0.15 0.00 0.00 54.97 54.34 2ies s GLU 14 Cb -0.03 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 34.10 2ies s GLU 14 CO -0.04 -0.35 0.00 0.41 0.95 0.00 0.00 175.26 176.23 2ies n GLY 15 N 0.31 -0.36 3.77 -3.83 0.00 -0.96 -4.92 105.19 99.20 2ies n GLY 15 Ca -0.18 -1.28 -0.36 0.00 0.00 0.00 0.00 46.02 44.20 2ies n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ies s VAL 16 N -2.00 3.23 0.18 1.61 0.11 -1.26 -2.54 120.40 119.73 2ies s VAL 16 Ca 0.00 0.87 -0.20 0.00 -2.93 0.00 0.00 61.98 59.72 2ies s VAL 16 Cb 0.00 -3.42 -0.08 0.00 -1.53 0.00 0.00 36.38 31.35 2ies s VAL 16 CO 0.00 -0.06 0.70 -0.83 -3.33 0.00 0.00 175.10 171.58 2ies s GLY 17 N -1.52 2.68 0.23 6.54 0.00 0.40 -2.09 107.32 113.55 2ies s GLY 17 Ca 0.65 0.16 -0.03 0.00 0.00 0.00 0.00 44.72 45.51 2ies s GLY 17 CO 0.31 0.56 1.67 1.19 0.00 0.00 0.00 173.10 176.83 2ies h ILE 18 N 2.99 1.26 0.00 0.90 2.10 -1.87 -2.44 117.51 120.45 2ies h ILE 18 Ca -0.48 -1.26 -0.06 0.00 1.08 0.00 0.00 64.86 64.14 2ies h ILE 18 Cb 1.20 1.15 -0.01 0.00 -1.09 0.00 0.00 36.82 38.07 2ies h ILE 18 CO 0.65 0.42 -0.66 0.45 -1.08 0.00 0.00 178.15 177.93 2ies h HIS 19 N 0.66 0.00 0.00 2.19 3.86 -1.93 0.44 115.15 120.37 2ies h HIS 19 Ca 0.10 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 2ies h HIS 19 Cb 0.66 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.13 2ies h HIS 19 CO 0.03 0.44 -0.09 1.79 0.86 0.00 0.00 177.93 180.96 2ies h THR 20 N -1.00 1.00 0.00 2.45 1.35 -1.92 0.70 112.91 115.48 2ies h THR 20 Ca -0.10 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 2ies h THR 20 Cb 0.70 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 2ies h THR 20 CO -0.06 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 2ies n GLY 21 N -1.23 0.59 3.95 5.82 0.00 -0.92 -4.66 105.19 108.75 2ies n GLY 21 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 2ies n GLY 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ies s GLU 22 N -0.31 3.48 0.38 1.61 2.02 -1.26 -4.73 118.70 119.90 2ies s GLU 22 Ca 0.00 -0.44 -0.19 0.00 0.02 0.00 0.00 54.97 54.36 2ies s GLU 22 Cb 0.00 -2.76 -0.10 0.00 0.10 0.00 0.00 34.13 31.37 2ies s GLU 22 CO 0.00 0.28 0.86 -0.47 0.02 0.00 0.00 175.26 175.95 2ies s TYR 23 N -2.13 3.35 0.13 1.61 5.04 -1.26 -0.45 117.35 123.64 2ies s TYR 23 Ca 0.38 1.46 -0.19 0.00 -2.44 0.00 0.00 57.07 56.28 2ies s TYR 23 Cb -0.10 -2.73 0.05 0.00 0.35 0.00 0.00 41.96 39.54 2ies s TYR 23 CO 0.33 -0.02 0.49 -1.54 -1.34 0.00 0.00 175.55 173.47 2ies s SER 24 N -2.20 -0.38 0.04 4.32 1.04 -1.05 -4.79 113.70 110.67 2ies s SER 24 Ca 0.58 -0.16 0.04 0.00 0.48 0.00 0.00 55.95 56.89 2ies s SER 24 Cb -0.10 0.53 -0.02 0.00 0.10 0.00 0.00 66.02 66.53 2ies s SER 24 CO 0.15 -0.89 -0.12 -0.75 0.98 0.00 0.00 173.24 172.61 2ies s LYS 25 N -3.70 0.78 0.13 4.02 2.20 -0.98 -2.26 119.74 119.93 2ies s LYS 25 Ca 0.02 -0.70 0.08 0.00 -0.36 0.00 0.00 55.97 55.01 2ies s LYS 25 Cb 0.01 -0.74 -0.04 0.00 -1.51 0.00 0.00 37.83 35.55 2ies s LYS 25 CO -0.12 0.18 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.43 2ies s LEU 26 N -1.13 2.96 -0.29 5.43 1.43 0.51 -1.50 118.68 126.09 2ies s LEU 26 Ca -0.01 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.61 2ies s LEU 26 Cb -0.08 -1.72 0.15 0.00 0.03 0.00 0.00 46.19 44.57 2ies s LEU 26 CO 0.01 0.15 0.35 -0.63 0.23 0.00 0.00 176.35 176.46 2ies s ILE 27 N -1.36 -0.51 -0.29 -0.59 1.01 -0.90 -1.77 121.20 116.78 2ies s ILE 27 Ca 0.22 -0.38 -0.26 0.00 0.00 0.00 0.00 60.65 60.22 2ies s ILE 27 Cb -0.10 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.40 2ies s ILE 27 CO 0.14 -0.37 0.93 -0.63 0.00 0.00 0.00 174.94 175.01 2ies s ILE 28 N 2.45 4.68 -0.05 2.92 1.09 0.40 -1.76 121.20 130.92 2ies s ILE 28 Ca 0.10 1.55 -0.09 0.00 -1.10 0.00 0.00 60.65 61.11 2ies s ILE 28 Cb -0.13 -4.26 -0.05 0.00 -1.06 0.00 0.00 42.46 36.96 2ies s ILE 28 CO -0.31 -0.30 0.24 -1.00 -0.10 0.00 0.00 174.94 173.47 2ies s HIS 29 N 3.22 3.63 0.43 3.97 3.76 0.81 -2.14 115.29 128.97 2ies s HIS 29 Ca 0.39 0.65 -0.22 0.00 -0.15 0.00 0.00 55.06 55.73 2ies s HIS 29 Cb -0.14 -2.04 -0.09 0.00 1.11 0.00 0.00 32.58 31.42 2ies s HIS 29 CO 0.12 0.68 1.02 -2.14 -0.85 0.00 0.00 174.74 173.57 2ies s PRO 30 N -1.25 4.10 0.02 8.40 0.02 -1.26 -1.24 135.00 143.80 2ies s PRO 30 Ca 0.21 1.37 0.02 0.00 0.02 0.00 0.00 61.00 62.61 2ies s PRO 30 Cb -0.13 -2.35 -0.02 0.00 0.02 0.00 0.00 34.50 32.02 2ies s PRO 30 CO 0.10 -0.17 -0.06 -1.21 -0.33 0.00 0.00 177.00 175.33 2ies s GLU 31 N -2.82 0.43 1.04 5.54 0.41 -1.21 -4.78 118.70 117.30 2ies s GLU 31 Ca 0.61 -0.54 -0.16 0.00 -0.41 0.00 0.00 54.97 54.46 2ies s GLU 31 Cb -0.17 -0.23 0.05 0.00 -1.78 0.00 0.00 34.13 32.00 2ies s GLU 31 CO 0.22 0.04 0.10 0.36 -0.49 0.00 0.00 175.26 175.50 2ies n LYS 32 N 1.96 -0.89 -0.82 1.61 2.85 -1.26 -4.74 118.16 116.86 2ies n LYS 32 Ca -0.20 -0.23 -0.31 0.00 -1.05 0.00 0.00 58.31 56.51 2ies n LYS 32 Cb 0.56 -1.72 0.15 0.00 -0.65 0.00 0.00 35.03 33.37 2ies n LYS 32 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2ies s GLU 33 N -3.43 1.24 0.00 -1.58 2.02 -1.26 -2.87 118.70 112.82 2ies s GLU 33 Ca 0.55 1.54 0.00 0.00 0.02 0.00 0.00 54.97 57.08 2ies s GLU 33 Cb -0.16 -1.75 0.00 0.00 0.10 0.00 0.00 34.13 32.32 2ies s GLU 33 CO 0.67 -2.46 0.00 0.41 0.02 0.00 0.00 175.26 173.90 2ies n GLY 34 N 0.10 0.26 0.40 -1.39 0.00 -1.26 -4.85 105.19 98.45 2ies n GLY 34 Ca 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.99 2ies n GLY 34 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ies h THR 35 N 0.00 0.03 0.00 2.61 2.02 -1.86 -3.50 112.91 112.21 2ies h THR 35 Ca 0.00 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.90 2ies h THR 35 Cb 0.00 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 2ies h THR 35 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 2ies n GLY 36 N -0.73 -3.32 3.68 2.16 0.00 -1.21 -4.94 105.19 100.83 2ies n GLY 36 Ca -0.12 -2.15 -0.37 0.00 0.00 0.00 0.00 46.02 43.38 2ies n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ies s ILE 37 N -0.93 5.31 -0.09 -0.61 1.09 -1.06 -1.60 121.20 123.31 2ies s ILE 37 Ca 0.00 0.39 -0.14 0.00 -1.10 0.00 0.00 60.65 59.80 2ies s ILE 37 Cb 0.00 -3.58 0.03 0.00 -1.06 0.00 0.00 42.46 37.85 2ies s ILE 37 CO 0.00 0.33 0.35 0.00 -0.10 0.00 0.00 174.94 175.52 2ies s ARG 38 N 0.98 0.54 0.41 2.79 1.70 -1.12 -1.42 118.95 122.83 2ies s ARG 38 Ca 0.12 0.23 0.01 0.00 -0.47 0.00 0.00 55.73 55.61 2ies s ARG 38 Cb -0.13 0.25 -0.01 0.00 -0.57 0.00 0.00 34.95 34.48 2ies s ARG 38 CO 0.05 -0.11 0.62 -0.06 -1.08 0.00 0.00 175.30 174.72 2ies s PHE 39 N -0.44 3.32 -0.12 5.89 0.40 0.29 -0.63 117.98 126.69 2ies s PHE 39 Ca -0.06 0.26 -0.02 0.00 -0.60 0.00 0.00 56.93 56.51 2ies s PHE 39 Cb -0.04 -2.15 0.04 0.00 0.51 0.00 0.00 43.02 41.39 2ies s PHE 39 CO 0.02 -0.17 0.02 0.12 0.70 0.00 0.00 175.22 175.91 2ies s PHE 40 N -2.45 0.75 -0.03 0.36 5.36 0.19 -0.42 117.98 121.72 2ies s PHE 40 Ca 0.45 -0.41 0.00 0.00 -0.96 0.00 0.00 56.93 56.01 2ies s PHE 40 Cb -0.10 -0.87 0.03 0.00 -0.34 0.00 0.00 43.02 41.74 2ies s PHE 40 CO 0.37 -0.44 -0.00 0.21 -1.46 0.00 0.00 175.22 173.90 2ies s LYS 41 N 1.95 0.35 -1.13 10.12 2.20 -0.23 -1.05 119.74 131.96 2ies s LYS 41 Ca 0.03 0.07 -0.25 0.00 -0.36 0.00 0.00 55.97 55.45 2ies s LYS 41 Cb -0.14 -0.54 0.02 0.00 -1.51 0.00 0.00 37.83 35.66 2ies s LYS 41 CO -0.06 -0.14 0.71 0.09 -0.36 0.00 0.00 175.35 175.59 2ies n ASN 42 N 4.20 -4.75 -2.03 1.43 3.02 -1.26 -0.61 115.26 115.26 2ies n ASN 42 Ca -0.25 -1.13 -0.12 0.00 -0.03 0.00 0.00 54.58 53.04 2ies n ASN 42 Cb 0.50 -2.34 -0.02 0.00 -0.61 0.00 0.00 39.78 37.31 2ies n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ies n GLY 43 N -1.89 0.15 3.02 7.41 0.00 -1.26 -4.94 105.19 107.67 2ies n GLY 43 Ca -0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 2ies n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ies s VAL 44 N -2.40 1.30 -0.23 1.61 1.01 0.22 -5.12 120.40 116.79 2ies s VAL 44 Ca 0.00 -0.54 -0.19 0.00 0.00 0.00 0.00 61.98 61.26 2ies s VAL 44 Cb 0.00 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 2ies s VAL 44 CO 0.00 0.40 0.54 -0.31 0.00 0.00 0.00 175.10 175.73 2ies s TYR 45 N 0.96 3.32 -0.27 5.22 1.51 -1.26 -1.07 117.35 125.77 2ies s TYR 45 Ca -0.08 0.74 -0.03 0.00 -1.01 0.00 0.00 57.07 56.69 2ies s TYR 45 Cb -0.15 -2.72 0.02 0.00 -0.11 0.00 0.00 41.96 39.00 2ies s TYR 45 CO -0.00 -0.20 -0.01 0.42 -1.11 0.00 0.00 175.55 174.64 2ies s ILE 46 N 2.02 3.20 0.26 2.71 1.01 0.44 -4.94 121.20 125.90 2ies s ILE 46 Ca 0.24 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.61 2ies s ILE 46 Cb -0.16 -2.66 -0.09 0.00 0.01 0.00 0.00 42.46 39.56 2ies s ILE 46 CO 0.09 0.12 1.27 -2.84 0.00 0.00 0.00 174.94 173.58 2ies s PRO 47 N 1.36 4.42 -0.95 2.79 0.02 -1.26 0.10 