#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1im3 s SER 2 N 0.00 6.47 0.22 1.61 1.04 -1.26 -3.70 113.70 118.08 1im3 s SER 2 Ca 0.00 1.15 0.02 0.00 0.48 0.00 0.00 55.95 57.60 1im3 s SER 2 Cb 0.00 -2.33 -0.05 0.00 0.10 0.00 0.00 66.02 63.74 1im3 s SER 2 CO 0.00 -0.47 0.04 -1.00 0.98 0.00 0.00 173.24 172.79 1im3 s HIS 3 N -2.49 1.43 0.00 5.02 0.09 0.25 -4.93 115.29 114.67 1im3 s HIS 3 Ca 0.51 -1.05 -0.13 0.00 -0.00 0.00 0.00 55.06 54.39 1im3 s HIS 3 Cb -0.10 -0.83 0.02 0.00 -0.00 0.00 0.00 32.58 31.66 1im3 s HIS 3 CO 0.35 -0.21 0.27 -1.54 -0.00 0.00 0.00 174.74 173.61 1im3 s SER 4 N -3.26 -0.13 -0.06 1.40 1.04 -1.26 0.14 113.70 111.57 1im3 s SER 4 Ca 0.30 -0.04 0.05 0.00 0.48 0.00 0.00 55.95 56.74 1im3 s SER 4 Cb 0.07 0.30 -0.00 0.00 0.10 0.00 0.00 66.02 66.48 1im3 s SER 4 CO 0.09 -0.47 -0.21 -0.32 0.98 0.00 0.00 173.24 173.31 1im3 s MET 5 N -1.62 2.29 -0.00 4.02 -2.45 -0.13 -0.06 119.30 121.35 1im3 s MET 5 Ca -0.12 -0.75 -0.02 0.00 -1.25 0.00 0.00 55.69 53.56 1im3 s MET 5 Cb -0.05 -1.90 -0.00 0.00 1.25 0.00 0.00 34.83 34.13 1im3 s MET 5 CO 0.02 0.26 0.04 1.03 1.05 0.00 0.00 175.02 177.42 1im3 s ARG 6 N 0.08 0.20 -0.09 4.11 1.81 0.16 -1.38 118.95 123.83 1im3 s ARG 6 Ca -0.08 -0.21 0.03 0.00 -1.72 0.00 0.00 55.73 53.76 1im3 s ARG 6 Cb -0.14 0.08 -0.01 0.00 -0.45 0.00 0.00 34.95 34.43 1im3 s ARG 6 CO 0.04 -0.04 -0.21 0.71 -0.68 0.00 0.00 175.30 175.13 1im3 s TYR 7 N -0.64 2.60 -0.12 -0.53 2.02 -0.45 0.11 117.35 120.34 1im3 s TYR 7 Ca -0.07 -0.80 0.03 0.00 -0.37 0.00 0.00 57.07 55.86 1im3 s TYR 7 Cb -0.04 -1.71 0.00 0.00 -0.40 0.00 0.00 41.96 39.81 1im3 s TYR 7 CO -0.00 -0.27 -0.22 -0.06 -1.57 0.00 0.00 175.55 173.43 1im3 s PHE 8 N 0.13 2.63 -0.08 2.71 0.08 0.60 -2.55 117.98 121.50 1im3 s PHE 8 Ca -0.11 -1.11 0.03 0.00 0.12 0.00 0.00 56.93 55.87 1im3 s PHE 8 Cb -0.16 -1.76 0.00 0.00 -0.57 0.00 0.00 43.02 40.53 1im3 s PHE 8 CO 0.06 -0.47 -0.19 -0.06 -0.10 0.00 0.00 175.22 174.47 1im3 s PHE 9 N 0.51 2.06 -0.08 0.36 0.08 0.18 -1.15 117.98 119.95 1im3 s PHE 9 Ca -0.14 -0.79 0.02 0.00 0.12 0.00 0.00 56.93 56.14 1im3 s PHE 9 Cb -0.17 -1.41 0.02 0.00 -0.57 0.00 0.00 43.02 40.89 1im3 s PHE 9 CO 0.05 -0.33 -0.12 0.99 -0.10 0.00 0.00 175.22 175.71 1im3 s THR 10 N 0.41 1.19 -0.08 0.64 2.01 -0.59 -1.01 115.64 118.20 1im3 s THR 10 Ca -0.15 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 61.39 1im3 s THR 10 Cb -0.16 -1.11 0.02 0.00 0.01 0.00 0.00 72.50 71.26 1im3 s THR 10 CO 0.06 0.38 -0.09 -0.55 -0.69 0.00 0.00 174.62 173.73 1im3 s SER 11 N 0.96 1.86 -0.18 3.53 0.15 -0.05 -1.09 113.70 118.89 1im3 s SER 11 Ca -0.09 -0.28 0.01 0.00 0.70 0.00 0.00 55.95 56.30 1im3 s SER 11 Cb -0.15 -0.78 0.03 0.00 -1.71 0.00 0.00 66.02 63.41 1im3 s SER 11 CO 0.00 -0.05 -0.16 -0.69 1.20 0.00 0.00 173.24 173.54 1im3 s VAL 12 N 1.19 1.86 0.51 4.45 1.01 0.08 -0.84 120.40 128.67 1im3 s VAL 12 Ca -0.05 -0.91 -0.20 0.00 0.00 0.00 0.00 61.98 60.82 1im3 s VAL 12 Cb -0.14 -1.75 -0.07 0.00 0.00 0.00 0.00 36.38 34.42 1im3 s VAL 12 CO -0.02 0.43 1.11 -0.94 0.00 0.00 0.00 175.10 175.68 1im3 s SER 13 N 1.35 5.94 -0.43 3.32 1.04 -0.36 -0.86 113.70 123.71 1im3 s SER 13 Ca 0.03 2.14 0.08 0.00 0.48 0.00 0.00 55.95 58.68 1im3 s SER 13 Cb -0.14 -2.58 0.25 0.00 0.10 0.00 0.00 66.02 63.65 1im3 s SER 13 CO -0.11 -1.06 0.55 0.54 0.98 0.00 0.00 173.24 174.13 1im3 n ARG 14 N -1.07 0.95 -1.67 4.02 1.74 -1.26 -4.15 116.66 115.22 1im3 n ARG 14 Ca 0.10 -3.42 -0.63 0.00 -0.77 0.00 0.00 57.85 53.13 1im3 n ARG 14 Cb 0.51 -1.37 -0.09 0.00 -1.02 0.00 0.00 32.46 30.49 1im3 n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1im3 n PRO 15 N 1.38 0.29 -0.90 5.56 -0.02 -1.26 -0.82 135.00 139.23 1im3 n PRO 15 Ca 0.22 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1im3 n PRO 15 Cb 0.51 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 1im3 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1im3 n GLY 16 N 3.28 0.47 1.69 -1.23 0.00 -1.26 -4.84 105.19 103.30 1im3 n GLY 16 Ca 0.26 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.24 1im3 n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1im3 n ARG 17 N -1.74 1.92 0.00 1.61 1.74 0.00 -5.10 116.66 115.08 1im3 n ARG 17 Ca 0.00 -3.35 0.00 0.00 -0.77 0.00 0.00 57.85 53.73 1im3 n ARG 17 Cb 0.09 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 1im3 n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1im3 n GLY 18 N -0.56 -2.39 3.70 -0.13 0.00 -1.25 -4.95 105.19 99.61 1im3 n GLY 18 Ca 0.21 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 1im3 n GLY 18 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1im3 n GLU 19 N -0.06 0.47 -1.86 1.61 -0.58 -1.26 -4.50 120.64 114.46 1im3 n GLU 19 Ca 0.00 0.23 -0.38 0.00 -0.42 0.00 0.00 57.16 56.60 1im3 n GLU 19 Cb 0.00 -2.47 0.04 0.00 -0.57 0.00 0.00 31.44 28.43 1im3 n GLU 19 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 1im3 s PRO 20 N -3.89 3.13 -0.09 3.49 0.02 -1.26 -4.64 135.00 131.76 1im3 s PRO 20 Ca 0.76 2.12 -0.30 0.00 0.02 0.00 0.00 61.00 63.60 1im3 s PRO 20 Cb -0.32 -2.19 -0.02 0.00 0.02 0.00 0.00 34.50 31.99 1im3 s PRO 20 CO 0.47 -1.16 1.07 0.50 -0.33 0.00 0.00 177.00 177.55 1im3 s ARG 21 N -2.98 4.40 -0.14 5.54 6.06 -0.04 -4.83 118.95 126.97 1im3 s ARG 21 Ca 0.72 1.48 0.02 0.00 -2.50 0.00 0.00 55.73 55.45 1im3 s ARG 21 Cb -0.38 -3.54 0.01 0.00 0.06 0.00 0.00 34.95 31.10 1im3 s ARG 21 CO 0.44 -0.35 -0.19 0.12 -2.50 0.00 0.00 175.30 172.81 1im3 s PHE 22 N 2.06 2.48 -0.11 5.12 5.36 -1.26 -0.74 117.98 130.88 1im3 s PHE 22 Ca 0.51 -1.29 0.02 0.00 -0.96 0.00 0.00 56.93 55.21 1im3 s PHE 22 Cb -0.20 -1.72 0.01 0.00 -0.34 0.00 0.00 43.02 40.77 1im3 s PHE 22 CO 0.19 -0.62 -0.17 0.42 -1.46 0.00 0.00 175.22 173.58 1im3 s ILE 23 N 0.99 1.64 -0.03 3.12 -1.09 -0.25 -0.87 121.20 124.72 1im3 s ILE 23 Ca -0.04 -0.73 0.06 0.00 -2.23 0.00 0.00 60.65 57.71 1im3 s ILE 23 Cb -0.15 -1.47 -0.01 0.00 -1.58 0.00 0.00 42.46 39.24 1im3 s ILE 23 CO -0.04 0.47 -0.22 0.00 -1.23 0.00 0.00 174.94 173.91 1im3 s ALA 24 N 0.88 1.90 0.02 9.38 0.00 0.22 -1.53 121.76 132.63 1im3 s ALA 24 Ca -0.08 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 50.94 1im3 s ALA 24 Cb -0.15 -0.53 -0.02 0.00 0.00 0.00 0.00 23.12 22.43 1im3 s ALA 24 CO -0.00 0.43 -0.06 0.14 0.00 0.00 0.00 175.76 176.26 1im3 s VAL 25 N -0.38 0.41 -0.06 0.00 -7.23 -0.30 -0.87 120.40 111.97 1im3 s VAL 25 Ca 0.04 -0.76 0.05 0.00 -1.81 0.00 0.00 61.98 59.51 1im3 s VAL 25 Cb -0.10 -0.45 -0.02 0.00 0.56 0.00 0.00 36.38 36.37 1im3 s VAL 25 CO 0.01 -0.24 -0.22 -0.83 -0.31 0.00 0.00 175.10 173.50 1im3 s GLY 26 N -1.07 1.36 0.06 2.32 0.00 -0.67 -0.29 107.32 109.03 1im3 s GLY 26 Ca -0.07 -1.03 0.06 0.00 0.00 0.00 0.00 44.72 43.68 1im3 s GLY 26 CO 0.00 -0.66 -0.16 -0.19 0.00 0.00 0.00 173.10 172.10 1im3 