135.00 141.49 2ies s PRO 47 Ca 0.00 2.07 -0.06 0.00 0.02 0.00 0.00 61.00 63.03 2ies s PRO 47 Cb -0.17 -3.15 -0.08 0.00 0.02 0.00 0.00 34.50 31.12 2ies s PRO 47 CO -0.02 -0.14 2.39 0.00 -0.33 0.00 0.00 177.00 178.89 2ies n ALA 48 N 1.69 5.37 -2.57 -1.55 0.00 -0.51 -4.71 120.51 118.24 2ies n ALA 48 Ca 0.03 -2.23 -0.22 0.00 0.00 0.00 0.00 53.44 51.01 2ies n ALA 48 Cb 0.43 -2.98 -0.15 0.00 0.00 0.00 0.00 19.45 16.75 2ies n ALA 48 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2ies s ARG 49 N 2.85 1.15 0.55 0.00 0.52 -1.26 -4.25 118.95 118.51 2ies s ARG 49 Ca 0.47 -0.61 0.47 0.00 -0.52 0.00 0.00 55.73 55.55 2ies s ARG 49 Cb 0.14 -1.13 1.70 0.00 0.52 0.00 0.00 34.95 36.17 2ies s ARG 49 CO -0.03 0.30 1.61 1.12 0.02 0.00 0.00 175.30 178.31 2ies h HIS 50 N 5.51 0.05 -0.18 -0.53 2.07 -1.60 0.11 115.15 120.58 2ies h HIS 50 Ca -0.36 0.00 0.05 0.00 -2.85 0.00 0.00 60.37 57.21 2ies h HIS 50 Cb 1.16 -0.01 -0.01 0.00 2.57 0.00 0.00 27.41 31.13 2ies h HIS 50 CO 0.44 -0.02 0.14 0.93 -3.07 0.00 0.00 177.93 176.34 2ies h GLU 51 N 0.00 0.00 -0.80 5.12 3.07 -1.92 -2.36 114.58 117.69 2ies h GLU 51 Ca 0.89 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 59.49 2ies h GLU 51 Cb 3.50 0.00 -0.16 0.00 -0.84 0.00 0.00 28.75 31.26 2ies h GLU 51 CO -0.05 0.00 0.33 1.19 -1.40 0.00 0.00 179.01 179.08 2ies n PHE 52 N -4.38 2.55 -3.02 4.33 3.01 0.38 -4.92 117.46 115.40 2ies n PHE 52 Ca 0.01 -1.28 -0.41 0.00 1.01 0.00 0.00 57.45 56.79 2ies n PHE 52 Cb 0.27 -0.73 -0.05 0.00 -0.01 0.00 0.00 39.48 38.96 2ies n PHE 52 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2ies s VAL 53 N -2.99 4.96 -0.26 -4.37 1.01 -0.89 -0.83 120.40 117.03 2ies s VAL 53 Ca 0.55 1.36 0.02 0.00 0.00 0.00 0.00 61.98 63.91 2ies s VAL 53 Cb 0.44 -4.02 0.01 0.00 0.00 0.00 0.00 36.38 32.81 2ies s VAL 53 CO 0.13 0.06 0.50 1.33 0.00 0.00 0.00 175.10 177.12 2ies n VAL 54 N 4.79 0.00 -3.64 2.92 0.24 -0.14 -4.94 118.33 117.57 2ies n VAL 54 Ca 0.01 -0.49 -0.05 0.00 -2.04 0.00 0.00 64.34 61.77 2ies n VAL 54 Cb 0.49 1.04 -0.07 0.00 -1.47 0.00 0.00 33.84 33.84 2ies n VAL 54 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2ies s HIS 55 N -0.35 -0.75 -0.13 6.34 5.65 -1.21 -4.96 115.29 119.88 2ies s HIS 55 Ca 0.02 1.54 0.20 0.00 0.25 0.00 0.00 55.06 57.07 2ies s HIS 55 Cb 0.02 0.45 0.44 0.00 -1.18 0.00 0.00 32.58 32.31 2ies s HIS 55 CO 0.04 -0.37 1.17 0.25 -0.65 0.00 0.00 174.74 175.18 2ies n THR 56 N 3.72 1.02 0.00 0.89 -2.24 -1.24 -0.23 114.28 116.20 2ies n THR 56 Ca -0.18 -2.21 0.00 0.00 -2.27 0.00 0.00 64.05 59.39 2ies n THR 56 Cb 0.58 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 2ies n THR 56 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2ies n ASN 57 N -0.22 0.00 -1.98 3.42 4.13 -1.26 -3.05 115.26 116.30 2ies n ASN 57 Ca 0.13 0.00 -0.24 0.00 1.68 0.00 0.00 54.58 56.16 2ies n ASN 57 Cb 0.95 0.00 0.04 0.00 -1.54 0.00 0.00 39.78 39.23 2ies n ASN 57 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2ies n HIS 58 N 0.00 2.66 0.00 3.10 8.25 -1.26 -4.71 115.22 123.26 2ies n HIS 58 Ca 0.00 -2.26 0.00 0.00 -0.26 0.00 0.00 57.72 55.20 2ies n HIS 58 Cb 0.00 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 30.67 2ies n HIS 58 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2ies n SER 59 N -0.75 0.00 -4.34 0.41 3.41 -1.26 -5.03 113.62 106.06 2ies n SER 59 Ca 0.45 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.66 2ies n SER 59 Cb 0.93 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.76 2ies n SER 59 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2ies s THR 60 N -2.00 4.25 0.01 6.66 2.01 -1.26 -3.71 115.64 121.60 2ies s THR 60 Ca 0.00 -0.95 -0.01 0.00 0.31 0.00 0.00 61.69 61.04 2ies s THR 60 Cb 0.00 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.10 2ies s THR 60 CO 0.00 -0.20 0.11 -1.81 -0.69 0.00 0.00 174.62 172.03 2ies s ASP 61 N 1.49 5.86 0.20 3.53 1.01 0.68 -2.34 116.67 127.10 2ies s ASP 61 Ca 0.01 0.18 0.09 0.00 0.71 0.00 0.00 52.55 53.55 2ies s ASP 61 Cb -0.19 -1.72 -0.04 0.00 1.01 0.00 0.00 42.92 41.97 2ies s ASP 61 CO 0.05 0.26 -0.19 -0.76 0.21 0.00 0.00 175.17 174.74 2ies s LEU 62 N -1.88 2.48 -0.00 1.23 1.43 -0.25 -0.96 118.68 120.73 2ies s LEU 62 Ca 0.25 -0.92 -0.29 0.00 -1.03 0.00 0.00 54.13 52.15 2ies s LEU 62 Cb -0.12 -0.90 0.10 0.00 0.03 0.00 0.00 46.19 45.30 2ies s LEU 62 CO 0.16 -0.02 0.88 -0.83 0.23 0.00 0.00 176.35 176.78 2ies s GLY 63 N -2.92 -0.47 -0.25 -3.19 0.00 -0.01 -0.36 107.32 100.12 2ies s GLY 63 Ca 0.20 1.01 -0.26 0.00 0.00 0.00 0.00 44.72 45.67 2ies s GLY 63 CO 0.09 0.33 0.86 -0.12 0.00 0.00 0.00 173.10 174.26 2ies s PHE 69 N -3.13 -0.63 -1.25 1.90 5.36 -0.45 -4.75 117.98 115.04 2ies s PHE 69 Ca 0.05 1.48 -0.18 0.00 -0.96 0.00 0.00 56.93 57.32 2ies s PHE 69 Cb -0.01 0.33 0.02 0.00 -0.34 0.00 0.00 43.02 43.02 2ies s PHE 69 CO -0.09 -0.33 0.34 1.63 -1.46 0.00 0.00 175.22 175.30 2ies n LYS 70 N 2.25 -0.57 -1.09 10.12 4.76 -1.26 -0.67 118.16 131.70 2ies n LYS 70 Ca -0.13 0.04 -0.03 0.00 -2.87 0.00 0.00 58.31 55.31 2ies n LYS 70 Cb 0.56 -2.65 -0.01 0.00 -1.84 0.00 0.00 35.03 31.08 2ies n LYS 70 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ies n GLY 71 N -2.21 0.60 3.14 0.72 0.00 -1.26 -5.02 105.19 101.15 2ies n GLY 71 Ca -0.19 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 2ies n GLY 71 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ies s GLN 72 N -1.54 2.79 0.03 1.61 -1.52 0.16 -5.13 119.66 116.07 2ies s GLN 72 Ca 0.00 -0.77 0.07 0.00 -1.95 0.00 0.00 55.36 52.71 2ies s GLN 72 Cb 0.00 -2.26 -0.02 0.00 -0.22 0.00 0.00 33.01 30.50 2ies s GLN 72 CO 0.00 -0.01 -0.21 1.03 -0.25 0.00 0.00 175.29 175.85 2ies s ARG 73 N 0.82 1.49 -0.09 2.91 0.52 -1.26 -1.33 118.95 122.00 2ies s ARG 73 Ca -0.08 -0.93 0.02 0.00 -0.52 0.00 0.00 55.73 54.21 2ies s ARG 73 Cb -0.16 -1.58 0.02 0.00 0.52 0.00 0.00 34.95 33.75 2ies s ARG 73 CO -0.01 0.41 -0.13 0.42 0.02 0.00 0.00 175.30 176.02 2ies s ILE 74 N -0.75 1.27 -0.06 1.52 1.01 0.51 -4.53 121.20 120.18 2ies s ILE 74 Ca 0.08 -0.51 -0.04 0.00 0.00 0.00 0.00 60.65 60.17 2ies s ILE 74 Cb -0.09 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 2ies s ILE 74 CO 0.01 0.39 0.16 -0.54 0.00 0.00 0.00 174.94 174.97 2ies s LYS 75 N 1.00 3.43 -0.55 2.79 1.02 0.27 -1.09 119.74 126.60 2ies s LYS 75 Ca -0.08 -0.24 -0.03 0.00 0.02 0.00 0.00 55.97 55.64 2ies s LYS 75 Cb -0.15 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 2ies s LYS 75 CO -0.01 0.72 0.55 2.41 -0.92 0.00 0.00 175.35 178.11 2ies n THR 76 N 1.40 -8.71 0.80 2.17 -1.04 -1.18 -0.88 114.28 106.84 2ies n THR 76 Ca -0.15 0.01 0.09 0.00 -2.04 0.00 0.00 64.05 61.95 2ies n THR 76 Cb 0.54 -6.40 -0.04 0.00 -1.82 0.00 0.00 70.33 62.62 2ies n THR 76 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2ies n VAL 77 N -1.35 0.00 0.02 12.58 0.24 -0.99 -3.87 118.33 124.97 2ies n VAL 77 Ca 0.02 -0.24 -0.10 0.00 -2.04 0.00 0.00 64.34 61.98 2ies n VAL 77 Cb 0.47 1.14 -0.04 0.00 -1.47 0.00 0.00 33.84 33.94 2ies n VAL 77 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 2ies h GLU 78 N 1.31 -0.17 0.68 7.34 9.09 -1.91 -0.95 114.58 129.96 2ies h GLU 78 Ca 0.00 0.01 -0.03 0.00 0.05 0.00 0.00 59.36 59.39 2ies h GLU 78 Cb 0.54 0.04 0.01 0.00 -1.65 0.00 0.00 28.75 27.69 2ies h GLU 78 CO 0.00 -0.12 -0.33 0.45 0.05 0.00 0.00 179.01 179.07 2ies h HIS 79 N -0.18 -0.84 -0.71 2.06 3.86 -1.92 0.52 115.15 117.94 2ies h HIS 79 Ca 0.07 -0.02 0.13 0.00 -1.16 0.00 0.00 60.37 59.40 2ies h HIS 79 Cb 0.28 0.28 -0.09 0.00 1.06 0.00 0.00 27.41 28.94 2ies h HIS 79 CO -0.23 -0.51 0.24 0.97 0.86 0.00 0.00 177.93 179.26 2ies h ILE 80 N -0.96 0.64 -0.28 2.45 6.09 -1.85 -0.69 117.51 122.91 2ies h ILE 80 Ca -0.09 -0.13 -0.03 0.00 -1.37 0.00 0.00 64.86 63.24 2ies h ILE 80 Cb 0.71 0.23 -0.01 0.00 0.47 0.00 0.00 36.82 38.22 2ies h ILE 80 CO 0.15 0.07 0.04 -0.07 -3.07 0.00 0.00 178.15 175.28 2ies h LEU 81 N 0.38 0.44 -0.45 2.19 3.38 -0.90 -2.26 115.31 118.09 2ies h LEU 81 Ca 0.38 -0.26 0.09 0.00 0.09 0.00 0.00 57.88 58.18 2ies h LEU 81 Cb 0.58 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.14 2ies h LEU 81 CO -0.41 0.59 -0.01 -1.28 0.09 0.00 0.00 178.44 177.42 2ies h SER 82 N 0.28 -0.20 0.50 -0.43 0.87 0.14 0.32 113.55 115.03 2ies h SER 82 Ca 0.08 0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 2ies h SER 82 Cb 0.34 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2ies h SER 82 CO 0.01 -0.07 -0.24 0.58 -0.53 0.00 0.00 176.83 176.58 2ies h VAL 83 N 0.10 0.51 -1.01 2.23 2.07 -1.19 0.13 116.25 119.08 2ies h VAL 83 Ca 0.22 -0.05 0.27 0.00 0.82 0.00 0.00 66.70 67.96 2ies h VAL 83 Cb 0.33 0.53 -0.07 0.00 -1.52 0.00 0.00 31.29 30.56 2ies h VAL 83 CO -0.38 0.01 0.68 -0.07 0.02 0.00 0.00 177.57 177.84 