s TYR 27 N -0.27 1.37 -0.20 1.90 1.51 0.12 -0.05 117.35 121.73 1im3 s TYR 27 Ca 0.00 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 55.67 1im3 s TYR 27 Cb -0.13 -0.79 0.03 0.00 -0.11 0.00 0.00 41.96 40.97 1im3 s TYR 27 CO 0.03 0.07 -0.15 0.08 -1.11 0.00 0.00 175.55 174.47 1im3 s VAL 28 N -1.03 1.89 0.00 0.71 1.01 -0.34 -0.66 120.40 121.98 1im3 s VAL 28 Ca 0.02 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 60.95 1im3 s VAL 28 Cb -0.09 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.45 1im3 s VAL 28 CO 0.02 0.32 0.00 0.47 0.00 0.00 0.00 175.10 175.91 1im3 n ASP 29 N 4.62 0.00 -1.43 3.32 8.00 0.92 -0.73 116.55 131.25 1im3 n ASP 29 Ca -0.17 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.40 1im3 n ASP 29 Cb 0.48 0.00 0.30 0.00 -0.02 0.00 0.00 41.12 41.88 1im3 n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1im3 n ASP 30 N 4.62 4.22 -4.24 -2.24 8.00 -1.26 -4.87 116.55 120.79 1im3 n ASP 30 Ca 0.00 -2.48 -0.35 0.00 0.71 0.00 0.00 54.79 52.68 1im3 n ASP 30 Cb 0.00 -0.56 -0.14 0.00 -0.02 0.00 0.00 41.12 40.40 1im3 n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1im3 s THR 31 N -1.98 3.06 0.28 -3.53 2.01 0.10 -5.03 115.64 110.56 1im3 s THR 31 Ca 0.42 -0.85 -0.29 0.00 0.31 0.00 0.00 61.69 61.28 1im3 s THR 31 Cb 0.29 -2.50 -0.10 0.00 0.01 0.00 0.00 72.50 70.20 1im3 s THR 31 CO 0.18 0.26 1.17 -1.58 -0.69 0.00 0.00 174.62 173.97 1im3 s GLN 32 N 1.38 4.54 0.00 4.92 0.74 -1.26 -1.20 119.66 128.77 1im3 s GLN 32 Ca 0.02 1.94 0.00 0.00 0.05 0.00 0.00 55.36 57.37 1im3 s GLN 32 Cb -0.16 -3.16 0.00 0.00 1.10 0.00 0.00 33.01 30.79 1im3 s GLN 32 CO -0.04 0.06 0.00 1.97 -0.55 0.00 0.00 175.29 176.73 1im3 n PHE 33 N 1.25 0.00 -3.81 1.67 -1.74 0.93 -4.10 117.46 111.67 1im3 n PHE 33 Ca -0.00 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.79 1im3 n PHE 33 Cb 0.44 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.38 1im3 n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1im3 s VAL 34 N -0.80 0.08 0.07 1.97 -7.23 -1.22 -0.92 120.40 112.37 1im3 s VAL 34 Ca 0.00 -1.01 -0.26 0.00 -1.81 0.00 0.00 61.98 58.90 1im3 s VAL 34 Cb 0.00 -1.47 0.08 0.00 0.56 0.00 0.00 36.38 35.55 1im3 s VAL 34 CO 0.00 -0.37 0.73 0.00 -0.31 0.00 0.00 175.10 175.14 1im3 s ARG 35 N -3.88 1.07 -0.10 4.82 1.04 -0.58 -1.67 118.95 119.65 1im3 s ARG 35 Ca 0.09 -0.34 -0.06 0.00 -1.04 0.00 0.00 55.73 54.38 1im3 s ARG 35 Cb 0.03 0.50 0.04 0.00 -2.04 0.00 0.00 34.95 33.47 1im3 s ARG 35 CO -0.07 -0.46 0.24 0.12 -0.04 0.00 0.00 175.30 175.09 1im3 s PHE 36 N -3.27 -0.31 -0.18 5.89 5.36 -0.05 -0.42 117.98 125.01 1im3 s PHE 36 Ca 0.02 0.74 -0.00 0.00 -0.96 0.00 0.00 56.93 56.72 1im3 s PHE 36 Cb -0.01 0.05 0.04 0.00 -0.34 0.00 0.00 43.02 42.77 1im3 s PHE 36 CO -0.10 -0.20 -0.06 0.34 -1.46 0.00 0.00 175.22 173.74 1im3 s ASP 37 N 0.96 2.99 0.64 6.13 -1.08 -1.26 -0.61 116.67 124.44 1im3 s ASP 37 Ca -0.07 -0.73 0.34 0.00 -0.52 0.00 0.00 52.55 51.57 1im3 s ASP 37 Cb -0.08 -0.99 1.90 0.00 -1.46 0.00 0.00 42.92 42.29 1im3 s ASP 37 CO -0.06 -0.18 2.14 0.77 0.52 0.00 0.00 175.17 178.36 1im3 h SER 38 N 8.08 0.00 0.21 -0.34 4.64 -1.39 -1.13 113.55 123.61 1im3 h SER 38 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1im3 h SER 38 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1im3 h SER 38 CO 0.42 0.00 -0.76 0.47 -0.87 0.00 0.00 176.83 176.09 1im3 n ASP 39 N -3.30 0.84 -4.85 4.97 9.92 -1.26 -4.95 116.55 117.92 1im3 n ASP 39 Ca -0.01 -0.72 -0.31 0.00 -0.53 0.00 0.00 54.79 53.23 1im3 n ASP 39 Cb 0.26 0.65 0.03 0.00 -0.64 0.00 0.00 41.12 41.42 1im3 n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1im3 s ALA 40 N -2.96 2.89 0.16 2.24 0.00 -0.43 -4.98 121.76 118.67 1im3 s ALA 40 Ca 0.10 -0.08 -0.07 0.00 0.00 0.00 0.00 51.96 51.92 1im3 s ALA 40 Cb 0.17 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1im3 s ALA 40 CO 0.78 -0.98 1.43 0.00 0.00 0.00 0.00 175.76 176.99 1im3 h ALA 41 N -0.54 0.55 -0.93 0.00 0.00 -1.92 -3.32 119.26 113.10 1im3 h ALA 41 Ca -0.44 -0.55 0.09 0.00 0.00 0.00 0.00 54.91 54.01 1im3 h ALA 41 Cb 1.21 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.86 1im3 h ALA 41 CO 0.60 0.70 0.57 0.66 0.00 0.00 0.00 179.25 181.78 1im3 h SER 42 N 0.48 0.85 -4.80 0.00 4.64 -1.93 -3.46 113.55 109.33 1im3 h SER 42 Ca -0.01 0.04 -0.41 0.00 -0.47 0.00 0.00 61.79 60.94 1im3 h SER 42 Cb 1.21 -0.14 0.07 0.00 -0.31 0.00 0.00 62.40 63.23 1im3 h SER 42 CO 0.12 0.49 -0.62 0.00 -0.87 0.00 0.00 176.83 175.95 1im3 n GLN 43 N -4.64 -5.41 -4.10 4.77 1.13 -1.25 -4.99 117.38 102.89 1im3 n GLN 43 Ca 0.16 0.87 -0.10 0.00 -1.94 0.00 0.00 57.00 55.99 1im3 n GLN 43 Cb 0.27 -5.77 -0.11 0.00 0.11 0.00 0.00 30.24 24.75 1im3 n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1im3 s ARG 44 N -5.85 0.64 0.11 -1.09 0.52 -1.26 -5.04 118.95 106.98 1im3 s ARG 44 Ca 0.37 -1.06 -0.31 0.00 -0.52 0.00 0.00 55.73 54.21 1im3 s ARG 44 Cb -0.16 -0.10 -0.07 0.00 0.52 0.00 0.00 34.95 35.14 1im3 s ARG 44 CO 0.45 -0.02 1.28 1.41 0.02 0.00 0.00 175.30 178.44 1im3 s MET 45 N -2.94 4.39 0.15 3.54 -2.45 -1.26 -4.67 119.30 116.06 1im3 s MET 45 Ca 0.01 1.93 0.09 0.00 -1.25 0.00 0.00 55.69 56.48 1im3 s MET 45 Cb -0.00 -3.28 -0.04 0.00 1.25 0.00 0.00 34.83 32.76 1im3 s MET 45 CO -0.04 -0.31 -0.17 -1.21 1.05 0.00 0.00 175.02 174.35 1im3 s GLU 46 N 0.80 1.80 0.31 4.11 2.02 0.44 -4.91 118.70 123.28 1im3 s GLU 46 Ca 0.60 -1.28 -0.28 0.00 0.02 0.00 0.00 54.97 54.03 1im3 s GLU 46 Cb -0.33 -2.07 -0.09 0.00 0.10 0.00 0.00 34.13 31.74 1im3 s GLU 46 CO 0.31 0.45 1.04 -1.25 0.02 0.00 0.00 175.26 175.84 1im3 s PRO 47 N -2.46 4.52 0.00 0.39 0.04 -1.26 -1.53 135.00 134.70 1im3 s PRO 47 Ca 0.21 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1im3 s PRO 47 Cb -0.09 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1im3 s PRO 47 CO 0.11 0.16 0.38 0.54 0.04 0.00 0.00 177.00 178.24 1im3 n ARG 48 N 0.80 0.16 -3.99 4.56 5.12 -0.09 -4.88 116.66 118.33 1im3 n ARG 48 Ca 0.01 -0.45 -0.14 0.00 -1.93 0.00 0.00 57.85 55.34 1im3 n ARG 48 Cb 0.47 -0.71 -0.14 0.00 -1.16 0.00 0.00 32.46 30.92 1im3 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1im3 s ALA 49 N -0.14 0.18 0.22 7.54 0.00 -1.24 -4.70 121.76 123.62 1im3 s ALA 49 Ca 0.00 -0.10 -0.08 0.00 0.00 0.00 0.00 51.96 51.78 1im3 s ALA 49 Cb 0.00 -0.04 0.30 0.00 0.00 0.00 0.00 23.12 23.37 1im3 s ALA 49 CO 0.00 0.04 1.80 -1.35 0.00 0.00 0.00 175.76 176.25 1im3 h PRO 50 N 6.07 0.67 0.00 0.00 0.11 -1.94 -2.73 132.00 134.18 1im3 h PRO 50 Ca -0.26 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1im3 h PRO 50 Cb 1.20 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1im3 h PRO 50 CO 0.50 0.45 0.00 0.11 -0.21 0.00 0.00 178.00 178.85 1im3 h TRP 51 N 0.70 0.00 0.00 0.65 5.08 -1.97 -2.00 115.95 118.41 1im3 h TRP 51 