2ies h LEU 84 N -0.70 0.28 -0.24 2.57 3.38 -0.76 0.40 115.31 120.24 2ies h LEU 84 Ca -0.07 0.05 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 2ies h LEU 84 Cb 0.53 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.28 2ies h LEU 84 CO 0.11 0.07 -0.72 -0.74 0.09 0.00 0.00 178.44 177.25 2ies h HIS 85 N 0.26 0.99 -0.32 1.13 2.76 0.50 -0.25 115.15 120.22 2ies h HIS 85 Ca 0.53 -0.42 -0.08 0.00 -2.20 0.00 0.00 60.37 58.20 2ies h HIS 85 Cb 1.61 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 30.40 2ies h HIS 85 CO -0.00 1.24 -0.13 -0.07 -1.30 0.00 0.00 177.93 177.67 2ies h LEU 86 N 0.52 0.67 0.00 0.26 3.38 0.23 -2.68 115.31 117.69 2ies h LEU 86 Ca -0.04 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2ies h LEU 86 Cb 1.34 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2ies h LEU 86 CO 0.15 0.91 0.00 0.18 0.09 0.00 0.00 178.44 179.77 2ies n LEU 87 N -4.39 0.00 -3.80 1.67 4.77 0.67 -4.91 117.00 111.01 2ies n LEU 87 Ca -0.03 0.06 -0.24 0.00 -0.03 0.00 0.00 56.01 55.77 2ies n LEU 87 Cb 0.36 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.41 2ies n LEU 87 CO 0.42 -0.01 -0.04 -0.62 -1.33 0.00 0.00 177.39 175.81 2ies n GLU 88 N -1.06 -4.83 -3.31 3.23 1.02 -0.63 -4.93 120.64 110.12 2ies n GLU 88 Ca 0.20 0.58 -0.39 0.00 -0.02 0.00 0.00 57.16 57.52 2ies n GLU 88 Cb 0.13 -5.17 -0.08 0.00 -0.02 0.00 0.00 31.44 26.29 2ies n GLU 88 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2ies s ILE 89 N -3.61 5.12 -0.15 -3.67 -1.09 -0.20 -4.03 121.20 113.58 2ies s ILE 89 Ca 0.19 0.76 0.12 0.00 -2.23 0.00 0.00 60.65 59.48 2ies s ILE 89 Cb -0.10 -3.77 -0.17 0.00 -1.58 0.00 0.00 42.46 36.84 2ies s ILE 89 CO 0.83 0.14 0.03 0.35 -1.23 0.00 0.00 174.94 175.05 2ies n THR 90 N 5.00 0.99 -4.03 2.92 -2.24 -0.65 -4.70 114.28 111.58 2ies n THR 90 Ca -0.06 -0.59 -0.32 0.00 -2.27 0.00 0.00 64.05 60.81 2ies n THR 90 Cb 0.50 -0.67 -0.15 0.00 -2.10 0.00 0.00 70.33 67.91 2ies n THR 90 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2ies s ASN 91 N -4.87 4.62 0.25 3.42 0.01 -0.82 -2.57 114.94 114.97 2ies s ASN 91 Ca -0.09 -1.65 -0.18 0.00 -0.71 0.00 0.00 52.86 50.23 2ies s ASN 91 Cb 0.04 -1.60 0.02 0.00 0.41 0.00 0.00 41.25 40.12 2ies s ASN 91 CO 0.57 -0.27 0.61 0.68 -1.51 0.00 0.00 177.10 177.18 2ies s VAL 92 N 1.05 0.01 -0.09 1.60 -7.23 -0.63 -3.29 120.40 111.81 2ies s VAL 92 Ca -0.02 -1.02 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 2ies s VAL 92 Cb -0.20 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 34.84 2ies s VAL 92 CO -0.06 -0.02 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.74 2ies s THR 93 N -3.93 0.98 -0.48 5.32 2.01 -0.37 -2.79 115.64 116.37 2ies s THR 93 Ca 0.13 -0.30 -0.16 0.00 0.31 0.00 0.00 61.69 61.67 2ies s THR 93 Cb -0.03 -0.98 0.08 0.00 0.01 0.00 0.00 72.50 71.58 2ies s THR 93 CO 0.05 0.35 0.43 -0.63 -0.69 0.00 0.00 174.62 174.12 2ies s ILE 94 N 1.38 5.20 -0.04 1.82 1.01 0.20 -0.14 121.20 130.64 2ies s ILE 94 Ca -0.01 -1.07 -0.27 0.00 0.00 0.00 0.00 60.65 59.29 2ies s ILE 94 Cb -0.14 -4.17 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 2ies s ILE 94 CO -0.04 -0.64 0.87 -0.70 0.00 0.00 0.00 174.94 174.43 2ies s GLU 95 N 1.72 4.50 -0.16 2.79 2.12 -0.72 0.53 118.70 129.48 2ies s GLU 95 Ca 0.05 1.20 0.01 0.00 0.36 0.00 0.00 54.97 56.59 2ies s GLU 95 Cb -0.25 -3.46 0.02 0.00 0.26 0.00 0.00 34.13 30.70 2ies s GLU 95 CO 0.07 -0.03 -0.19 0.08 -0.54 0.00 0.00 175.26 174.65 2ies s VAL 96 N 1.02 1.90 -0.84 3.70 1.01 -0.21 -2.12 120.40 124.87 2ies s VAL 96 Ca 0.46 -0.86 -0.06 0.00 0.00 0.00 0.00 61.98 61.52 2ies s VAL 96 Cb -0.19 -1.72 0.21 0.00 0.00 0.00 0.00 36.38 34.68 2ies s VAL 96 CO 0.23 0.52 0.73 -0.63 0.00 0.00 0.00 175.10 175.95 2ies s ILE 97 N 1.19 4.77 -1.51 2.22 1.01 -0.56 -4.58 121.20 123.73 2ies s ILE 97 Ca 0.01 -3.18 0.00 0.00 0.00 0.00 0.00 60.65 57.48 2ies s ILE 97 Cb -0.14 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.36 2ies s ILE 97 CO -0.09 -1.03 0.00 0.61 0.00 0.00 0.00 174.94 174.43 2ies n GLY 98 N 3.14 -0.20 0.05 6.18 0.00 -1.26 -2.31 105.19 110.79 2ies n GLY 98 Ca 0.16 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2ies n GLY 98 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ies n ASN 99 N 0.00 0.39 -3.64 1.61 3.02 -1.26 -4.94 115.26 110.44 2ies n ASN 99 Ca 0.00 -1.31 -0.07 0.00 -0.03 0.00 0.00 54.58 53.17 2ies n ASN 99 Cb 0.00 -0.03 -0.07 0.00 -0.61 0.00 0.00 39.78 39.07 2ies n ASN 99 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2ies s GLU 100 N -0.23 0.45 0.29 3.52 2.12 -1.26 0.93 118.70 124.52 2ies s GLU 100 Ca 0.01 0.58 -0.30 0.00 0.36 0.00 0.00 54.97 55.62 2ies s GLU 100 Cb 0.01 0.19 -0.11 0.00 0.26 0.00 0.00 34.13 34.48 2ies s GLU 100 CO 0.00 -0.06 1.52 0.42 -0.54 0.00 0.00 175.26 176.60 2ies s ILE 101 N 0.45 2.27 0.41 -3.70 -1.09 -0.06 -4.81 121.20 114.67 2ies s ILE 101 Ca 0.01 0.23 -0.27 0.00 -2.23 0.00 0.00 60.65 58.39 2ies s ILE 101 Cb -0.05 -3.15 -0.10 0.00 -1.58 0.00 0.00 42.46 37.58 2ies s ILE 101 CO -0.09 0.04 1.48 -2.84 -1.23 0.00 0.00 174.94 172.30 2ies s PRO 102 N -0.72 3.92 0.27 2.79 0.02 -1.26 -4.66 135.00 135.36 2ies s PRO 102 Ca 0.60 2.54 0.14 0.00 0.02 0.00 0.00 61.00 64.30 2ies s PRO 102 Cb -0.45 -2.84 0.15 0.00 0.02 0.00 0.00 34.50 31.37 2ies s PRO 102 CO 0.49 -0.68 1.48 0.97 -0.33 0.00 0.00 177.00 178.93 2ies h ILE 103 N 2.70 1.07 0.00 2.83 6.09 -1.72 -3.49 117.51 125.00 2ies h ILE 103 Ca -0.51 -2.33 0.00 0.00 -1.37 0.00 0.00 64.86 60.65 2ies h ILE 103 Cb 1.25 2.40 0.00 0.00 0.47 0.00 0.00 36.82 40.94 2ies h ILE 103 CO 0.63 0.57 0.00 0.18 -3.07 0.00 0.00 178.15 176.46 2ies n LEU 104 N -3.34 0.00 -0.22 2.19 4.77 -1.26 -1.08 117.00 118.07 2ies n LEU 104 Ca 0.01 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.06 2ies n LEU 104 Cb 0.73 0.00 0.32 0.00 -2.33 0.00 0.00 43.42 42.14 2ies n LEU 104 CO 0.41 0.00 0.72 -0.90 -1.33 0.00 0.00 177.39 176.29 2ies n ASP 105 N 3.07 0.64 0.00 -1.43 5.75 -1.26 -4.63 116.55 118.68 2ies n ASP 105 Ca 0.00 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.07 2ies n ASP 105 Cb 0.00 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 2ies n ASP 105 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ies n GLY 106 N 0.83 0.76 0.89 6.12 0.00 -0.24 -4.61 105.19 108.95 2ies n GLY 106 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.05 2ies n GLY 106 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ies n SER 107 N 0.00 1.52 -1.31 1.61 3.41 -1.26 -1.00 113.62 116.59 2ies n SER 107 Ca 0.00 -1.57 0.10 0.00 -0.26 0.00 0.00 58.87 57.15 2ies n SER 107 Cb 0.00 0.20 0.31 0.00 -0.26 0.00 0.00 64.21 64.46 2ies n SER 107 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ies n GLY 108 N 2.25 2.62 0.37 5.00 0.00 -0.84 -4.63 105.19 109.96 2ies n GLY 108 Ca -0.03 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 2ies n GLY 108 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2ies h TRP 109 N 3.92 -1.01 -0.56 1.61 2.91 -0.57 -1.21 115.95 121.04 2ies h TRP 109 Ca 0.00 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.08 2ies h TRP 109 Cb 1.07 0.43 -0.04 0.00 -0.51 0.00 0.00 29.16 30.11 2ies h TRP 109 CO 0.52 -0.46 0.32 1.49 -1.03 0.00 0.00 178.44 179.28 2ies h GLU 110 N -0.57 0.61 0.70 2.65 4.81 -1.87 -1.42 114.58 119.50 2ies h GLU 110 Ca 0.04 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2ies h GLU 110 Cb 0.62 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.87 2ies h GLU 110 CO -0.24 0.41 -0.33 0.74 -0.73 0.00 0.00 179.01 178.85 2ies h PHE 111 N 0.63 -0.87 -0.37 0.92 -1.00 -1.85 -2.59 116.94 111.81 2ies h PHE 111 Ca 0.23 -0.02 0.04 0.00 2.81 0.00 0.00 57.97 61.03 2ies h PHE 111 Cb 0.07 0.29 -0.06 0.00 3.61 0.00 0.00 35.95 39.85 2ies h PHE 111 CO -0.07 -0.53 -0.41 -0.92 -1.61 0.00 0.00 178.31 174.76 2ies h TYR 112 N -0.96 -1.27 -1.02 -0.55 3.20 -0.99 0.32 116.97 115.70 2ies h TYR 112 Ca -0.10 0.07 0.25 0.00 3.14 0.00 0.00 58.73 62.09 2ies h TYR 112 Cb 0.72 0.60 -0.10 0.00 1.54 0.00 0.00 36.73 39.50 2ies h TYR 112 CO -0.02 -0.34 0.64 1.49 -1.64 0.00 0.00 178.16 178.29 2ies h GLU 113 N -0.24 0.46 0.16 1.82 4.22 -1.28 0.69 114.58 120.40 2ies h GLU 113 Ca 0.06 -0.03 -0.33 0.00 0.08 0.00 0.00 59.36 59.15 2ies h GLU 113 Cb 0.41 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2ies h GLU 113 CO -0.48 0.30 -1.65 0.00 -2.18 0.00 0.00 179.01 175.01 2ies h ALA 114 N 1.64 0.20 -0.26 2.92 0.00 -0.76 -3.35 119.26 119.65 2ies h ALA 114 Ca 0.59 -1.