Ca 0.33 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.30 1im3 h TRP 51 Cb 0.27 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.43 1im3 h TRP 51 CO -0.08 0.00 -0.69 0.97 -1.28 0.00 0.00 178.44 177.36 1im3 h ILE 52 N 0.00 0.00 0.00 0.12 6.09 -1.83 -3.31 117.51 118.58 1im3 h ILE 52 Ca 0.00 -0.71 0.00 0.00 -1.37 0.00 0.00 64.86 62.78 1im3 h ILE 52 Cb 0.15 1.30 0.00 0.00 0.47 0.00 0.00 36.82 38.74 1im3 h ILE 52 CO 0.00 0.00 0.00 -0.33 -3.07 0.00 0.00 178.15 174.75 1im3 h GLU 53 N 0.00 0.00 0.00 2.19 5.08 -1.43 -2.02 114.58 118.40 1im3 h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1im3 h GLU 53 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1im3 h GLU 53 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1im3 n GLN 54 N -2.38 0.96 -2.75 2.33 10.64 -1.25 -4.78 117.38 120.15 1im3 n GLN 54 Ca 0.01 0.00 -0.40 0.00 -1.83 0.00 0.00 57.00 54.78 1im3 n GLN 54 Cb 0.19 -1.42 -0.05 0.00 -0.86 0.00 0.00 30.24 28.09 1im3 n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1im3 s GLU 55 N -2.00 4.78 1.16 2.61 0.41 -0.76 -5.04 118.70 119.86 1im3 s GLU 55 Ca 0.39 1.46 -0.18 0.00 -0.41 0.00 0.00 54.97 56.22 1im3 s GLU 55 Cb 0.18 -3.32 0.27 0.00 -1.78 0.00 0.00 34.13 29.48 1im3 s GLU 55 CO 0.30 0.39 1.14 0.20 -0.49 0.00 0.00 175.26 176.80 1im3 s GLY 56 N -0.68 1.61 0.35 -1.39 0.00 -1.26 -4.84 107.32 101.10 1im3 s GLY 56 Ca 0.43 -0.95 0.06 0.00 0.00 0.00 0.00 44.72 44.26 1im3 s GLY 56 CO 0.31 -0.09 1.93 -2.55 0.00 0.00 0.00 173.10 172.69 1im3 h PRO 57 N -2.42 0.77 -0.27 2.90 0.11 -1.98 -1.89 132.00 129.22 1im3 h PRO 57 Ca -0.45 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.53 1im3 h PRO 57 Cb 1.29 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1im3 h PRO 57 CO 0.36 0.51 -0.19 0.93 -0.21 0.00 0.00 178.00 179.40 1im3 h GLU 58 N 0.79 0.49 0.22 1.05 3.07 -1.99 -1.11 114.58 117.11 1im3 h GLU 58 Ca 0.36 -0.16 -0.01 0.00 -0.50 0.00 0.00 59.36 59.04 1im3 h GLU 58 Cb 0.36 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1im3 h GLU 58 CO -0.13 0.66 -0.11 -0.92 -1.40 0.00 0.00 179.01 177.11 1im3 h TYR 59 N 0.44 -0.28 -0.60 4.33 3.20 -1.69 -0.65 116.97 121.73 1im3 h TYR 59 Ca 0.07 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 1im3 h TYR 59 Cb 0.59 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 1im3 h TYR 59 CO 0.02 -0.15 0.15 -1.49 -1.64 0.00 0.00 178.16 175.06 1im3 h TRP 60 N -0.33 0.95 -0.43 -3.82 4.06 -1.34 0.76 115.95 115.81 1im3 h TRP 60 Ca -0.03 -0.09 -0.11 0.00 2.06 0.00 0.00 58.89 60.72 1im3 h TRP 60 Cb 0.25 -0.28 -0.01 0.00 -1.00 0.00 0.00 29.16 28.12 1im3 h TRP 60 CO -0.05 0.78 -0.16 -0.44 -3.56 0.00 0.00 178.44 175.01 1im3 h ASP 61 N 0.88 0.88 -0.00 -3.49 3.32 -1.13 -1.14 116.42 115.74 1im3 h ASP 61 Ca 0.19 -0.38 -0.00 0.00 0.02 0.00 0.00 57.03 56.86 1im3 h ASP 61 Cb 0.30 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1im3 h ASP 61 CO -0.00 1.06 0.00 1.23 -1.72 0.00 0.00 179.24 179.81 1im3 h GLY 62 N 0.69 0.01 1.33 2.75 0.00 -0.62 -1.54 103.07 105.68 1im3 h GLY 62 Ca 0.10 -0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 1im3 h GLY 62 CO 0.05 0.00 0.13 0.83 0.00 0.00 0.00 176.54 177.55 1im3 h GLU 63 N -0.14 0.84 -0.15 4.80 4.39 -0.83 -0.06 114.58 123.43 1im3 h GLU 63 Ca 0.00 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.52 1im3 h GLU 63 Cb 0.14 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1im3 h GLU 63 CO -0.00 0.76 0.07 1.15 -1.16 0.00 0.00 179.01 179.83 1im3 h THR 64 N 0.81 1.14 -0.26 1.13 2.02 -1.14 0.24 112.91 116.86 1im3 h THR 64 Ca 0.18 -0.43 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 1im3 h THR 64 Cb 0.30 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1im3 h THR 64 CO -0.00 0.13 0.16 -0.09 0.37 0.00 0.00 175.52 176.09 1im3 h ARG 65 N 0.10 0.34 -0.58 6.66 2.43 -0.90 -1.18 114.38 121.27 1im3 h ARG 65 Ca 0.05 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 1im3 h ARG 65 Cb 0.15 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1im3 h ARG 65 CO -0.01 0.26 0.09 0.87 -1.51 0.00 0.00 179.97 179.68 1im3 h LYS 66 N 0.33 0.96 -0.33 0.20 1.57 -0.85 -1.38 116.57 117.06 1im3 h LYS 66 Ca 0.09 -0.26 -0.10 0.00 -1.87 0.00 0.00 60.65 58.52 1im3 h LYS 66 Cb 0.00 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1im3 h LYS 66 CO -0.02 0.91 -0.20 -0.24 -0.57 0.00 0.00 179.45 179.33 1im3 h VAL 67 N 0.86 1.26 -0.65 0.50 3.04 -0.38 -0.69 116.25 120.18 1im3 h VAL 67 Ca 0.17 -1.25 -0.08 0.00 -1.01 0.00 0.00 66.70 64.54 1im3 h VAL 67 Cb 0.42 1.23 -0.03 0.00 -2.01 0.00 0.00 31.29 30.90 1im3 h VAL 67 CO 0.01 0.41 0.10 0.11 -1.01 0.00 0.00 177.57 177.19 1im3 h LYS 68 N 0.56 1.08 -0.79 4.17 1.57 -1.06 -0.79 116.57 121.32 1im3 h LYS 68 Ca 0.09 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 1im3 h LYS 68 Cb 0.65 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.80 1im3 h LYS 68 CO 0.05 1.00 0.38 0.00 -0.57 0.00 0.00 179.45 180.31 1im3 h ALA 69 N 1.08 1.01 -0.76 3.86 0.00 -0.54 -1.16 119.26 122.75 1im3 h ALA 69 Ca 0.20 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1im3 h ALA 69 Cb 0.45 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1im3 h ALA 69 CO 0.01 0.57 0.47 0.45 0.00 0.00 0.00 179.25 180.76 1im3 h HIS 70 N 1.11 0.99 -0.64 0.00 3.86 -0.52 -1.20 115.15 118.75 1im3 h HIS 70 Ca 0.27 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 1im3 h HIS 70 Cb 0.11 -0.33 -0.03 0.00 1.06 0.00 0.00 27.41 28.22 1im3 h HIS 70 CO 0.01 0.65 0.40 1.03 0.86 0.00 0.00 177.93 180.88 1im3 h SER 71 N 1.05 0.75 0.09 2.45 0.87 -0.31 -1.98 113.55 116.48 1im3 h SER 71 Ca 0.28 -0.04 -0.19 0.00 -1.23 0.00 0.00 61.79 60.60 1im3 h SER 71 Cb -0.06 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 61.71 1im3 h SER 71 CO -0.05 0.57 -0.71 1.56 -0.53 0.00 0.00 176.83 177.67 1im3 h GLN 72 N 0.87 0.55 -0.44 2.24 1.08 -0.35 -2.15 115.11 116.91 1im3 h GLN 72 Ca 0.23 -0.43 -0.08 0.00 -1.45 0.00 0.00 58.65 56.93 1im3 h GLN 72 Cb -0.06 0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.43 1im3 h GLN 72 CO -0.05 1.05 -0.05 1.79 -0.95 0.00 0.00 178.83 180.63 1im3 h THR 73 N 0.39 1.24 -0.12 -0.54 1.35 -1.06 -2.08 112.91 112.09 1im3 h THR 73 Ca -0.03 -1.04 -0.08 0.00 -0.55 0.00 0.00 66.41 64.71 1im3 h THR 73 Cb 1.29 0.96 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 1im3 h THR 73 CO 0.13 0.36 -0.29 0.45 -0.25 0.00 0.00 175.52 175.92 1im3 h HIS 74 N 0.68 0.25 -0.51 4.73 3.86 -1.29 0.16 115.15 123.02 1im3 h HIS 74 Ca 0.13 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1im3 h HIS 74 Cb 0.49 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.88 1im3 h HIS 74 CO 0.02 0.50 0.15 -0.09 0.86 0.00 0.00 177.93 179.37 1im3 h ARG 75 N 0.20 0.81 -0.49 2.45 2.43 -0.83 -1.37 114.38 117.57 1im3 h ARG 75 Ca 0.03 -0.18 -0.08 