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.25 2ies h ALA 114 Cb 1.36 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 2ies h ALA 114 CO -0.33 1.07 -0.35 0.82 0.00 0.00 0.00 179.25 180.45 2ies h ILE 115 N 0.09 1.31 -0.87 0.00 1.08 0.12 -3.24 117.51 116.00 2ies h ILE 115 Ca -0.30 -1.55 0.19 0.00 -0.39 0.00 0.00 64.86 62.82 2ies h ILE 115 Cb 2.07 1.68 -0.11 0.00 -3.07 0.00 0.00 36.82 37.38 2ies h ILE 115 CO 0.17 0.49 0.40 -0.09 -0.69 0.00 0.00 178.15 178.43 2ies h ARG 116 N 0.43 0.45 0.35 2.37 2.43 -1.04 -2.42 114.38 116.96 2ies h ARG 116 Ca 0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2ies h ARG 116 Cb 0.94 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 2ies h ARG 116 CO 0.08 0.30 -0.27 0.87 -1.51 0.00 0.00 179.97 179.44 2ies h LYS 117 N 0.47 -0.58 -2.26 0.20 1.57 -1.68 -3.28 116.57 111.01 2ies h LYS 117 Ca 0.52 0.04 -0.31 0.00 -1.87 0.00 0.00 60.65 59.03 2ies h LYS 117 Cb 0.91 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.31 2ies h LYS 117 CO -0.47 -0.39 0.70 0.09 -0.57 0.00 0.00 179.45 178.81 2ies n ASN 118 N -4.00 6.15 -4.83 0.86 3.02 -0.91 -4.92 115.26 110.62 2ies n ASN 118 Ca -0.07 -2.50 -0.37 0.00 -0.03 0.00 0.00 54.58 51.60 2ies n ASN 118 Cb 0.26 -1.46 -0.06 0.00 -0.61 0.00 0.00 39.78 37.92 2ies n ASN 118 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2ies s ILE 120 N 1.30 4.87 -0.21 2.41 1.01 -1.22 -0.69 121.20 128.67 2ies s ILE 120 Ca 0.68 0.96 -0.02 0.00 0.00 0.00 0.00 60.65 62.27 2ies s ILE 120 Cb 0.28 -3.79 0.06 0.00 0.01 0.00 0.00 42.46 39.03 2ies s ILE 120 CO -0.02 0.45 0.00 -0.22 0.00 0.00 0.00 174.94 175.16 2ies s LEU 121 N -1.40 1.66 0.70 2.97 2.96 0.25 -4.62 118.68 121.21 2ies s LEU 121 Ca 0.30 -0.94 -0.16 0.00 -0.22 0.00 0.00 54.13 53.12 2ies s LEU 121 Cb -0.17 -0.80 0.02 0.00 0.50 0.00 0.00 46.19 45.74 2ies s LEU 121 CO 0.17 -0.28 1.21 0.20 -1.32 0.00 0.00 176.35 176.34 2ies s ASN 122 N 1.69 4.38 0.05 3.68 0.02 -1.26 -2.57 114.94 120.93 2ies s ASN 122 Ca -0.03 2.37 0.00 0.00 -1.02 0.00 0.00 52.86 54.18 2ies s ASN 122 Cb -0.18 -2.59 -0.03 0.00 0.02 0.00 0.00 41.25 38.47 2ies s ASN 122 CO -0.07 -2.14 -0.04 -1.10 0.02 0.00 0.00 177.10 173.77 2ies s GLN 123 N -3.81 0.54 -1.31 -0.60 -0.21 -1.00 -4.94 119.66 108.33 2ies s GLN 123 Ca 0.75 -0.97 -0.15 0.00 0.02 0.00 0.00 55.36 55.01 2ies s GLN 123 Cb -0.30 0.03 0.10 0.00 1.00 0.00 0.00 33.01 33.84 2ies s GLN 123 CO 0.43 -0.05 1.78 0.27 -2.12 0.00 0.00 175.29 175.61 2ies n ASN 124 N 0.78 4.81 -3.18 5.90 6.94 -1.26 -4.29 115.26 124.96 2ies n ASN 124 Ca -0.18 -2.94 0.05 0.00 -0.02 0.00 0.00 54.58 51.49 2ies n ASN 124 Cb 0.58 -1.66 -0.02 0.00 -2.36 0.00 0.00 39.78 36.32 2ies n ASN 124 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2ies s ARG 125 N 3.00 0.16 -0.01 -3.83 3.52 -1.26 -5.03 118.95 115.50 2ies s ARG 125 Ca 0.48 0.31 -0.30 0.00 -0.13 0.00 0.00 55.73 56.10 2ies s ARG 125 Cb 0.05 0.18 -0.07 0.00 -1.56 0.00 0.00 34.95 33.55 2ies s ARG 125 CO 0.02 -0.15 1.70 -2.00 -0.81 0.00 0.00 175.30 174.05 2ies s GLU 126 N 2.83 4.18 0.24 5.12 2.56 -1.26 0.15 118.70 132.51 2ies s GLU 126 Ca -0.02 2.28 -0.31 0.00 0.00 0.00 0.00 54.97 56.92 2ies s GLU 126 Cb -0.09 -3.91 -0.13 0.00 2.00 0.00 0.00 34.13 31.99 2ies s GLU 126 CO -0.12 -0.83 1.41 -0.89 -0.56 0.00 0.00 175.26 174.28 2ies n ILE 127 N 5.29 0.91 -3.25 -3.70 5.41 0.35 -4.79 119.36 119.58 2ies n ILE 127 Ca 0.17 -0.23 -0.45 0.00 1.00 0.00 0.00 62.75 63.24 2ies n ILE 127 Cb 0.42 -1.48 -0.01 0.00 -0.71 0.00 0.00 39.64 37.87 2ies n ILE 127 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2ies s ASP 128 N 0.32 7.12 0.89 4.38 -1.08 -1.26 -4.79 116.67 122.24 2ies s ASP 128 Ca 0.69 -3.20 -0.12 0.00 -0.52 0.00 0.00 52.55 49.39 2ies s ASP 128 Cb -0.65 -2.25 0.09 0.00 -1.46 0.00 0.00 42.92 38.65 2ies s ASP 128 CO 0.49 -0.47 0.93 -1.22 0.52 0.00 0.00 175.17 175.42 2ies n TYR 129 N 3.68 0.25 -3.29 -5.34 4.02 -1.26 -4.83 117.16 110.38 2ies n TYR 129 Ca 0.23 0.35 -0.44 0.00 -0.01 0.00 0.00 57.90 58.04 2ies n TYR 129 Cb 0.42 -1.96 -0.07 0.00 -0.02 0.00 0.00 39.34 37.71 2ies n TYR 129 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 2ies s PHE 130 N -2.40 3.17 -0.07 -0.72 5.36 -0.28 -5.01 117.98 118.03 2ies s PHE 130 Ca 0.66 -0.80 -0.18 0.00 -0.96 0.00 0.00 56.93 55.64 2ies s PHE 130 Cb -0.25 -3.36 -0.05 0.00 -0.34 0.00 0.00 43.02 39.03 2ies s PHE 130 CO 0.59 -0.91 0.49 0.08 -1.46 0.00 0.00 175.22 174.01 2ies s VAL 131 N 2.03 5.09 -0.36 3.12 1.01 -1.26 -2.09 120.40 127.93 2ies s VAL 131 Ca 0.08 1.00 -0.28 0.00 0.00 0.00 0.00 61.98 62.78 2ies s VAL 131 Cb -0.23 -3.82 0.02 0.00 0.00 0.00 0.00 36.38 32.35 2ies s VAL 131 CO 0.08 0.40 1.05 -0.69 0.00 0.00 0.00 175.10 175.94 2ies s VAL 132 N 0.09 4.47 -0.03 2.92 1.01 -0.99 -4.90 120.40 122.97 2ies s VAL 132 Ca 0.27 1.50 0.12 0.00 0.00 0.00 0.00 61.98 63.87 2ies s VAL 132 Cb -0.16 -4.43 -0.14 0.00 0.00 0.00 0.00 36.38 31.65 2ies s VAL 132 CO 0.12 -0.60 1.10 -0.33 0.00 0.00 0.00 175.10 175.39 2ies h GLU 133 N 8.41 0.00 -1.87 2.72 5.08 -1.93 -3.36 114.58 123.63 2ies h GLU 133 Ca -0.22 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 2ies h GLU 133 Cb 1.06 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.11 2ies h GLU 133 CO 1.04 0.63 0.32 -1.83 -1.00 0.00 0.00 179.01 178.18 2ies s GLU 134 N -2.79 0.89 0.26 2.33 4.04 -1.26 -4.80 118.70 117.38 2ies s GLU 134 Ca -0.00 0.19 -0.12 0.00 0.04 0.00 0.00 54.97 55.08 2ies s GLU 134 Cb 0.09 0.42 -0.09 0.00 0.02 0.00 0.00 34.13 34.57 2ies s GLU 134 CO 0.80 -0.28 -0.00 -2.30 -1.84 0.00 0.00 175.26 171.63 2ies n PRO 135 N 0.79 0.00 -3.59 -4.83 -0.02 -1.26 -4.76 135.00 121.33 2ies n PRO 135 Ca -0.16 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.20 2ies n PRO 135 Cb 0.58 -0.59 -0.06 0.00 -0.02 0.00 0.00 33.50 33.40 2ies n PRO 135 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 2ies s ILE 136 N -1.08 0.00 0.03 4.25 2.07 -0.32 -4.98 121.20 121.18 2ies s ILE 136 Ca 0.35 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.59 2ies s ILE 136 Cb -0.34 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.22 2ies s ILE 136 CO 0.38 0.00 -0.05 -0.63 -1.91 0.00 0.00 174.94 172.73 2ies s ILE 137 N -0.56 0.30 -0.05 2.00 1.01 -1.26 -0.92 121.20 121.71 2ies s ILE 137 Ca -0.02 -1.09 -0.03 0.00 0.00 0.00 0.00 60.65 59.51 2ies s ILE 137 Cb -0.02 -0.55 0.03 0.00 0.01 0.00 0.00 42.46 41.92 2ies s ILE 137 CO 0.01 -0.52 0.13 0.68 0.00 0.00 0.00 174.94 175.24 2ies s VAL 138 N -1.73 -0.03 0.54 2.92 -7.23 -0.53 -5.01 120.40 109.33 2ies s VAL 138 Ca -0.11 0.12 0.02 0.00 -1.81 0.00 0.00 61.98 60.20 2ies s VAL 138 Cb -0.08 -0.20 0.01 0.00 0.56 0.00 0.00 36.38 36.67 2ies s VAL 138 CO -0.01 0.05 0.13 -1.61 -0.31 0.00 0.00 175.10 173.34 2ies s GLU 139 N 0.77 2.23 0.00 4.82 2.02 -1.26 -1.30 118.70 125.97 2ies s GLU 139 Ca -0.06 -2.33 0.00 0.00 0.02 0.00 0.00 54.97 52.60 2ies s GLU 139 Cb -0.08 -1.69 0.00 0.00 0.10 0.00 0.00 34.13 32.46 2ies s GLU 139 CO -0.04 -0.49 0.00 -3.47 0.02 0.00 0.00 175.26 171.29 2ies n ASP 140 N -1.46 0.00 -2.80 -0.19 -0.08 -0.43 -4.93 116.55 106.66 2ies n ASP 140 Ca -0.15 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.12 2ies n ASP 140 Cb 0.66 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.12 2ies n ASP 140 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2ies n GLU 141 N 0.00 -3.03 0.00 -0.67 -0.58 -1.26 -3.47 120.64 111.63 2ies n GLU 141 Ca 0.00 2.50 0.00 0.00 -0.42 0.00 0.00 57.16 59.24 2ies n GLU 141 Cb 0.00 -4.84 0.00 0.00 -0.57 0.00 0.00 31.44 26.03 2ies n GLU 141 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ies n GLY 142 N 0.70 0.90 3.73 0.62 0.00 -1.26 -4.90 105.19 104.98 2ies n GLY 142 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2ies n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ies s ARG 143 N 0.00 4.37 -0.07 1.61 0.52 -1.23 -4.92 118.95 119.23 2ies s ARG 143 Ca 0.00 2.03 -0.13 0.00 -0.52 0.00 0.00 55.73 57.12 2ies s ARG 143 Cb 0.00 -3.23 0.03 0.00 0.52 0.00 0.00 34.95 32.27 2ies s ARG 143 CO 0.00 -0.32 0.31 -1.17 0.02 0.00 0.00 175.30 174.14 2ies s LEU 144 N 0.45 0.83 -0.03 2.53 0.20 -0.98 -1.32 118.68 120.37 2ies s LEU 144 Ca 0.60 0.39 0.03 0.00 0.69 0.00 0.00 54.13 55.83 2ies s LEU 144 Cb -0.36 1.16 0.00 0.00 -0.43 0.00 0.00 46.19 46.56 2ies s LEU 144 CO 0.34 -0.26 -0.10 -0.63 -0.29 0.00 0.00 176.35 175.41 2ies s ILE 145 N -0.50 0.90 -0.09 6.68 1.01 -0.42 -0.20 121.20 128.58 2ies s ILE 145 Ca -0.06 -0.42 0.04 0.00 0.00 0.00 0.00 60.65 60.21 2ies s ILE 145 Cb -0.04 -0.80 0.00 0.00 0.01 0.00 0.00 42.46 41.64 2ies s ILE 145 CO 0.02 0.28 -0.21 -0.75 0.00 0.00 0.00 174.94 174.28 2ies s LYS 146 N 0.20 2.64 -0.07 2.79 2.20 0.24 -1.45 119.74 126.29 2ies s LYS 146 Ca -0.04 -0.75 0.00 0.00 -0.36 0.00 0.00 55.97 54.82 2ies s LYS 146 Cb -0.09 -2.04 0.02 0.00 -1.51 0.00 0.00 37.83 34.21 2ies s LYS 146 CO 0.01 0.15 -0.04 0.00 -0.36 0.00 0.00 175.35 175.11 2ies s ALA 147 N 0.38 0.83 0.37 3.13 0.00 -0.10 0.77 121.76 127.15 2ies s ALA 147 Ca -0.17 -0.19 0.04 0.00 0.00 0.00 0.00 51.96 51.65 2ies s ALA 147 Cb -0.17 -0.63 -0.05 0.00 0.00 0.00 0.00 23.12 22.27 2ies s ALA 147 CO 0.07 -0.23 0.06 -1.83 0.00 0.00 0.00 175.76 173.83 2ies s GLU 148 N 1.39 1.80 0.39 0.00 -1.05 -0.30 -1.17 118.70 119.77 2ies s GLU 148 Ca -0.03 -2.04 -0.26 0.00 -0.15 0.00 0.00 54.97 52.49 2ies s GLU 148 Cb -0.13 -1.00 -0.09 0.00 -0.44 0.00 0.00 34.13 32.47 2ies s GLU 148 CO -0.03 -0.23 1.25 -2.14 0.95 0.00 0.00 175.26 175.05 2ies s PRO 149 N -3.83 4.05 -0.27 -4.83 0.02 -1.26 -0.62 135.00 128.26 2ies s PRO 149 Ca 0.31 2.03 -0.24 0.00 0.02 0.00 0.00 61.00 63.12 2ies s PRO 149 Cb 0.07 -2.76 0.07 0.00 0.02 0.00 0.00 34.50 31.90 2ies s PRO 149 CO 0.15 -0.38 0.71 0.45 -0.33 0.00 0.00 177.00 177.60 2ies s SER 150 N -0.87 -0.77 0.50 2.53 0.15 -1.26 -4.48 113.70 109.49 2ies s SER 150 Ca 0.56 1.45 0.18 0.00 0.70 0.00 0.00 55.95 58.84 2ies s SER 150 Cb -0.35 1.46 1.22 0.00 -1.71 0.00 0.00 66.02 66.64 2ies s SER 150 CO 0.45 -0.25 2.05 -0.78 1.20 0.00 0.00 173.24 175.92 2ies h ASP 151 N 5.21 0.12 -4.22 5.45 3.58 -1.93 -3.31 116.42 121.32 2ies h ASP 151 Ca -0.29 0.00 -0.41 0.00 0.42 0.00 0.00 57.03 56.75 2ies h ASP 151 Cb 1.17 -0.03 -0.08 0.00 1.72 0.00 0.00 39.33 42.11 2ies h ASP 151 CO 0.06 0.08 -0.31 0.35 -2.88 0.00 0.00 179.24 176.54 2ies n THR 152 N -4.47 0.00 -3.54 2.25 -2.24 -1.26 -4.95 114.28 100.07 2ies n THR 152 Ca 0.05 -1.57 -0.38 0.00 -2.27 0.00 0.00 64.05 59.88 2ies n THR 152 Cb 0.32 0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 68.87 2ies n THR 152 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2ies s LEU 153 N 0.00 4.06 -0.07 3.22 2.96 -1.26 -2.41 118.68 125.19 2ies s LEU 153 Ca 0.05 0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 54.08 2ies s LEU 153 Cb 0.00 -2.23 0.04 0.00 0.50 0.00 0.00 46.19 44.51 2ies s LEU 153 CO 0.04 -0.05 0.11 -0.70 -1.32 0.00 0.00 176.35 174.43 2ies s GLU 154 N 1.59 -0.02 -0.05 1.98 2.12 -0.55 -2.91 118.70 120.86 2ies s GLU 154 Ca 0.10 0.46 0.02 0.00 0.36 0.00 0.00 54.97 55.91 2ies s GLU 154 Cb -0.15 -0.42 0.02 0.00 0.26 0.00 0.00 34.13 33.83 2ies s GLU 154 CO 0.09 -0.33 -0.08 0.08 -0.54 0.00 0.00 175.26 174.47 2ies s VAL 155 N 2.23 0.82 -0.02 3.70 1.01 -0.27 -0.06 120.40 127.81 2ies s VAL 155 Ca 0.04 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 61.78 2ies s VAL 155 Cb -0.12 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.46 2ies s VAL 155 CO -0.05 0.28 -0.23 -0.89 0.00 0.00 0.00 175.10 174.22 2ies s THR 156 N 0.72 1.81 -0.06 3.92 2.01 0.18 0.41 115.64 124.63 2ies s THR 156 Ca -0.12 -0.97 0.03 0.00 0.31 0.00 0.00 61.69 60.94 2ies s THR 156 Cb -0.15 -1.51 0.01 0.00 0.01 0.00 0.00 72.50 70.86 2ies s THR 156 CO 0.02 0.51 -0.16 -0.47 -0.69 0.00 0.00 174.62 173.83 2ies s TYR 157 N -0.44 1.69 -0.09 4.92 5.04 -0.56 -0.79 117.35 127.13 2ies s TYR 157 Ca 0.06 -0.59 0.04 0.00 -2.44 0.00 0.00 57.07 54.15 2ies s TYR 157 Cb -0.10 -1.18 -0.00 0.00 0.35 0.00 0.00 41.96 41.03 2ies s TYR 157 CO -0.00 -0.25 -0.23 -2.00 -1.34 0.00 0.00 175.55 171.72 2ies s GLU 158 N 0.39 2.83 0.17 4.97 2.12 0.15 -1.62 118.70 127.70 2ies s GLU 158 Ca -0.11 -0.85 0.07 0.00 0.36 0.00 0.00 54.97 54.44 2ies s GLU 158 Cb -0.14 -2.20 -0.04 0.00 0.26 0.00 0.00 34.13 32.01 2ies s GLU 158 CO 0.04 0.21 0.01 0.20 -0.54 0.00 0.00 175.26 175.18 2ies s GLY 159 N 0.25 1.74 -0.49 -1.50 0.00 0.56 -1.51 107.32 106.37 2ies s GLY 159 Ca -0.15 -1.34 0.08 0.00 0.00 0.00 0.00 44.72 43.31 2ies s GLY 159 CO 0.07 -1.35 0.83 -2.21 0.00 0.00 0.00 173.10 170.44 2ies n GLU 160 N -0.09 2.15 -1.84 2.90 2.13 -1.26 -2.76 120.64 121.88 2ies n GLU 160 Ca -0.10 -4.17 -0.42 0.00 0.66 0.00 0.00 57.16 53.14 2ies n GLU 160 Cb 0.55 -1.98 -0.03 0.00 0.27 0.00 0.00 31.44 30.26 2ies n GLU 160 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2ies s PHE 161 N -2.90 2.93 0.17 4.31 0.40 0.03 -4.92 117.98 118.00 2ies s PHE 161 Ca 0.44 0.64 0.31 0.00 -0.60 0.00 0.00 56.93 57.72 2ies s PHE 161 Cb 0.30 -4.01 1.29 0.00 0.51 0.00 0.00 43.02 41.10 2ies s PHE 161 CO -0.11 -3.63 1.96 0.87 0.70 0.00 0.00 175.22 175.02 2ies h LYS 162 N 6.03 0.00 0.00 0.44 1.57 -1.99 -3.22 116.57 119.40 2ies h LYS 162 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2ies h LYS 162 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2ies h LYS 162 CO 0.88 0.08 0.00 0.27 -0.57 0.00 0.00 179.45 180.11 2ies n ASN 163 N -3.24 0.00 0.31 0.86 6.94 -1.26 -4.92 115.26 113.94 2ies n ASN 163 Ca 0.00 -0.73 0.10 0.00 -0.02 0.00 0.00 54.58 53.93 2ies n ASN 163 Cb 0.33 0.00 0.53 0.00 -2.36 0.00 0.00 39.78 38.28 2ies n ASN 163 CO 0.00 0.00 0.00 2.19 -1.03 0.00 0.00 177.26 178.42 2ies h PHE 167 N -0.17 0.00 -0.22 -2.53 -5.15 -1.77 -2.15 116.94 104.95 2ies h PHE 167 Ca 0.00 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.77 2ies h PHE 167 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.16 2ies h PHE 167 CO 0.00 0.00 0.14 -0.07 -2.00 0.00 0.00 178.31 176.38 2ies h LEU 168 N 0.00 0.26 0.00 2.10 3.38 -1.90 -3.48 115.31 115.68 2ies h LEU 168 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2ies h LEU 168 Cb 1.01 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2ies h LEU 168 CO 0.00 0.22 0.00 0.61 0.09 0.00 0.00 178.44 179.36 2ies n GLY 169 N -1.07 0.36 3.31 0.83 0.00 -0.81 -4.64 105.19 103.17 2ies n GLY 169 Ca -0.03 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 2ies n GLY 169 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ies s ARG 170 N 0.00 2.68 0.06 1.61 0.52 -1.26 -0.79 118.95 121.78 2ies s ARG 170 Ca 0.00 -1.32 0.01 0.00 -0.52 0.00 0.00 55.73 53.90 2ies s ARG 170 Cb 0.00 -3.75 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 2ies s ARG 170 CO 0.00 -0.85 -0.05 1.14 0.02 0.00 0.00 175.30 175.55 2ies s GLN 171 N 1.47 0.64 0.05 3.54 -2.07 -1.11 -4.97 119.66 117.20 2ies s GLN 171 Ca 0.02 -1.10 -0.09 0.00 -1.82 0.00 0.00 55.36 52.37 2ies s GLN 171 Cb -0.22 -0.06 0.00 0.00 -1.09 0.00 0.00 33.01 31.65 2ies s GLN 171 CO 0.04 -0.04 0.19 -1.59 -1.32 0.00 0.00 175.29 172.57 2ies s LYS 172 N -3.13 0.71 0.11 9.60 -2.85 -1.26 -0.32 119.74 122.60 2ies s LYS 172 Ca 0.03 -0.68 0.05 0.00 -1.00 0.00 0.00 55.97 54.37 2ies s LYS 172 Cb 0.01 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 36.04 2ies s LYS 172 CO -0.05 -0.21 -0.11 0.12 0.10 0.00 0.00 175.35 175.20 2ies s PHE 173 N -2.73 1.21 -0.06 1.78 5.36 -0.64 -4.99 117.98 117.91 2ies s PHE 173 Ca -0.04 -0.63 0.00 0.00 -0.96 0.00 0.00 56.93 55.30 2ies s PHE 173 Cb -0.00 -0.64 0.02 0.00 -0.34 0.00 0.00 43.02 42.06 2ies s PHE 173 CO -0.05 0.06 -0.03 0.99 -1.46 0.00 0.00 175.22 174.73 2ies s THR 174 N -2.45 0.52 -0.13 0.12 2.01 -1.26 -1.50 115.64 112.95 2ies s THR 174 Ca 0.08 -0.05 -0.07 0.00 0.31 0.00 0.00 61.69 61.96 2ies s THR 174 Cb -0.03 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.85 2ies s THR 174 CO 0.01 0.25 0.12 0.12 -0.69 0.00 0.00 174.62 174.43 2ies s PHE 175 N 1.36 3.51 0.05 4.92 5.36 0.17 -4.96 117.98 128.38 2ies s PHE 175 Ca -0.04 0.44 0.03 0.00 -0.96 0.00 0.00 56.93 56.39 2ies s PHE 175 Cb -0.13 -1.97 -0.03 0.00 -0.34 0.00 0.00 43.02 40.55 2ies s PHE 175 CO -0.02 0.61 -0.09 0.14 -1.46 0.00 0.00 175.22 174.40 2ies s VAL 179 N -0.72 0.63 0.15 3.12 -7.23 -1.26 -1.12 120.40 113.97 2ies s VAL 179 Ca 0.13 -1.16 -0.34 0.00 -1.81 0.00 0.00 61.98 58.81 2ies s VAL 179 Cb -0.12 -0.73 -0.16 0.00 0.56 0.00 0.00 36.38 35.94 2ies s VAL 179 CO 0.03 -0.39 1.26 -0.62 -0.31 0.00 0.00 175.10 175.07 2ies n GLU 180 N 1.36 1.29 0.00 4.82 1.02 -1.14 -1.66 120.64 126.32 2ies n GLU 180 Ca -0.22 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2ies n GLU 180 Cb 0.55 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 2ies n GLU 180 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ies n GLY 181 N 2.25 0.53 1.27 0.62 0.00 -1.26 -4.95 105.19 103.65 2ies n GLY 181 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 2ies n GLY 181 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ies n ASN 182 N 0.00 3.07 -0.03 1.61 4.13 -0.66 -4.83 115.26 118.55 2ies n ASN 182 Ca 0.00 -3.77 -0.12 0.00 1.68 0.00 0.00 54.58 52.38 2ies n ASN 182 Cb 0.00 -0.44 -0.06 0.00 -1.54 0.00 0.00 39.78 37.74 2ies n ASN 182 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 2ies h GLU 183 N 1.53 0.18 0.00 3.52 3.07 -1.93 -2.55 114.58 118.40 2ies h GLU 183 Ca 0.15 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 2ies h GLU 183 Cb 1.26 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 2ies h GLU 183 CO 0.33 0.33 0.03 0.39 -1.40 0.00 0.00 179.01 178.70 2ies n GLU 184 N -4.87 0.00 0.02 2.33 1.02 -1.26 -0.90 120.64 116.98 2ies n GLU 184 Ca -0.06 0.23 0.12 0.00 -0.02 0.00 0.00 57.16 57.43 2ies n GLU 184 Cb 0.14 -1.53 0.18 0.00 -0.02 0.00 0.00 31.44 30.21 2ies n GLU 184 