0.00 -0.81 0.00 0.00 59.98 58.94 1im3 h ARG 75 Cb 0.63 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1im3 h ARG 75 CO 0.05 0.76 -0.01 0.28 -1.51 0.00 0.00 179.97 179.54 1im3 h VAL 76 N 0.71 1.26 -0.61 0.20 2.07 -0.87 -3.15 116.25 115.85 1im3 h VAL 76 Ca 0.16 -1.09 0.08 0.00 0.82 0.00 0.00 66.70 66.67 1im3 h VAL 76 Cb 0.30 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 30.99 1im3 h VAL 76 CO -0.00 0.38 0.27 0.44 0.02 0.00 0.00 177.57 178.68 1im3 h ASP 77 N 0.74 0.33 -1.00 0.57 3.32 -0.22 -0.78 116.42 119.38 1im3 h ASP 77 Ca 0.14 0.06 0.09 0.00 0.02 0.00 0.00 57.03 57.34 1im3 h ASP 77 Cb 0.53 0.01 -0.08 0.00 0.22 0.00 0.00 39.33 40.01 1im3 h ASP 77 CO 0.03 0.20 0.63 -0.07 -1.72 0.00 0.00 179.24 178.31 1im3 h LEU 78 N 0.49 0.97 -0.36 1.55 3.38 -1.22 0.27 115.31 120.38 1im3 h LEU 78 Ca 0.30 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.17 1im3 h LEU 78 Cb 0.31 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1im3 h LEU 78 CO -0.26 0.57 -0.29 1.23 0.09 0.00 0.00 178.44 179.79 1im3 h GLY 79 N 1.07 0.90 0.96 0.83 0.00 -1.33 -1.46 103.07 104.04 1im3 h GLY 79 Ca 0.46 -0.88 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 1im3 h GLY 79 CO -0.22 0.80 0.20 -0.84 0.00 0.00 0.00 176.54 176.48 1im3 h THR 80 N 0.62 1.19 -0.39 4.70 2.02 0.06 -2.42 112.91 118.68 1im3 h THR 80 Ca 0.07 -0.55 -0.13 0.00 0.77 0.00 0.00 66.41 66.56 1im3 h THR 80 Cb 0.86 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1im3 h THR 80 CO 0.07 0.21 -0.28 -0.07 0.37 0.00 0.00 175.52 175.82 1im3 h LEU 81 N 0.57 0.86 -1.25 2.58 3.38 -0.50 -0.14 115.31 120.81 1im3 h LEU 81 Ca 0.15 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.83 1im3 h LEU 81 Cb 0.14 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 1im3 h LEU 81 CO -0.02 1.09 0.53 -0.09 0.09 0.00 0.00 178.44 180.04 1im3 h ARG 82 N 0.71 0.91 0.15 1.13 2.43 -1.15 -1.59 114.38 116.96 1im3 h ARG 82 Ca 0.08 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1im3 h ARG 82 Cb 0.83 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1im3 h ARG 82 CO 0.07 0.60 -0.07 0.78 -1.51 0.00 0.00 179.97 179.84 1im3 h GLY 83 N 0.94 -0.21 0.51 2.80 0.00 -0.87 0.11 103.07 106.36 1im3 h GLY 83 Ca 0.33 0.08 0.18 0.00 0.00 0.00 0.00 47.33 47.92 1im3 h GLY 83 CO -0.11 -0.08 0.54 -0.97 0.00 0.00 0.00 176.54 175.93 1im3 h TYR 84 N -0.65 0.46 -0.64 5.60 0.05 -0.67 -0.20 116.97 120.92 1im3 h TYR 84 Ca -0.02 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1im3 h TYR 84 Cb 0.48 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 38.08 1im3 h TYR 84 CO 0.06 0.15 0.00 0.66 -1.05 0.00 0.00 178.16 177.98 1im3 n TYR 85 N -4.47 1.25 -4.11 4.88 4.01 -0.63 -4.91 117.16 113.17 1im3 n TYR 85 Ca 0.16 -0.58 -0.28 0.00 -0.16 0.00 0.00 57.90 57.05 1im3 n TYR 85 Cb 0.63 -0.16 -0.05 0.00 -0.31 0.00 0.00 39.34 39.44 1im3 n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1im3 n ASN 86 N 1.18 0.22 -4.95 7.72 3.02 -0.09 -4.94 115.26 117.42 1im3 n ASN 86 Ca 0.24 -1.12 -0.24 0.00 -0.03 0.00 0.00 54.58 53.44 1im3 n ASN 86 Cb 0.78 -2.44 -0.02 0.00 -0.61 0.00 0.00 39.78 37.49 1im3 n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1im3 s GLN 87 N -6.90 3.46 0.72 3.52 -0.21 0.34 -5.03 119.66 115.56 1im3 s GLN 87 Ca 0.00 -0.60 -0.16 0.00 0.02 0.00 0.00 55.36 54.63 1im3 s GLN 87 Cb -0.00 -2.87 0.03 0.00 1.00 0.00 0.00 33.01 31.16 1im3 s GLN 87 CO 0.94 0.41 1.17 0.45 -2.12 0.00 0.00 175.29 176.14 1im3 n SER 88 N -1.14 1.27 -0.07 5.90 2.88 -1.26 -4.77 113.62 116.43 1im3 n SER 88 Ca -0.07 0.70 0.16 0.00 -1.33 0.00 0.00 58.87 58.32 1im3 n SER 88 Cb 0.56 -1.50 0.86 0.00 -0.75 0.00 0.00 64.21 63.38 1im3 n SER 88 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1im3 n GLU 89 N -2.36 1.02 -0.07 -1.46 4.07 -1.26 -3.94 120.64 116.64 1im3 n GLU 89 Ca 0.14 -0.14 -0.04 0.00 -0.06 0.00 0.00 57.16 57.07 1im3 n GLU 89 Cb 0.49 -1.50 -0.16 0.00 -0.06 0.00 0.00 31.44 30.21 1im3 n GLU 89 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1im3 n ALA 90 N -0.87 1.90 -1.72 4.31 0.00 -1.26 -4.85 120.51 118.02 1im3 n ALA 90 Ca 0.22 -1.08 -0.31 0.00 0.00 0.00 0.00 53.44 52.27 1im3 n ALA 90 Cb 0.16 -0.35 0.02 0.00 0.00 0.00 0.00 19.45 19.28 1im3 n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1im3 s GLY 91 N -5.17 1.79 -0.10 0.00 0.00 -1.25 -4.58 107.32 98.00 1im3 s GLY 91 Ca -0.09 0.09 -0.21 0.00 0.00 0.00 0.00 44.72 44.51 1im3 s GLY 91 CO 0.85 0.38 0.60 -0.45 0.00 0.00 0.00 173.10 174.48 1im3 s SER 92 N -3.66 6.83 0.17 1.64 0.15 -1.26 -4.63 113.70 112.94 1im3 s SER 92 Ca 0.58 1.00 0.07 0.00 0.70 0.00 0.00 55.95 58.30 1im3 s SER 92 Cb -0.13 -2.35 -0.04 0.00 -1.71 0.00 0.00 66.02 61.79 1im3 s SER 92 CO 0.49 -0.08 -0.15 -1.00 1.20 0.00 0.00 173.24 173.70 1im3 s HIS 93 N 0.80 1.61 -0.14 3.44 3.76 -1.26 -4.94 115.29 118.56 1im3 s HIS 93 Ca 0.32 -0.56 0.03 0.00 -0.15 0.00 0.00 55.06 54.69 1im3 s HIS 93 Cb -0.16 -0.79 0.01 0.00 1.11 0.00 0.00 32.58 32.75 1im3 s HIS 93 CO 0.14 0.26 -0.22 0.99 -0.85 0.00 0.00 174.74 175.07 1im3 s THR 94 N -2.55 2.04 -0.11 1.30 2.01 -1.26 -1.23 115.64 115.84 1im3 s THR 94 Ca 0.16 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1im3 s THR 94 Cb -0.03 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.66 1im3 s THR 94 CO 0.05 0.55 -0.12 0.54 -0.69 0.00 0.00 174.62 174.94 1im3 s VAL 95 N 0.78 3.14 0.10 3.82 0.11 -0.02 -0.69 120.40 127.64 1im3 s VAL 95 Ca -0.08 -0.64 0.08 0.00 -2.93 0.00 0.00 61.98 58.41 1im3 s VAL 95 Cb -0.16 -2.30 -0.03 0.00 -1.53 0.00 0.00 36.38 32.35 1im3 s VAL 95 CO -0.01 0.54 -0.21 -1.10 -3.33 0.00 0.00 175.10 170.99 1im3 s GLN 96 N 0.09 1.15 -0.03 1.54 -0.21 -0.51 -0.87 119.66 120.83 1im3 s GLN 96 Ca -0.05 -1.16 -0.06 0.00 0.02 0.00 0.00 55.36 54.11 1im3 s GLN 96 Cb -0.15 -1.43 0.01 0.00 1.00 0.00 0.00 33.01 32.45 1im3 s GLN 96 CO 0.04 0.33 0.13 0.50 -2.12 0.00 0.00 175.29 174.18 1im3 s ARG 97 N -1.88 0.30 -0.06 2.91 3.52 -0.18 -1.16 118.95 122.40 1im3 s ARG 97 Ca 0.07 -0.08 -0.05 0.00 -0.13 0.00 0.00 55.73 55.54 1im3 s ARG 97 Cb -0.10 0.13 0.02 0.00 -1.56 0.00 0.00 34.95 33.44 1im3 s ARG 97 CO 0.04 -0.06 0.16 1.41 -0.81 0.00 0.00 175.30 176.04 1im3 s MET 98 N -0.58 0.18 0.11 5.12 1.75 -0.10 -0.64 119.30 125.15 1im3 s MET 98 Ca -0.07 0.23 -0.16 0.00 -1.25 0.00 0.00 55.69 54.45 1im3 s MET 98 Cb -0.04 0.07 0.03 0.00 2.84 0.00 0.00 34.83 37.73 1im3 s MET 98 CO 0.01 -0.03 0.39 1.52 -0.65 0.00 0.00 175.02 176.25 1im3 s TYR 99 N 0.16 -0.19 -5.00 4.11 -0.85 -1.06 -0.82 117.35 113.71 1im3 s TYR 99 Ca -0.01 -0.11 0.00 0.00 -0.52 0.00 0.00 57.07 56.43 1im3 s TYR 99 Cb -0.02 0.24 0.00 0.00 0.38 0.00 0.00 41.96 42.56 1im3 s TYR 99 CO -0.00 -0.68 0.00 0.41 -1.52 0.00 0.00 175.55 173.76 1im3 n GLY 100 N -0.14 -2.24 3.21 5.49 0.00 -0.87 -1.34 105.19 109.29 