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2ies n GLU 185 N -1.20 0.14 0.00 3.49 2.13 -0.96 -4.41 120.64 119.83 2ies n GLU 185 Ca 0.00 0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.85 2ies n GLU 185 Cb 0.03 -1.58 0.00 0.00 0.27 0.00 0.00 31.44 30.17 2ies n GLU 185 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2ies n ILE 186 N -1.77 0.00 1.22 6.31 -5.35 -0.08 -4.72 119.36 114.96 2ies n ILE 186 Ca 0.04 -0.18 0.12 0.00 -0.27 0.00 0.00 62.75 62.46 2ies n ILE 186 Cb 0.39 0.90 0.62 0.00 -1.74 0.00 0.00 39.64 39.81 2ies n ILE 186 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 2ies n VAL 187 N -0.43 0.19 0.67 7.28 0.24 -0.91 -2.85 118.33 122.53 2ies n VAL 187 Ca 0.00 0.05 0.07 0.00 -2.04 0.00 0.00 64.34 62.42 2ies n VAL 187 Cb 0.00 -0.67 -0.08 0.00 -1.47 0.00 0.00 33.84 31.63 2ies n VAL 187 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2ies n LEU 188 N -1.20 0.71 -4.71 1.34 4.77 -1.26 0.24 117.00 116.88 2ies n LEU 188 Ca 0.13 -0.51 -0.42 0.00 -0.03 0.00 0.00 56.01 55.18 2ies n LEU 188 Cb 0.15 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2ies n LEU 188 CO 0.16 0.17 0.94 0.00 -1.33 0.00 0.00 177.39 177.34 2ies s ALA 189 N -2.32 3.45 0.79 -1.18 0.00 -1.13 -4.84 121.76 116.53 2ies s ALA 189 Ca 0.06 0.92 -0.08 0.00 0.00 0.00 0.00 51.96 52.86 2ies s ALA 189 Cb 0.11 -3.47 0.12 0.00 0.00 0.00 0.00 23.12 19.88 2ies s ALA 189 CO 0.58 -0.49 1.11 1.03 0.00 0.00 0.00 175.76 177.99 2ies s ARG 190 N 1.10 1.54 0.29 0.00 0.52 -1.26 -4.28 118.95 116.86 2ies s ARG 190 Ca 0.60 -0.54 -0.20 0.00 -0.52 0.00 0.00 55.73 55.07 2ies s ARG 190 Cb -0.31 -2.11 -0.09 0.00 0.52 0.00 0.00 34.95 32.96 2ies s ARG 190 CO 0.29 -1.69 0.80 -0.08 0.02 0.00 0.00 175.30 174.65 2ies s THR 191 N -3.43 4.48 0.15 0.02 -1.32 -0.17 -4.63 115.64 110.74 2ies s THR 191 Ca 0.66 1.37 0.04 0.00 -1.21 0.00 0.00 61.69 62.56 2ies s THR 191 Cb -0.07 -3.82 -0.04 0.00 -1.51 0.00 0.00 72.50 67.06 2ies s THR 191 CO 0.47 0.06 -0.09 0.72 -2.21 0.00 0.00 174.62 173.57 2ies s PHE 192 N -1.71 1.23 -0.12 9.09 -0.12 -1.26 -0.41 117.98 124.70 2ies s PHE 192 Ca 0.49 -0.79 -0.23 0.00 -0.05 0.00 0.00 56.93 56.35 2ies s PHE 192 Cb -0.15 -0.64 0.05 0.00 -0.63 0.00 0.00 43.02 41.65 2ies s PHE 192 CO 0.20 0.04 0.56 0.00 -0.05 0.00 0.00 175.22 175.97 2ies s ALA 193 N -3.38 -1.42 0.50 1.99 0.00 -0.86 -4.92 121.76 113.68 2ies s ALA 193 Ca 0.17 1.26 -0.04 0.00 0.00 0.00 0.00 51.96 53.35 2ies s ALA 193 Cb 0.03 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 2ies s ALA 193 CO 0.00 -0.31 0.79 -0.06 0.00 0.00 0.00 175.76 176.19 2ies s PHE 194 N -0.55 3.42 0.25 0.00 0.40 -1.26 -0.59 117.98 119.65 2ies s PHE 194 Ca -0.07 0.66 -0.05 0.00 -0.60 0.00 0.00 56.93 56.88 2ies s PHE 194 Cb -0.03 -2.42 0.29 0.00 0.51 0.00 0.00 43.02 41.37 2ies s PHE 194 CO 0.05 -0.44 1.83 0.38 0.70 0.00 0.00 175.22 177.74 2ies h ASP 195 N 0.15 0.98 0.00 1.36 3.04 -0.85 -0.64 116.42 120.46 2ies h ASP 195 Ca -0.46 -0.13 0.00 0.00 -3.24 0.00 0.00 57.03 53.19 2ies h ASP 195 Cb 1.23 -0.25 0.00 0.00 -1.04 0.00 0.00 39.33 39.26 2ies h ASP 195 CO 0.61 0.86 0.00 -2.67 -2.04 0.00 0.00 179.24 175.99 2ies n TRP 196 N -4.30 0.00 -2.58 4.15 2.14 -1.26 -2.17 117.44 113.41 2ies n TRP 196 Ca 0.07 0.00 -0.12 0.00 2.07 0.00 0.00 57.50 59.52 2ies n TRP 196 Cb 0.16 -0.07 0.03 0.00 -0.81 0.00 0.00 31.31 30.62 2ies n TRP 196 CO 0.00 0.00 0.00 -1.91 2.07 0.00 0.00 177.69 177.85 2ies n GLU 197 N 0.08 2.10 0.00 -2.67 2.13 -0.25 -4.96 120.64 117.07 2ies n GLU 197 Ca 0.00 -3.70 0.00 0.00 0.66 0.00 0.00 57.16 54.12 2ies n GLU 197 Cb 0.18 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.21 2ies n GLU 197 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2ies n ILE 198 N -0.38 0.00 0.19 6.31 2.08 -0.92 -4.37 119.36 122.28 2ies n ILE 198 Ca 0.19 0.00 -0.13 0.00 0.56 0.00 0.00 62.75 63.37 2ies n ILE 198 Cb 0.80 -0.09 -0.07 0.00 -0.75 0.00 0.00 39.64 39.53 2ies n ILE 198 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2ies h GLU 199 N 0.00 -0.69 -0.77 0.38 4.81 -1.93 -1.21 114.58 115.17 2ies h GLU 199 Ca 0.00 0.05 0.13 0.00 -0.13 0.00 0.00 59.36 59.40 2ies h GLU 199 Cb 0.00 0.16 -0.13 0.00 0.63 0.00 0.00 28.75 29.40 2ies h GLU 199 CO 0.00 -0.46 -0.36 1.25 -0.73 0.00 0.00 179.01 178.71 2ies h HIS 200 N -0.71 -1.02 -0.58 0.92 2.76 -1.93 -0.33 115.15 114.26 2ies h HIS 200 Ca -0.04 0.09 0.08 0.00 -2.20 0.00 0.00 60.37 58.30 2ies h HIS 200 Cb 0.63 0.56 -0.07 0.00 1.55 0.00 0.00 27.41 30.09 2ies h HIS 200 CO -0.24 -0.39 0.23 0.82 -1.30 0.00 0.00 177.93 177.04 2ies h ILE 201 N -0.09 0.81 -0.13 6.26 2.04 -1.80 -1.07 117.51 123.53 2ies h ILE 201 Ca 0.28 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.90 2ies h ILE 201 Cb 0.57 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 2ies h ILE 201 CO -0.82 0.08 -0.34 0.11 0.00 0.00 0.00 178.15 177.17 2ies h LYS 202 N 0.42 0.27 -0.10 2.37 1.79 -0.07 -1.59 116.57 119.66 2ies h LYS 202 Ca 0.29 -0.11 -0.16 0.00 -2.18 0.00 0.00 60.65 58.49 2ies h LYS 202 Cb 0.32 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 2ies h LYS 202 CO -0.27 0.58 -0.62 -0.22 -1.08 0.00 0.00 179.45 177.85 2ies h LYS 203 N 0.23 0.37 -0.89 3.15 1.63 -0.10 -2.72 116.57 118.23 2ies h LYS 203 Ca 0.03 -0.26 -0.10 0.00 -0.85 0.00 0.00 60.65 59.47 2ies h LYS 203 Cb 0.72 0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 32.33 2ies h LYS 203 CO 0.05 0.87 0.13 1.33 -3.45 0.00 0.00 179.45 178.39 2ies n VAL 204 N -3.89 1.59 -3.08 2.00 0.24 -0.50 -4.89 118.33 109.80 2ies n VAL 204 Ca -0.03 -0.74 -0.13 0.00 -2.04 0.00 0.00 64.34 61.39 2ies n VAL 204 Cb 0.63 -0.56 0.07 0.00 -1.47 0.00 0.00 33.84 32.51 2ies n VAL 204 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ies n GLY 205 N 0.05 -0.50 3.38 7.63 0.00 -1.03 -5.06 105.19 109.67 2ies n GLY 205 Ca 0.19 0.20 -0.10 0.00 0.00 0.00 0.00 46.02 46.31 2ies n GLY 205 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ies s LEU 206 N -5.33 0.80 -1.47 0.99 1.43 -0.60 -4.91 118.68 109.59 2ies s LEU 206 Ca 0.18 -1.10 0.00 0.00 -1.03 0.00 0.00 54.13 52.17 2ies s LEU 206 Cb -0.02 1.08 0.00 0.00 0.03 0.00 0.00 46.19 47.28 2ies s LEU 206 CO 0.61 -0.97 0.00 0.61 0.23 0.00 0.00 176.35 176.83 2ies n GLY 207 N -0.30 1.42 0.32 -3.19 0.00 -1.15 -3.67 105.19 98.62 2ies n GLY 207 Ca -0.01 -0.37 0.17 0.00 0.00 0.00 0.00 46.02 45.81 2ies n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ies h LYS 208 N 0.00 0.00 0.00 1.61 1.57 0.66 -0.83 116.57 119.58 2ies h LYS 208 Ca -0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2ies h LYS 208 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.23 2ies h LYS 208 CO 0.42 0.00 -0.91 0.41 -0.57 0.00 0.00 179.45 178.79 2ies n GLY 209 N -1.34 -1.11 3.66 3.86 0.00 0.15 -4.47 105.19 105.95 2ies n GLY 209 Ca -0.00 -0.49 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 2ies n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ies n GLY 210 N 1.46 0.12 3.72 -0.02 0.00 -0.32 -4.80 105.19 105.35 2ies n GLY 210 Ca 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2ies n GLY 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ies s SER 211 N -1.04 -0.18 0.00 1.61 1.04 -1.26 -5.00 113.70 108.87 2ies s SER 211 Ca 0.72 -0.34 0.14 0.00 0.48 0.00 0.00 55.95 56.96 2ies s SER 211 Cb -0.44 0.44 0.59 0.00 0.10 0.00 0.00 66.02 66.71 2ies s SER 211 CO 0.49 -0.80 1.43 0.18 0.98 0.00 0.00 173.24 175.52 2ies n LEU 212 N -0.45 0.00 0.09 2.42 4.77 -1.26 0.55 117.00 123.12 2ies n LEU 212 Ca -0.07 0.49 0.04 0.00 -0.03 0.00 0.00 56.01 56.44 2ies n LEU 212 Cb 0.61 -0.49 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 2ies n LEU 212 CO 0.13 -0.26 0.07 0.11 -1.33 0.00 0.00 177.39 176.11 2ies h LYS 213 N 0.00 0.00 0.00 3.23 1.57 -1.96 -3.38 116.57 116.03 2ies h LYS 213 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ies h LYS 213 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2ies h LYS 213 CO 0.00 0.25 -1.11 0.27 -0.57 0.00 0.00 179.45 178.29 2ies n ASN 214 N -2.94 3.54 -4.23 0.86 0.23 -0.87 -4.76 115.26 107.10 2ies n ASN 214 Ca -0.03 -0.06 -0.23 0.00 -0.53 0.00 0.00 54.58 53.73 2ies n ASN 214 Cb 0.72 1.19 -0.13 0.00 -2.08 0.00 0.00 39.78 39.48 2ies n ASN 214 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2ies s THR 215 N -2.23 1.48 -0.39 5.53 2.01 0.19 -3.51 115.64 118.71 2ies s THR 215 Ca -0.01 -1.30 -0.10 0.00 0.31 0.00 0.00 61.69 60.58 2ies s THR 215 Cb 0.03 -1.33 0.05 0.00 0.01 0.00 0.00 72.50 71.26 2ies s THR 215 CO 0.19 -0.00 0.23 -0.22 -0.69 0.00 0.00 174.62 174.13 2ies s LEU 216 N -1.53 4.91 -0.20 4.42 0.20 0.46 -4.18 118.68 122.76 2ies s LEU 216 Ca 0.04 -1.21 -0.19 0.00 0.69 0.00 0.00 54.13 53.46 2ies s LEU 216 Cb -0.09 -2.01 -0.03 0.00 -0.43 0.00 0.00 46.19 43.63 2ies s