1im3 n GLY 100 Ca -0.16 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 1im3 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1im3 s ASP 102 N -3.10 2.28 0.14 0.00 1.01 0.20 -0.95 116.67 116.25 1im3 s ASP 102 Ca 0.16 -0.36 0.09 0.00 0.71 0.00 0.00 52.55 53.15 1im3 s ASP 102 Cb 0.05 -0.32 -0.04 0.00 1.01 0.00 0.00 42.92 43.62 1im3 s ASP 102 CO -0.01 0.23 -0.20 0.68 0.21 0.00 0.00 175.17 176.08 1im3 s VAL 103 N -0.38 1.82 0.82 -1.27 -7.23 0.12 0.10 120.40 114.39 1im3 s VAL 103 Ca 0.06 -1.79 -0.06 0.00 -1.81 0.00 0.00 61.98 58.37 1im3 s VAL 103 Cb -0.08 -1.77 0.17 0.00 0.56 0.00 0.00 36.38 35.26 1im3 s VAL 103 CO -0.00 -0.21 1.13 -0.83 -0.31 0.00 0.00 175.10 174.88 1im3 s GLY 104 N -2.40 1.77 0.63 2.32 0.00 -0.97 -0.58 107.32 108.10 1im3 s GLY 104 Ca 0.13 -1.62 0.35 0.00 0.00 0.00 0.00 44.72 43.57 1im3 s GLY 104 CO 0.06 -0.95 2.05 1.48 0.00 0.00 0.00 173.10 175.74 1im3 h SER 105 N -0.98 0.00 -0.10 1.64 4.64 -1.92 0.78 113.55 117.61 1im3 h SER 105 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1im3 h SER 105 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1im3 h SER 105 CO 0.37 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.43 1im3 n ASP 106 N -2.88 1.25 -1.08 4.97 5.75 -1.26 -4.91 116.55 118.38 1im3 n ASP 106 Ca -0.02 -1.59 -0.14 0.00 -0.01 0.00 0.00 54.79 53.03 1im3 n ASP 106 Cb 0.24 -0.06 -0.06 0.00 -1.03 0.00 0.00 41.12 40.20 1im3 n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1im3 n TRP 107 N 0.03 0.00 -3.74 2.11 7.02 0.27 -5.00 117.44 118.13 1im3 n TRP 107 Ca 0.17 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.32 1im3 n TRP 107 Cb 0.27 -2.57 -0.05 0.00 -2.42 0.00 0.00 31.31 26.54 1im3 n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1im3 s ARG 108 N -3.16 3.58 0.02 -0.99 0.52 -1.26 -4.81 118.95 112.86 1im3 s ARG 108 Ca 0.00 -0.13 -0.37 0.00 -0.52 0.00 0.00 55.73 54.71 1im3 s ARG 108 Cb 0.00 -2.97 -0.16 0.00 0.52 0.00 0.00 34.95 32.34 1im3 s ARG 108 CO 0.00 0.56 1.46 0.34 0.02 0.00 0.00 175.30 177.68 1im3 n PHE 109 N 0.52 1.73 -0.06 -0.53 -0.00 -1.26 -2.28 117.46 115.59 1im3 n PHE 109 Ca -0.06 0.55 -0.10 0.00 -0.00 0.00 0.00 57.45 57.84 1im3 n PHE 109 Cb 0.52 -2.39 -0.05 0.00 -0.00 0.00 0.00 39.48 37.56 1im3 n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 1im3 n LEU 110 N 3.30 2.01 -3.50 -2.13 7.94 0.11 -4.83 117.00 119.90 1im3 n LEU 110 Ca 0.20 0.03 -0.13 0.00 -1.11 0.00 0.00 56.01 55.00 1im3 n LEU 110 Cb 0.20 -0.37 -0.04 0.00 0.53 0.00 0.00 43.42 43.74 1im3 n LEU 110 CO 0.66 0.48 0.56 -0.60 -1.11 0.00 0.00 177.39 177.38 1im3 s ARG 111 N -2.22 0.97 0.19 1.96 3.52 -1.08 -4.98 118.95 117.31 1im3 s ARG 111 Ca -0.15 -0.09 0.08 0.00 -0.13 0.00 0.00 55.73 55.43 1im3 s ARG 111 Cb 0.05 0.45 -0.05 0.00 -1.56 0.00 0.00 34.95 33.84 1im3 s ARG 111 CO 0.23 -0.37 -0.15 0.20 -0.81 0.00 0.00 175.30 174.41 1im3 s GLY 112 N -1.89 1.38 0.00 8.12 0.00 -1.26 -0.63 107.32 113.04 1im3 s GLY 112 Ca -0.02 -1.61 -0.08 0.00 0.00 0.00 0.00 44.72 43.01 1im3 s GLY 112 CO -0.02 -1.70 0.15 -0.19 0.00 0.00 0.00 173.10 171.33 1im3 s TYR 113 N -2.86 0.03 -0.29 1.90 1.51 0.08 -4.84 117.35 112.88 1im3 s TYR 113 Ca 0.21 -0.11 -0.01 0.00 -1.01 0.00 0.00 57.07 56.15 1im3 s TYR 113 Cb -0.01 -0.04 0.19 0.00 -0.11 0.00 0.00 41.96 41.99 1im3 s TYR 113 CO 0.06 -0.30 0.74 -1.58 -1.11 0.00 0.00 175.55 173.37 1im3 s HIS 114 N -1.41 -1.38 0.06 2.71 2.46 -1.25 -2.04 115.29 114.44 1im3 s HIS 114 Ca -0.15 0.92 -0.09 0.00 0.47 0.00 0.00 55.06 56.21 1im3 s HIS 114 Cb -0.07 0.28 0.00 0.00 -0.13 0.00 0.00 32.58 32.66 1im3 s HIS 114 CO 0.02 -0.79 0.20 1.14 -2.47 0.00 0.00 174.74 172.83 1im3 s GLN 115 N 2.88 0.76 0.18 2.88 -2.07 -0.00 -1.17 119.66 123.12 1im3 s GLN 115 Ca 0.15 -0.75 0.09 0.00 -1.82 0.00 0.00 55.36 53.04 1im3 s GLN 115 Cb -0.08 0.31 -0.04 0.00 -1.09 0.00 0.00 33.01 32.10 1im3 s GLN 115 CO -0.24 -0.23 -0.18 0.71 -1.32 0.00 0.00 175.29 174.03 1im3 s TYR 116 N -3.06 1.87 0.04 9.60 1.51 0.15 -0.92 117.35 126.55 1im3 s TYR 116 Ca -0.01 -0.47 0.01 0.00 -1.01 0.00 0.00 57.07 55.59 1im3 s TYR 116 Cb 0.01 -0.91 -0.03 0.00 -0.11 0.00 0.00 41.96 40.92 1im3 s TYR 116 CO -0.07 0.38 -0.06 0.00 -1.11 0.00 0.00 175.55 174.69 1im3 s ALA 117 N -2.19 0.50 -0.05 3.71 0.00 -0.31 -1.29 121.76 122.14 1im3 s ALA 117 Ca 0.18 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.31 1im3 s ALA 117 Cb -0.05 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.20 1im3 s ALA 117 CO 0.07 -0.12 -0.02 -0.47 0.00 0.00 0.00 175.76 175.23 1im3 s TYR 118 N -1.91 0.60 -1.50 0.00 5.04 -0.41 -1.42 117.35 117.75 1im3 s TYR 118 Ca -0.07 -0.14 -0.09 0.00 -2.44 0.00 0.00 57.07 54.34 1im3 s TYR 118 Cb -0.06 -0.63 0.06 0.00 0.35 0.00 0.00 41.96 41.68 1im3 s TYR 118 CO -0.02 -0.21 0.72 -0.25 -1.34 0.00 0.00 175.55 174.46 1im3 n ASP 119 N 4.35 -2.48 0.00 4.32 8.00 0.14 -2.63 116.55 128.25 1im3 n ASP 119 Ca -0.21 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.38 1im3 n ASP 119 Cb 0.50 -3.39 0.00 0.00 -0.02 0.00 0.00 41.12 38.21 1im3 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1im3 n GLY 120 N -1.69 1.01 3.20 0.44 0.00 -1.26 -5.02 105.19 101.86 1im3 n GLY 120 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 1im3 n GLY 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1im3 s LYS 121 N -0.31 0.91 0.57 1.61 0.00 -1.08 -5.13 119.74 116.32 1im3 s LYS 121 Ca 0.00 -1.30 -0.19 0.00 0.00 0.00 0.00 55.97 54.48 1im3 s LYS 121 Cb 0.00 -0.48 -0.06 0.00 0.00 0.00 0.00 37.83 37.29 1im3 s LYS 121 CO 0.00 0.05 0.87 -0.25 0.00 0.00 0.00 175.35 176.02 1im3 n ASP 122 N 0.15 0.43 0.07 0.03 8.00 -1.26 -1.28 116.55 122.68 1im3 n ASP 122 Ca -0.13 0.82 0.00 0.00 0.71 0.00 0.00 54.79 56.19 1im3 n ASP 122 Cb 0.59 -1.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.36 1im3 n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1im3 n TYR 123 N -1.54 -0.50 -3.65 1.24 9.36 -0.41 -4.62 117.16 117.04 1im3 n TYR 123 Ca 0.13 0.09 -0.15 0.00 3.32 0.00 0.00 57.90 61.28 1im3 n TYR 123 Cb 0.46 0.12 -0.07 0.00 -0.63 0.00 0.00 39.34 39.22 1im3 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1im3 s ILE 124 N -2.00 0.03 -0.01 2.97 2.07 -1.08 -1.21 121.20 121.97 1im3 s ILE 124 Ca 0.00 -0.28 -0.11 0.00 -1.41 0.00 0.00 60.65 58.85 1im3 s ILE 124 Cb 0.00 -0.82 0.01 0.00 0.13 0.00 0.00 42.46 41.78 1im3 s ILE 124 CO 0.00 -0.16 0.22 0.00 -1.91 0.00 0.00 174.94 173.09 1im3 s ALA 125 N -1.49 -0.55 -0.01 1.50 0.00 -0.80 -0.67 121.76 119.74 1im3 s ALA 125 Ca -0.11 0.11 -0.25 0.00 0.00 0.00 0.00 51.96 51.71 1im3 s ALA 125 Cb -0.02 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 1im3 s ALA 125 CO 0.05 -0.23 0.78 -1.17 0.00 0.00 0.00 175.76 175.19 1im3 s LEU 126 N -1.30 4.38 0.77 0.00 2.96 -0.31 -0.98 118.68 124.20 1im3 s LEU 126 Ca -0.14 1.38 -0.11 0.00 -0.22 0.00 0.00 54.13 55.04 1im3 s LEU 126 Cb -0.06 -3.23 0.05 0.00 0.50 0.00 0.00 46.19 43.45 1im3 s LEU 126 CO 0.03 -0.09 1.08 -0.54 -1.32 0.00 0.00 176.35 175.51 1im3 s LYS 127 N 0.49 2.32 0.63 1.98 1.02 0.20 -4.64 119.74 121.76 1im3 s LYS 127 Ca 0.41 0.89 0.32 0.00 0.02 0.00 0.00 55.97 57.61 1im3 s LYS 127 Cb -0.19 -1.93 1.78 0.00 -0.52 0.00 0.00 37.83 36.97 1im3 s LYS 127 CO 0.22 -1.52 2.06 1.49 -0.92 0.00 0.00 175.35 176.68 1im3 h GLU 128 N -1.02 0.00 0.00 1.68 4.81 -1.88 0.15 114.58 118.32 1im3 h GLU 128 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1im3 h GLU 128 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1im3 h GLU 128 CO 0.56 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.44 1im3 n ASP 129 N -3.30 0.00 -2.34 1.04 5.68 -1.26 -4.83 116.55 111.54 1im3 n ASP 129 Ca 0.00 -0.19 -0.18 0.00 -0.50 0.00 0.00 54.79 53.92 1im3 n ASP 129 Cb 0.34 -0.23 -0.01 0.00 -1.14 0.00 0.00 41.12 40.07 1im3 n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1im3 n LEU 130 N -1.23 -1.65 0.00 -2.12 4.77 0.52 -4.76 117.00 112.53 1im3 n LEU 130 Ca 0.13 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1im3 n LEU 130 Cb 0.17 -2.67 0.00 0.00 -2.33 0.00 0.00 43.42 38.59 1im3 n LEU 130 CO 0.18 -0.25 -0.15 -1.14 -1.33 0.00 0.00 177.39 174.69 1im3 n ARG 131 N -2.88 0.13 -4.20 3.23 0.63 -1.26 -4.64 116.66 107.66 1im3 n ARG 131 Ca -0.21 0.00 -0.24 0.00 -0.92 0.00 0.00 57.85 56.48 1im3 n ARG 131 Cb 0.66 -0.65 -0.06 0.00 0.45 0.00 0.00 32.46 32.85 1im3 n ARG 131 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 1im3 s SER 132 N -3.12 4.99 0.07 6.15 1.04 -1.26 -4.86 113.70 116.71 1im3 s SER 132 Ca 0.00 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.05 1im3 s SER 132 Cb 0.00 -1.11 -0.04 0.00 0.10 0.00 0.00 66.02 64.97 1im3 s SER 132 CO 0.00 0.02 0.02 0.26 0.98 0.00 0.00 173.24 174.53 1im3 s TRP 133 N -2.05 3.07 -0.33 5.02 0.52 -1.26 -0.62 118.94 123.29 1im3 s TRP 133 Ca 0.31 0.03 -0.01 0.00 0.02 0.00 0.00 56.10 56.45 1im3 s TRP 133 Cb -0.08 -1.59 0.07 0.00 -1.15 0.00 0.00 33.47 30.72 1im3 s TRP 133 CO 0.21 0.49 0.05 0.99 0.02 0.00 0.00 176.95 178.72 1im3 s THR 134 N -1.29 2.94 -0.16 2.01 2.01 -0.15 -4.91 115.64 116.10 1im3 s THR 134 Ca 0.25 -1.69 -0.25 0.00 0.31 0.00 0.00 61.69 60.31 1im3 s THR 134 Cb -0.12 -2.83 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 1im3 s THR 134 CO 0.18 -0.31 0.83 0.00 -0.69 0.00 0.00 174.62 174.62 1im3 s ALA 135 N 1.17 3.49 0.37 7.40 0.00 -1.26 -1.90 121.76 131.04 1im3 s ALA 135 Ca -0.00 0.06 0.18 0.00 0.00 0.00 0.00 51.96 52.20 1im3 s ALA 135 Cb -0.20 -3.22 0.96 0.00 0.00 0.00 0.00 23.12 20.66 1im3 s ALA 135 CO -0.03 -0.60 1.91 0.00 0.00 0.00 0.00 175.76 177.05 1im3 h ALA 136 N 7.27 1.37 -2.44 0.00 0.00 -1.46 -3.47 119.26 120.53 1im3 h ALA 136 Ca -0.31 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1im3 h ALA 136 Cb 1.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1im3 h ALA 136 CO 0.83 0.34 0.00 -0.40 0.00 0.00 0.00 179.25 180.02 1im3 n ASP 137 N -3.95 0.00 0.05 0.00 5.68 -1.26 -5.04 116.55 112.03 1im3 n ASP 137 Ca -0.02 -0.97 -0.13 0.00 -0.50 0.00 0.00 54.79 53.17 1im3 n ASP 137 Cb 0.34 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.25 1im3 n ASP 137 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 1im3 h MET 138 N 0.00 -0.06 -0.58 0.11 1.85 -1.98 -3.03 114.93 111.24 1im3 h MET 138 Ca 0.00 0.00 0.08 0.00 -0.61 0.00 0.00 59.70 59.17 1im3 h MET 138 Cb 0.00 0.01 -0.06 0.00 0.43 0.00 0.00 31.60 31.98 1im3 h MET 138 CO 0.00 0.05 0.25 0.00 -0.40 0.00 0.00 176.91 176.81 1im3 h ALA 139 N 0.78 0.75 -0.01 0.39 0.00 -1.98 -1.49 119.26 117.71 1im3 h ALA 139 Ca -0.01 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1im3 h ALA 139 Cb 0.14 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1im3 h ALA 139 CO 0.01 -0.14 0.06 0.00 0.00 0.00 0.00 179.25 179.18 1im3 h ALA 140 N 1.37 1.15 -0.71 0.00 0.00 -1.81 -1.58 119.26 117.68 1im3 h ALA 140 Ca 0.28 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.20 1im3 h ALA 140 Cb 0.29 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1im3 h ALA 140 CO -0.25 -0.07 0.47 1.96 0.00 0.00 0.00 179.25 181.36 1im3 h GLN 141 N 0.00 0.92 -0.23 0.00 1.08 -1.22 -0.00 115.11 115.67 1im3 h GLN 141 Ca 0.00 -0.06 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1im3 h GLN 141 Cb 0.13 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 1im3 h GLN 141 CO -0.00 0.61 0.12 1.15 -0.95 0.00 0.00 178.83 179.76 1im3 h THR 142 N 0.95 1.00 -0.74 -0.54 2.02 -1.41 0.05 112.91 114.24 1im3 h THR 142 Ca 0.26 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 67.31 1im3 h THR 142 Cb -0.10 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1im3 h THR 142 CO -0.06 0.05 0.28 0.74 0.37 0.00 0.00 175.52 176.90 1im3 h THR 143 N 0.25 1.26 -0.39 3.16 2.02 -1.49 -0.01 112.91 117.70 1im3 h THR 143 Ca 0.09 -0.83 0.04 0.00 0.77 0.00 0.00 66.41 66.48 1im3 h THR 143 Cb 0.02 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 66.79 1im3 h THR 143 CO -0.06 0.33 0.15 0.50 0.37 0.00 0.00 175.52 176.81 1im3 h LYS 144 N 1.08 0.30 -0.34 6.66 3.64 -0.25 0.54 116.57 128.20 1im3 h LYS 144 Ca 0.25 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1im3 h LYS 144 Cb 0.24 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1im3 h LYS 144 CO -0.02 0.20 0.13 1.25 -2.27 0.00 0.00 179.45 178.75 1im3 h HIS 145 N 0.31 0.51 -0.59 1.91 2.76 -0.71 -1.43 115.15 117.92 1im3 h HIS 145 Ca 0.18 -0.04 0.02 0.00 -2.20 0.00 0.00 60.37 58.33 1im3 h HIS 145 Cb 0.15 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 28.92 1im3 h HIS 145 CO -0.14 0.48 0.37 -0.22 -1.30 0.00 0.00 177.93 177.12 1im3 h LYS 146 N 0.40 0.71 0.00 5.26 3.64 -0.25 -0.77 116.57 125.55 1im3 h LYS 146 Ca 0.11 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 1im3 h LYS 146 Cb 0.18 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1im3 h LYS 146 CO -0.01 0.47 -0.37 -1.49 -2.27 0.00 0.00 179.45 175.78 1im3 h TRP 147 N 0.73 0.00 -0.18 1.91 4.06 0.36 -1.59 115.95 121.24 1im3 h TRP 147 Ca 0.23 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 61.01 1im3 h TRP 147 Cb -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1im3 h TRP 147 CO -0.05 0.37 -0.54 0.93 -3.56 0.00 0.00 178.44 175.58 1im3 h GLU 148 N 0.00 0.69 -0.17 0.49 5.08 -0.80 -0.96 114.58 118.91 1im3 h GLU 148 Ca -0.00 -0.50 -0.06 0.00 -1.00 0.00 0.00 59.36 57.80 1im3 h GLU 148 Cb 0.69 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1im3 h GLU 148 CO 0.05 1.12 -0.15 0.00 -1.00 0.00 0.00 179.01 179.03 1im3 h ALA 149 N 0.57 1.44 -0.16 3.43 0.00 -0.85 -2.86 119.26 120.84 1im3 h ALA 149 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1im3 h ALA 149 Cb 1.