LEU 216 CO 0.03 -0.46 0.56 -0.69 -0.29 0.00 0.00 176.35 175.50 2ies s VAL 217 N 1.50 5.08 -0.09 1.68 1.01 -1.26 -2.02 120.40 126.30 2ies s VAL 217 Ca 0.02 1.03 -0.01 0.00 0.00 0.00 0.00 61.98 63.02 2ies s VAL 217 Cb -0.21 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2ies s VAL 217 CO 0.05 0.16 -0.03 -0.76 0.00 0.00 0.00 175.10 174.52 2ies s LEU 218 N 1.69 3.38 0.00 3.92 1.43 0.25 -1.99 118.68 127.36 2ies s LEU 218 Ca 0.26 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 2ies s LEU 218 Cb -0.16 -1.77 0.09 0.00 0.03 0.00 0.00 46.19 44.39 2ies s LEU 218 CO 0.10 0.34 0.66 0.61 0.23 0.00 0.00 176.35 178.29 2ies n GLY 219 N 2.38 1.08 0.32 -3.19 0.00 0.17 -0.13 105.19 105.83 2ies n GLY 219 Ca -0.18 -2.07 0.21 0.00 0.00 0.00 0.00 46.02 43.98 2ies n GLY 219 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2ies h LYS 220 N 0.00 0.00 0.00 1.61 1.63 -1.99 -3.33 116.57 114.49 2ies h LYS 220 Ca -0.22 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.49 2ies h LYS 220 Cb 0.87 0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 32.41 2ies h LYS 220 CO 0.26 0.01 0.04 -0.40 -3.45 0.00 0.00 179.45 175.90 2ies n ASP 221 N -3.22 -1.05 -3.72 4.20 3.85 -1.26 -2.55 116.55 112.80 2ies n ASP 221 Ca -0.03 -1.68 -0.05 0.00 -0.71 0.00 0.00 54.79 52.32 2ies n ASP 221 Cb 0.10 0.78 -0.02 0.00 -1.35 0.00 0.00 41.12 40.64 2ies n ASP 221 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 2ies s LYS 222 N 0.06 1.24 -0.23 0.11 -2.85 -1.25 -4.98 119.74 111.84 2ies s LYS 222 Ca 0.06 -0.65 0.01 0.00 -1.00 0.00 0.00 55.97 54.39 2ies s LYS 222 Cb 0.13 0.45 0.06 0.00 -2.06 0.00 0.00 37.83 36.40 2ies s LYS 222 CO -0.03 -0.57 -0.07 0.08 0.10 0.00 0.00 175.35 174.86 2ies s VAL 223 N -3.39 1.62 0.09 1.79 1.01 -1.26 0.42 120.40 120.68 2ies s VAL 223 Ca 0.10 -1.22 -0.26 0.00 0.00 0.00 0.00 61.98 60.60 2ies s VAL 223 Cb -0.02 -1.83 -0.14 0.00 0.00 0.00 0.00 36.38 34.39 2ies s VAL 223 CO 0.00 -0.04 1.69 1.88 0.00 0.00 0.00 175.10 178.64 2ies h TYR 224 N 7.94 -0.32 -1.67 5.22 -1.99 -1.76 -3.43 116.97 120.96 2ies h TYR 224 Ca -0.20 -0.00 -0.68 0.00 2.00 0.00 0.00 58.73 59.85 2ies h TYR 224 Cb 1.07 0.12 0.07 0.00 2.00 0.00 0.00 36.73 39.99 2ies h TYR 224 CO 0.52 -0.19 0.26 0.09 -0.00 0.00 0.00 178.16 178.83 2ies n ASN 225 N -5.24 1.11 0.25 3.88 4.13 -1.26 -4.81 115.26 113.32 2ies n ASN 225 Ca -0.08 1.14 0.14 0.00 1.68 0.00 0.00 54.58 57.46 2ies n ASN 225 Cb 0.16 -1.15 0.43 0.00 -1.54 0.00 0.00 39.78 37.69 2ies n ASN 225 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2ies h PRO 226 N 3.59 0.00 0.00 3.52 0.13 -1.94 -3.01 132.00 134.28 2ies h PRO 226 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2ies h PRO 226 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2ies h PRO 226 CO 0.71 0.02 0.00 -0.85 -0.23 0.00 0.00 178.00 177.65 2ies n GLU 227 N -3.11 0.76 -0.66 0.86 0.00 -1.26 -5.00 120.64 112.23 2ies n GLU 227 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.27 2ies n GLU 227 Cb 0.42 -1.38 -0.02 0.00 0.00 0.00 0.00 31.44 30.46 2ies n GLU 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ies n GLY 228 N 0.46 -1.22 3.79 -1.84 0.00 -1.14 -4.73 105.19 100.51 2ies n GLY 228 Ca 0.14 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 44.86 2ies n GLY 228 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ies s LEU 229 N 0.00 4.52 -0.02 0.99 1.43 -1.26 -4.98 118.68 119.36 2ies s LEU 229 Ca 0.00 1.50 -0.24 0.00 -1.03 0.00 0.00 54.13 54.36 2ies s LEU 229 Cb 0.00 -3.26 -0.20 0.00 0.03 0.00 0.00 46.19 42.76 2ies s LEU 229 CO 0.00 0.19 1.21 0.03 0.23 0.00 0.00 176.35 178.01 2ies h ARG 230 N 4.17 0.14 -6.38 1.70 3.08 -1.97 -3.44 114.38 111.67 2ies h ARG 230 Ca -0.48 -0.09 -0.62 0.00 0.07 0.00 0.00 59.98 58.86 2ies h ARG 230 Cb 1.21 0.01 -0.25 0.00 0.08 0.00 0.00 29.97 31.02 2ies h ARG 230 CO 0.65 0.68 -0.85 0.71 -1.07 0.00 0.00 179.97 180.09 2ies s TYR 231 N -3.93 2.01 0.33 3.04 4.12 -1.26 -5.00 117.35 116.66 2ies s TYR 231 Ca -0.16 -0.39 0.12 0.00 0.02 0.00 0.00 57.07 56.66 2ies s TYR 231 Cb 0.02 -1.17 0.96 0.00 -1.52 0.00 0.00 41.96 40.25 2ies s TYR 231 CO 0.71 0.15 1.71 1.05 0.02 0.00 0.00 175.55 179.20 2ies h GLU 232 N 4.59 0.48 -0.44 -0.62 4.11 -2.03 0.19 114.58 120.87 2ies h GLU 232 Ca -0.45 -0.03 -0.23 0.00 0.07 0.00 0.00 59.36 58.72 2ies h GLU 232 Cb 1.16 -0.11 -0.14 0.00 0.50 0.00 0.00 28.75 30.16 2ies h GLU 232 CO 0.42 0.32 -0.01 0.27 0.07 0.00 0.00 179.01 180.09 2ies n ASN 233 N -4.91 2.66 -0.32 3.06 0.23 -1.26 -4.82 115.26 109.90 2ies n ASN 233 Ca 0.28 -3.78 0.12 0.00 -0.53 0.00 0.00 54.58 50.67 2ies n ASN 233 Cb 0.82 -0.66 0.25 0.00 -2.08 0.00 0.00 39.78 38.12 2ies n ASN 233 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2ies h GLU 234 N 1.02 0.04 0.06 -3.83 4.81 -1.34 -1.30 114.58 114.05 2ies h GLU 234 Ca 0.28 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.53 2ies h GLU 234 Cb 1.79 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 31.12 2ies h GLU 234 CO 0.49 0.03 -0.33 -1.35 -0.73 0.00 0.00 179.01 177.12 2ies h PRO 235 N 0.04 -0.50 -0.99 0.92 0.11 -1.87 -1.19 132.00 128.53 2ies h PRO 235 Ca 0.55 0.03 0.10 0.00 0.11 0.00 0.00 66.00 66.79 2ies h PRO 235 Cb 1.09 0.11 -0.08 0.00 0.11 0.00 0.00 31.00 32.24 2ies h PRO 235 CO -0.85 -0.33 0.63 0.28 -0.21 0.00 0.00 178.00 177.51 2ies h VAL 236 N -0.52 0.98 0.44 3.15 2.07 -1.64 -1.40 116.25 119.34 2ies h VAL 236 Ca 0.04 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 2ies h VAL 236 Cb 0.58 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2ies h VAL 236 CO -0.23 0.19 -0.23 0.03 0.02 0.00 0.00 177.57 177.34 2ies h ARG 237 N 1.04 -0.61 -0.74 1.57 3.08 -0.88 -2.27 114.38 115.57 2ies h ARG 237 Ca 0.46 0.04 0.14 0.00 0.07 0.00 0.00 59.98 60.70 2ies h ARG 237 Cb 0.37 0.14 -0.10 0.00 0.08 0.00 0.00 29.97 30.46 2ies h ARG 237 CO -0.22 -0.40 0.27 1.25 -1.07 0.00 0.00 179.97 179.80 2ies h HIS 238 N -0.63 0.46 -0.68 3.04 2.76 -0.52 0.49 115.15 120.08 2ies h HIS 238 Ca -0.06 0.04 0.13 0.00 -2.20 0.00 0.00 60.37 58.28 2ies h HIS 238 Cb 0.50 -0.09 -0.04 0.00 1.55 0.00 0.00 27.41 29.32 2ies h HIS 238 CO -0.06 0.04 0.45 0.87 -1.30 0.00 0.00 177.93 177.93 2ies h LYS 239 N 0.41 0.39 -0.21 5.26 1.79 -0.82 0.30 116.57 123.69 2ies h LYS 239 Ca 0.41 -0.02 -0.16 0.00 -2.18 0.00 0.00 60.65 58.70 2ies h LYS 239 Cb 0.63 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2ies h LYS 239 CO -0.42 0.26 -0.48 0.28 -1.08 0.00 0.00 179.45 178.00 2ies h VAL 240 N 0.40 1.31 0.20 0.50 2.07 0.46 -1.95 116.25 119.24 2ies h VAL 240 Ca 0.32 -1.71 0.01 0.00 0.82 0.00 0.00 66.70 66.15 2ies h VAL 240 Cb 0.71 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.31 2ies h VAL 240 CO -0.09 0.54 -0.34 0.15 0.02 0.00 0.00 177.57 177.84 2ies h PHE 241 N 0.40 -0.92 -0.35 1.57 3.57 0.62 -1.18 116.94 120.64 2ies h PHE 241 Ca -0.00 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.56 2ies h PHE 241 Cb 1.10 0.38 -0.08 0.00 2.79 0.00 0.00 35.95 40.14 2ies h PHE 241 CO 0.09 -0.46 -0.53 -0.44 -2.23 0.00 0.00 178.31 174.74 2ies h ASP 242 N -0.61 -1.76 -0.65 0.41 3.32 -0.43 -1.44 116.42 115.27 2ies h ASP 242 Ca 0.01 0.23 0.14 0.00 0.02 0.00 0.00 57.03 57.42 2ies h ASP 242 Cb 0.61 0.71 -0.10 0.00 0.22 0.00 0.00 39.33 40.77 2ies h ASP 242 CO -0.15 -0.40 0.05 0.25 -1.72 0.00 0.00 179.24 177.27 2ies h LEU 243 N -0.41 -0.19 0.34 1.55 5.85 -1.14 0.12 115.31 121.43 2ies h LEU 243 Ca 0.06 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 2ies h LEU 243 Cb 0.58 0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2ies h LEU 243 CO -0.54 -0.09 -0.39 0.40 -0.34 0.00 0.00 178.44 177.48 2ies h ILE 244 N 0.16 0.21 -0.93 4.05 2.04 -0.22 0.26 117.51 123.08 2ies h ILE 244 Ca 0.34 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.34 2ies h ILE 244 Cb 0.57 0.21 -0.09 0.00 -0.74 0.00 0.00 36.82 36.76 2ies h ILE 244 CO -0.52 0.00 0.55 1.23 0.00 0.00 0.00 178.15 179.41 2ies h GLY 245 N -0.77 1.52 0.99 5.37 0.00 -0.36 -0.99 103.07 108.83 2ies h GLY 245 Ca -0.02 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.96 2ies h GLY 245 CO -0.09 0.07 0.03 -0.55 0.00 0.00 0.00 176.54 176.00 2ies h ASP 246 N 0.83 0.05 -0.50 0.19 3.32 -0.16 -2.49 116.42 117.65 2ies h ASP 246 Ca 0.48 -0.01 0.15 0.00 0.02 0.00 0.00 57.03 57.66 2ies h ASP 246 Cb 0.56 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 2ies h ASP 246 CO -0.30 0.05 0.41 -0.07 -1.72 0.00 0.00 179.24 177.61 2ies h LEU 247 N 0.04 0.00 0.00 1.55 3.38 0.83 0.12 115.31 121.24 2ies h LEU 247 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2ies h LEU 247 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2ies h LEU 247 CO -0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2ies n TYR 248 N -4.12 0.00 1.85 1.13 9.36 -0.85 -1.84 117.16 122.69 2ies n TYR 248 Ca 0.09 0.00 0.06 0.00 3.32 0.00 0.00 57.90 61.37 2ies n TYR 248 Cb 0.62 -0.14 0.33 0.00 -0.63 0.00 0.00 39.34 39.52 2ies n TYR 248 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2ies n LEU 249 N -1.14 0.29 -0.01 2.98 4.77 0.43 -2.76 117.00 121.56 2ies n LEU 249 Ca 0.05 -0.13 0.14 0.00 -0.03 0.00 0.00 56.01 56.04 2ies n LEU 249 Cb 0.05 -0.03 0.64 0.00 -2.33 0.00 0.00 43.42 41.75 2ies n LEU 249 CO 0.05 0.07 0.93 0.18 -1.33 0.00 0.00 177.39 177.29 2ies n LEU 250 N -0.50 0.10 0.00 2.23 4.77 -0.77 -1.58 117.00 121.25 2ies n LEU 250 Ca 0.09 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2ies n LEU 250 Cb 0.08 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 2ies n LEU 250 CO 0.07 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 2ies n GLY 251 N 1.39 0.88 0.00 -0.72 0.00 -1.11 -4.99 105.19 100.64 2ies n GLY 251 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2ies n GLY 251 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ies n SER 252 N 0.04 0.00 -4.38 1.61 3.41 -1.26 -4.94 113.62 108.09 2ies n SER 252 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.18 2ies n SER 252 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 2ies n SER 252 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2ies n PRO 253 N -0.10 0.25 -4.13 4.33 -0.02 -1.26 -4.48 135.00 129.59 2ies n PRO 253 Ca 0.00 0.09 -0.25 0.00 -2.02 0.00 0.00 63.50 61.32 2ies n PRO 253 Cb 0.00 -1.21 -0.06 0.00 -0.02 0.00 0.00 33.50 32.22 2ies n PRO 253 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ies s VAL 254 N -1.44 4.28 -0.29 -1.45 1.01 -1.26 -1.13 120.40 120.13 2ies s VAL 254 Ca 0.62 -1.27 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 2ies s VAL 254 Cb -0.69 -3.22 0.10 0.00 0.00 0.00 0.00 36.38 32.57 2ies s VAL 254 CO 0.60 -0.19 0.13 -0.54 0.00 0.00 0.00 175.10 175.10 2ies s LYS 255 N -3.29 0.21 0.19 2.72 -0.14 -0.89 -4.58 119.74 113.95 2ies s LYS 255 Ca 0.31 -0.55 -0.23 0.00 -1.36 0.00 0.00 55.97 54.14 2ies s LYS 255 Cb -0.09 -1.21 0.07 0.00 -1.68 0.00 0.00 37.83 34.92 2ies s LYS 255 CO 0.23 -1.01 1.01 0.20 -0.76 0.00 0.00 175.35 175.02 2ies s GLY 256 N 2.08 0.04 -0.30 -3.33 0.00 -1.01 -2.34 107.32 102.46 2ies s GLY 256 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 44.72 44.56 2ies s GLY 256 CO -0.36 1.72 -0.00 1.25 0.00 0.00 0.00 173.10 175.71 2ies s LYS 257 N -2.42 2.36 -0.08 2.90 2.20 0.21 -1.49 119.74 123.42 2ies s LYS 257 Ca 0.19 -1.32 -0.00 0.00 -0.36 0.00 0.00 55.97 54.48 2ies s LYS 257 Cb -0.02 -3.17 -0.03 0.00 -1.51 0.00 0.00 37.83 33.10 2ies s LYS 257 CO 0.05 -0.64 -0.06 -0.06 -0.36 0.00 0.00 175.35 174.28 2ies s PHE 258 N 1.22 2.98 -0.17 4.03 0.40 0.92 -1.15 117.98 126.21 2ies s PHE 258 Ca -0.05 -0.01 0.01 0.00 -0.60 0.00 0.00 56.93 56.28 2ies s PHE 258 Cb -0.20 -1.76 0.02 0.00 0.51 0.00 0.00 43.02 41.59 2ies s PHE 258 CO -0.02 0.29 -0.18 -0.47 0.70 0.00 0.00 175.22 175.54 2ies s TYR 259 N -0.64 2.58 -0.14 0.36 5.04 0.23 -0.64 117.35 124.14 2ies s TYR 259 Ca 0.10 -1.50 0.01 0.00 -2.44 0.00 0.00 57.07 53.24 2ies s TYR 259 Cb -0.12 -1.81 0.02 0.00 0.35 0.00 0.00 41.96 40.40 2ies s TYR 259 CO 0.02 -0.76 -0.16 0.45 -1.34 0.00 0.00 175.55 173.76 2ies s SER 260 N 1.34 2.70 -0.33 4.32 0.15 0.03 0.81 113.70 122.72 2ies s SER 260 Ca 0.05 -0.50 -0.03 0.00 0.70 0.00 0.00 55.95 56.17 2ies s SER 260 Cb -0.13 -1.21 0.06 0.00 -1.71 0.00 0.00 66.02 63.03 2ies s SER 260 CO -0.12 -0.01 0.06 0.12 1.20 0.00 0.00 173.24 174.49 2ies s PHE 261 N 1.23 3.31 -1.07 3.44 5.36 0.72 -0.67 117.98 130.30 2ies s PHE 261 Ca -0.00 -1.83 -0.01 0.00 -0.96 0.00 0.00 56.93 54.13 2ies s PHE 261 Cb -0.14 -2.33 0.00 0.00 -0.34 0.00 0.00 43.02 40.21 2ies s PHE 261 CO -0.07 -0.81 0.90 0.54 -1.46 0.00 0.00 175.22 174.32 2ies n ARG 262 N 4.67 -5.97 -2.19 10.12 1.74 -0.57 -2.31 116.66 122.15 2ies n ARG 262 Ca -0.11 0.74 -0.27 0.00 -0.77 0.00 0.00 57.85 57.44 2ies n ARG 262 Cb 0.43 -5.46 0.16 0.00 -1.02 0.00 0.00 32.46 26.57 2ies n ARG 262 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2ies s GLY 263 N -4.07 1.77 -0.25 -0.13 0.00 -1.26 -4.57 107.32 98.81 2ies s GLY 263 Ca 0.07 -1.43 -0.28 0.00 0.00 0.00 0.00 44.72 43.08 2ies s GLY 263 CO 0.64 -0.73 1.20 -0.32 0.00 0.00 0.00 173.10 173.89 2ies s GLY 264 N -4.84 -0.02 0.12 0.20 0.00 -1.26 -5.03 107.32 96.50 2ies s GLY 264 Ca 0.71 2.67 -0.03 0.00 0.00 0.00 0.00 44.72 48.08 2ies s GLY 264 CO 0.50 1.37 0.68 1.42 0.00 0.00 0.00 173.10 177.07 2ies n HIS 265 N 1.09 0.18 0.01 1.90 8.25 -1.26 0.33 115.22 125.72 2ies n HIS 265 Ca -0.08 0.53 -0.13 0.00 -0.26 0.00 0.00 57.72 57.79 2ies n HIS 265 Cb 0.58 -0.77 -0.06 0.00 1.12 0.00 0.00 29.99 30.86 2ies n HIS 265 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2ies h SER 266 N 0.00 -1.31 -0.43 0.41 0.02 -1.82 0.21 113.55 110.63 2ies h SER 266 Ca 0.22 0.17 -0.06 0.00 -0.84 0.00 0.00 61.79 61.27 2ies h SER 266 Cb 0.36 0.53 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 2ies h SER 266 CO -0.44 -0.43 0.01 0.25 -1.14 0.00 0.00 176.83 175.08 2ies h LEU 267 N -0.51 0.72 -0.43 5.07 5.85 -0.48 -2.34 115.31 123.19 2ies h LEU 267 Ca 0.07 -0.30 0.06 0.00 0.84 0.00 0.00 57.88 58.55 2ies h LEU 267 Cb 0.63 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.38 2ies h LEU 267 CO -0.38 0.84 -0.53 0.78 -0.34 0.00 0.00 178.44 178.82 2ies h ASN 268 N 0.58 -1.78 -0.46 1.25 4.21 -0.33 0.63 115.58 119.68 2ies h ASN 268 Ca 0.12 0.24 0.04 0.00 1.21 0.00 0.00 56.30 57.92 2ies h ASN 268 Cb 0.46 0.74 -0.04 0.00 -1.12 0.00 0.00 38.32 38.36 2ies h ASN 268 CO 0.02 -0.39 0.21 0.58 -1.29 0.00 0.00 177.43 176.56 2ies h VAL 269 N -0.37 0.93 -0.60 2.81 2.07 -0.57 -1.72 116.25 118.80 2ies h VAL 269 Ca 0.09 -0.15 0.12 0.00 0.82 0.00 0.00 66.70 67.59 2ies h VAL 269 Cb 0.59 0.47 -0.11 0.00 -1.52 0.00 0.00 31.29 30.72 2ies h VAL 269 CO -0.61 0.08 -0.08 0.50 0.02 0.00 0.00 177.57 177.48 2ies h LYS 270 N 0.42 0.04 0.25 1.57 3.64 -0.52 0.28 116.57 122.26 2ies h LYS 270 Ca 0.21 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2ies h LYS 270 Cb 0.14 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2ies h LYS 270 CO -0.16 0.03 -0.17 1.25 -2.27 0.00 0.00 179.45 178.12 2ies h LEU 271 N 0.05 -0.44 -0.89 5.20 5.85 -0.42 -0.57 115.31 124.08 2ies h LEU 271 Ca 0.30 0.03 0.17 0.00 0.84 0.00 0.00 57.88 59.21 2ies h LEU 271 Cb 0.47 0.13 -0.16 0.00 0.37 0.00 0.00 40.66 41.47 2ies h LEU 271 CO -0.57 -0.25 -0.25 0.52 -0.34 0.00 0.00 178.44 177.54 2ies n VAL 272 N -3.33 -0.40 -0.06 1.05 0.31 -0.60 -0.01 118.33 115.29 2ies n VAL 272 Ca -0.05 2.05 -0.10 0.00 -0.01 0.00 0.00 64.34 66.23 2ies n VAL 272 Cb 0.17 -2.81 -0.04 0.00 -0.91 0.00 0.00 33.84 30.26 2ies n VAL 272 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2ies h LYS 273 N 0.00 0.33 0.00 5.55 1.57 -0.25 -1.06 116.57 122.71 2ies h LYS 273 Ca 0.40 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 2ies h LYS 273 Cb 0.62 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2ies h LYS 273 CO -0.91 0.34 0.00 0.39 -0.57 0.00 0.00 179.45 178.70 2ies n GLU 274 N -4.84 0.78 -0.02 3.15 1.02 0.91 -1.22 120.64 120.43 2ies n GLU 274 Ca -0.03 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.15 2ies n GLU 274 Cb 0.10 -1.38 -0.11 0.00 -0.02 0.00 0.00 31.44 30.03 2ies n GLU 274 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2ies n LEU 275 N -0.88 0.00 -0.03 -4.62 0.00 0.99 -4.39 117.00 108.07 2ies n LEU 275 Ca 0.14 0.00 0.03 0.00 0.00 0.00 0.00 56.01 56.18 2ies n LEU 275 Cb 0.07 0.06 -0.15 0.00 0.00 0.00 0.00 43.42 43.40 2ies n LEU 275 CO 0.11 0.06 -0.79 0.00 0.00 0.00 0.00 177.39 176.77 2ies n ALA 276 N -2.09 2.27 0.25 1.96 0.00 -0.49 -3.95 120.51 118.46 2ies n ALA 276 Ca -0.06 -0.77 0.03 0.00 0.00 0.00 0.00 53.44 52.64 2ies n ALA 276 Cb 0.47 -0.61 0.14 0.00 0.00 0.00 0.00 19.45 19.45 2ies n ALA 276 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2ies n LYS 277 N -2.52 0.05 -1.18 0.00 4.81 -0.35 -0.31 118.16 118.66 2ies n LYS 277 Ca -0.14 0.30 -0.25 0.00 -0.87 0.00 0.00 58.31 57.35 2ies n LYS 277 Cb 0.79 -1.50 0.14 0.00 0.02 0.00 0.00 35.03 34.48 2ies n LYS 277 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2ies n LYS 278 N -1.38 2.29 -0.08 1.64 5.02 -1.25 -4.87 118.16 119.53 2ies n LYS 278 Ca 0.02 -2.87 0.00 0.00 -2.02 0.00 0.00 58.31 53.45 2ies n LYS 278 Cb 0.06 -2.12 0.00 0.00 -0.02 0.00 0.00 35.03 32.94 2ies n LYS 278 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ies n GLN 279 N -0.93 -1.01 0.00 1.97 10.64 0.58 -5.11 117.38 123.52 2ies n GLN 279 Ca 0.56 0.03 0.00 0.00 -1.83 0.00 0.00 57.00 55.76 2ies n GLN 279 Cb 1.29 -2.06 0.00 0.00 -0.86 0.00 0.00 30.24 28.61 2ies n GLN 279 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40