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1im3 h ALA 149 CO 0.12 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.76 1im3 n ALA 150 N -2.49 2.49 -3.84 0.00 0.00 -0.62 -4.97 120.51 111.08 1im3 n ALA 150 Ca -0.00 -0.66 -0.26 0.00 0.00 0.00 0.00 53.44 52.51 1im3 n ALA 150 Cb 0.29 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 18.78 1im3 n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1im3 n HIS 151 N 0.83 -2.04 -0.08 0.00 -0.00 -0.46 -4.89 115.22 108.58 1im3 n HIS 151 Ca 0.17 0.86 -0.06 0.00 -0.00 0.00 0.00 57.72 58.69 1im3 n HIS 151 Cb 0.47 -4.10 0.13 0.00 -0.00 0.00 0.00 29.99 26.49 1im3 n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1im3 h VAL 152 N -1.95 1.26 -0.77 1.59 2.07 -1.61 -3.06 116.25 113.78 1im3 h VAL 152 Ca -0.60 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 65.68 1im3 h VAL 152 Cb 1.37 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 32.23 1im3 h VAL 152 CO 0.62 0.41 0.43 0.00 0.02 0.00 0.00 177.57 179.06 1im3 h ALA 153 N 1.16 0.98 -0.67 1.67 0.00 -1.89 -0.72 119.26 119.80 1im3 h ALA 153 Ca 0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1im3 h ALA 153 Cb 0.64 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1im3 h ALA 153 CO 0.04 0.48 0.29 0.93 0.00 0.00 0.00 179.25 181.00 1im3 h GLU 154 N 1.06 0.96 -0.20 0.00 3.07 -1.83 0.21 114.58 117.86 1im3 h GLU 154 Ca 0.27 -0.14 -0.11 0.00 -0.50 0.00 0.00 59.36 58.88 1im3 h GLU 154 Cb 0.02 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 27.75 1im3 h GLU 154 CO -0.05 0.77 -0.29 1.96 -1.40 0.00 0.00 179.01 180.00 1im3 h GLN 155 N 0.95 0.56 -0.62 2.33 4.20 -1.32 -2.81 115.11 118.39 1im3 h GLN 155 Ca 0.23 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 1im3 h GLN 155 Cb 0.15 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 1im3 h GLN 155 CO -0.02 0.93 0.22 -0.07 -0.67 0.00 0.00 178.83 179.22 1im3 h LEU 156 N 0.23 0.89 -0.45 1.46 3.38 -0.92 -2.60 115.31 117.29 1im3 h LEU 156 Ca 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1im3 h LEU 156 Cb 0.87 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1im3 h LEU 156 CO 0.07 0.84 0.29 -0.09 0.09 0.00 0.00 178.44 179.64 1im3 h ARG 157 N 0.88 0.60 -0.81 1.13 2.43 -0.97 0.33 114.38 117.97 1im3 h ARG 157 Ca 0.20 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1im3 h ARG 157 Cb 0.25 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.62 1im3 h ARG 157 CO -0.01 0.41 0.53 0.00 -1.51 0.00 0.00 179.97 179.38 1im3 h ALA 158 N 1.16 1.06 -0.01 2.80 0.00 -1.34 -1.30 119.26 121.64 1im3 h ALA 158 Ca 0.17 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1im3 h ALA 158 Cb -0.06 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1im3 h ALA 158 CO -0.03 0.37 -0.00 -0.92 0.00 0.00 0.00 179.25 178.66 1im3 h TYR 159 N 1.03 0.01 -0.95 0.00 3.20 -1.01 -1.41 116.97 117.85 1im3 h TYR 159 Ca 0.32 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.19 1im3 h TYR 159 Cb -0.02 -0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.20 1im3 h TYR 159 CO -0.02 0.43 0.59 -0.07 -1.64 0.00 0.00 178.16 177.44 1im3 h LEU 160 N -0.40 1.12 0.00 2.82 3.38 -0.21 0.22 115.31 122.24 1im3 h LEU 160 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1im3 h LEU 160 Cb 0.42 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1im3 h LEU 160 CO 0.00 0.85 -0.67 -0.33 0.09 0.00 0.00 178.44 178.37 1im3 h GLU 161 N 1.30 0.00 0.00 1.13 5.08 -1.31 -3.32 114.58 117.45 1im3 h GLU 161 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 1im3 h GLU 161 Cb -0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1im3 h GLU 161 CO -0.07 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.35 1im3 n GLY 162 N 1.19 0.18 0.31 -3.84 0.00 -0.53 -4.67 105.19 97.83 1im3 n GLY 162 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 1im3 n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1im3 h THR 163 N 0.00 0.18 0.03 2.61 2.02 -1.61 0.26 112.91 116.39 1im3 h THR 163 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1im3 h THR 163 Cb 0.00 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 66.56 1im3 h THR 163 CO 0.00 0.00 -0.17 0.00 0.37 0.00 0.00 175.52 175.72 1im3 h VAL 165 N -0.29 1.33 -0.36 0.00 -1.51 -1.56 -1.15 116.25 112.71 1im3 h VAL 165 Ca 0.05 -1.66 -0.03 0.00 -1.23 0.00 0.00 66.70 63.83 1im3 h VAL 165 Cb 0.34 1.79 -0.02 0.00 -2.13 0.00 0.00 31.29 31.27 1im3 h VAL 165 CO -0.14 0.49 0.13 -0.33 -1.23 0.00 0.00 177.57 176.49 1im3 h GLU 166 N 0.18 0.56 -0.06 5.19 5.08 -0.49 -0.92 114.58 124.11 1im3 h GLU 166 Ca 0.01 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.09 1im3 h GLU 166 Cb 0.90 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 1im3 h GLU 166 CO 0.07 0.56 -0.69 -1.49 -1.00 0.00 0.00 179.01 176.46 1im3 h TRP 167 N 0.44 0.36 -0.62 4.33 4.06 -1.01 -2.15 115.95 121.36 1im3 h TRP 167 Ca 0.12 -0.15 0.02 0.00 2.06 0.00 0.00 58.89 60.94 1im3 h TRP 167 Cb 0.22 -0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 28.29 1im3 h TRP 167 CO 0.00 0.87 0.39 1.25 -3.56 0.00 0.00 178.44 177.39 1im3 h LEU 168 N 0.18 0.64 -0.67 -4.49 5.85 -1.00 0.14 115.31 115.97 1im3 h LEU 168 Ca -0.02 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 1im3 h LEU 168 Cb 1.24 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 1im3 h LEU 168 CO 0.11 0.45 0.23 0.03 -0.34 0.00 0.00 178.44 178.93 1im3 h ARG 169 N 0.77 1.02 -0.73 1.25 3.08 -0.94 0.95 114.38 119.78 1im3 h ARG 169 Ca 0.24 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1im3 h ARG 169 Cb -0.01 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.85 1im3 h ARG 169 CO -0.09 0.87 0.45 -0.09 -1.07 0.00 0.00 179.97 180.04 1im3 h ARG 170 N 0.96 0.99 -0.47 0.04 2.43 -0.81 -1.54 114.38 115.98 1im3 h ARG 170 Ca 0.22 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1im3 h ARG 170 Cb 0.26 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1im3 h ARG 170 CO -0.01 0.70 0.03 1.88 -1.51 0.00 0.00 179.97 181.06 1im3 h TYR 171 N 1.00 0.86 -0.77 2.20 0.05 -0.16 -0.53 116.97 119.61 1im3 h TYR 171 Ca 0.26 -0.14 -0.00 0.00 0.05 0.00 0.00 58.73 58.91 1im3 h TYR 171 Cb -0.04 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 37.43 1im3 h TYR 171 CO -0.01 0.82 0.48 -0.07 -1.05 0.00 0.00 178.16 178.33 1im3 h LEU 172 N 0.66 0.91 0.19 3.88 3.38 -0.49 0.83 115.31 124.67 1im3 h LEU 172 Ca 0.14 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1im3 h LEU 172 Cb 0.45 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1im3 h LEU 172 CO 0.02 0.69 -0.09 -0.08 0.09 0.00 0.00 178.44 179.06 1im3 h GLU 173 N 1.06 -0.25 -0.84 1.13 4.57 -1.07 -0.48 114.58 118.70 1im3 h GLU 173 Ca 0.28 0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.56 1im3 h GLU 173 Cb -0.07 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 28.52 1im3 h GLU 173 CO -0.06 0.13 0.54 -0.91 -1.18 0.00 0.00 179.01 177.54 1im3 h ASN 174 N -0.92 0.76 -0.56 1.04 2.35 -1.00 -1.33 115.58 115.93 1im3 h ASN 174 Ca -0.03 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1im3 h ASN 174 Cb 0.49 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1im3 h ASN 174 CO 0.04 0.47 0.02 0.61 -1.65 0.00 0.00 177.43 176.92 1im3 n GLY 175 N -1.42 3.17 0.38 2.83 0.00 0.28 -4.67 105.19 105.75 1im3 n GLY 175 Ca 0.13 -0.95 0.20 0.00 0.00 0.00 0.00 46.02 45.41 1im3 n GLY 175 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1im3 h LYS 176 N 3.68 0.48 0.00 1.61 2.10 0.13 0.23 116.57 124.81 1im3 h LYS 176 Ca 0.02 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1im3 h LYS 176 Cb 1.97 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 33.19 1im3 h LYS 176 CO 0.49 0.32 -0.02 0.93 -2.00 0.00 0.00 179.45 179.17 1im3 h GLU 177 N 0.50 0.00 0.00 0.07 4.39 -1.84 -1.64 114.58 116.06 1im3 h GLU 177 Ca 0.62 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.32 1im3 h GLU 177 Cb 1.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.01 1im3 h GLU 177 CO -0.38 0.02 -0.88 0.25 -1.16 0.00 0.00 179.01 176.86 1im3 n THR 178 N -3.54 0.00 -0.08 1.13 -2.24 0.05 -4.43 114.28 105.18 1im3 n THR 178 Ca -0.03 -0.03 -0.11 0.00 -2.27 0.00 0.00 64.05 61.62 1im3 n THR 178 Cb 0.11 0.50 -0.15 0.00 -2.10 0.00 0.00 70.33 68.69 1im3 n THR 178 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1im3 n LEU 179 N -1.38 0.65 -0.29 3.22 4.77 0.60 -4.50 117.00 120.07 1im3 n LEU 179 Ca 0.00 0.12 0.09 0.00 -0.03 0.00 0.00 56.01 56.19 1im3 n LEU 179 Cb 0.00 0.20 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 1im3 n LEU 179 CO 0.00 0.52 0.17 0.00 -1.33 0.00 0.00 177.39 176.76 1im3 n GLN 180 N -2.92 1.32 -3.11 3.23 6.02 -0.63 -4.95 117.38 116.34 1im3 n GLN 180 Ca -0.29 -0.60 -0.22 0.00 -0.01 0.00 0.00 57.00 55.87 1im3 n GLN 180 Cb 1.11 -1.37 0.01 0.00 1.02 0.00 0.00 30.24 31.01 1im3 n GLN 180 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1im3 s ARG 181 N -2.35 3.10 0.25 -1.09 0.52 -1.16 -4.97 118.95 113.25 1im3 s ARG 181 Ca 0.13 -0.60 0.12 0.00 -0.52 0.00 0.00 55.73 54.86 1im3 s ARG 181 Cb 0.15 -2.62 -0.05 0.00 0.52 0.00 0.00 34.95 32.95 1im3 s ARG 181 CO 0.57 -0.18 -0.21 0.95 0.02 0.00 0.00 175.30 176.45 1im3 s THR 182 N -2.46 2.41 -0.21 0.02 -4.23 -1.26 -4.75 115.64 105.15 1im3 s THR 182 Ca 0.47 -2.29 0.01 0.00 -1.18 0.00 0.00 61.69 58.71 1im3 s THR 182 Cb -0.10 -2.23 0.05 0.00 1.34 0.00 0.00 72.50 71.56 1im3 s THR 182 CO 0.36 -0.32 -0.10 -1.81 -0.54 0.00 0.00 174.62 172.21 1im3 s ASP 183 N -3.24 3.63 0.45 3.99 1.11 0.22 -4.95 116.67 117.86 1im3 s ASP 183 Ca 0.27 -1.00 -0.23 0.00 0.18 0.00 0.00 52.55 51.77 1im3 s ASP 183 Cb -0.06 -1.30 -0.08 0.00 1.07 0.00 0.00 42.92 42.56 1im3 s ASP 183 CO 0.13 -0.16 1.12 0.00 1.18 0.00 0.00 175.17 177.45 1im3 s ALA 184 N 1.34 2.99 0.28 5.23 0.00 -1.26 -1.33 121.76 129.00 1im3 s ALA 184 Ca -0.03 0.84 -0.29 0.00 0.00 0.00 0.00 51.96 52.48 1im3 s ALA 184 Cb -0.17 -3.34 -0.10 0.00 0.00 0.00 0.00 23.12 19.51 1im3 s ALA 184 CO -0.08 -0.51 1.21 -1.25 0.00 0.00 0.00 175.76 175.13 1im3 s PRO 185 N -2.69 4.49 -0.21 0.00 0.04 -1.26 -4.45 135.00 130.91 1im3 s PRO 185 Ca 0.62 2.00 -0.17 0.00 0.04 0.00 0.00 61.00 63.50 1im3 s PRO 185 Cb -0.26 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.10 1im3 s PRO 185 CO 0.32 -0.02 0.44 0.15 0.04 0.00 0.00 177.00 177.92 1im3 s LYS 186 N -1.30 4.16 0.21 4.56 1.02 0.29 -4.82 119.74 123.86 1im3 s LYS 186 Ca 0.48 0.26 0.11 0.00 0.02 0.00 0.00 55.97 56.84 1im3 s LYS 186 Cb -0.36 -3.56 -0.04 0.00 -0.52 0.00 0.00 37.83 33.35 1im3 s LYS 186 CO 0.45 -0.10 -0.18 0.95 -0.92 0.00 0.00 175.35 175.55 1im3 s THR 187 N 1.51 2.67 0.10 2.17 -4.23 -1.26 -1.34 115.64 115.25 1im3 s THR 187 Ca 0.20 -1.99 -0.26 0.00 -1.18 0.00 0.00 61.69 58.46 1im3 s THR 187 Cb -0.15 -2.32 0.08 0.00 1.34 0.00 0.00 72.50 71.44 1im3 s THR 187 CO 0.09 -0.18 0.90 -1.38 -0.54 0.00 0.00 174.62 173.51 1im3 s HIS 188 N -1.86 -0.23 0.02 3.99 -3.43 -1.13 -5.00 115.29 107.64 1im3 s HIS 188 Ca 0.24 -0.01 0.06 0.00 -0.80 0.00 0.00 55.06 54.55 1im3 s HIS 188 Cb -0.08 0.60 -0.02 0.00 -1.43 0.00 0.00 32.58 31.66 1im3 s HIS 188 CO 0.13 -0.74 -0.18 1.41 -2.00 0.00 0.00 174.74 173.35 1im3 s MET 189 N -3.28 1.35 0.21 -0.38 1.75 -1.26 -0.80 119.30 116.90 1im3 s MET 189 Ca 0.09 -0.78 0.11 0.00 -1.25 0.00 0.00 55.69 53.86 1im3 s MET 189 Cb -0.01 -1.38 -0.04 0.00 2.84 0.00 0.00 34.83 36.23 1im3 s MET 189 CO -0.02 0.36 -0.19 0.95 -0.65 0.00 0.00 175.02 175.47 1im3 s THR 190 N -0.63 2.63 -0.09 10.11 -4.23 -0.03 -4.95 115.64 118.44 1im3 s THR 190 Ca 0.06 -2.02 0.03 0.00 -1.18 0.00 0.00 61.69 58.58 1im3 s THR 190 Cb -0.08 -2.30 0.01 0.00 1.34 0.00 0.00 72.50 71.47 1im3 s THR 190 CO 0.01 -0.18 -0.17 -2.28 -0.54 0.00 0.00 174.62 171.45 1im3 s HIS 191 N -1.88 2.04 -0.12 3.99 2.46 -1.26 -0.98 115.29 119.54 1im3 s HIS 191 Ca 0.24 -0.87 -0.01 0.00 0.47 0.00 0.00 55.06 54.89 1im3 s HIS 191 Cb -0.07 -1.43 0.03 0.00 -0.13 0.00 0.00 32.58 30.98 1im3 s HIS 191 CO 0.13 -0.41 -0.04 -1.01 -2.47 0.00 0.00 174.74 170.94 1im3 s HIS 192 N 0.68 1.29 -0.14 3.88 3.76 -0.53 -4.99 115.29 119.24 1im3 s HIS 192 Ca -0.13 -0.69 -0.29 0.00 -0.15 0.00 0.00 55.06 53.80 1im3 s HIS 192 Cb -0.16 -1.13 -0.03 0.00 1.11 0.00 0.00 32.58 32.38 1im3 s HIS 192 CO 0.03 -0.50 1.40 0.00 -0.85 0.00 0.00 174.74 174.82 1im3 s ALA 193 N 1.77 3.62 0.02 -1.40 0.00 -1.26 -0.55 121.76 123.96 1im3 s ALA 193 Ca 0.03 0.59 -0.05 0.00 0.00 0.00 0.00 51.96 52.53 1im3 s ALA 193 Cb -0.14 -3.68 -0.29 0.00 0.00 0.00 0.00 23.12 19.02 1im3 s ALA 193 CO -0.07 -1.30 0.95 0.28 0.00 0.00 0.00 175.76 175.61 1im3 h VAL 194 N 5.57 1.26 -1.67 0.00 2.07 -1.58 -3.48 116.25 118.41 1im3 h VAL 194 Ca -0.31 -2.85 0.00 0.00 0.82 0.00 0.00 66.70 64.37 1im3 h VAL 194 Cb 1.13 2.85 0.00 0.00 -1.52 0.00 0.00 31.29 33.74 1im3 h VAL 194 CO 0.97 0.84 0.00 -1.54 0.02 0.00 0.00 177.57 177.86 1im3 n SER 195 N -3.51 0.00 -0.19 0.57 3.41 -0.81 -4.96 113.62 108.12 1im3 n SER 195 Ca -0.15 -0.77 0.14 0.00 -0.26 0.00 0.00 58.87 57.83 1im3 n SER 195 Cb 1.05 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 65.53 1im3 n SER 195 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1im3 n ASP 196 N -0.70 0.75 -0.07 4.04 -0.08 -1.26 -3.85 116.55 115.39 1im3 n ASP 196 Ca 0.00 -0.79 -0.07 0.00 -1.51 0.00 0.00 54.79 52.42 1im3 n ASP 196 Cb 0.00 0.01 -0.10 0.00 2.34 0.00 0.00 41.12 43.37 1im3 n ASP 196 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1im3 n HIS 197 N -0.74 0.00 -4.30 -0.67 8.25 -1.26 -4.69 115.22 111.82 1im3 n HIS 197 Ca 0.14 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.40 1im3 n HIS 197 Cb 0.30 -0.64 -0.11 0.00 1.12 0.00 0.00 29.99 30.66 1im3 n HIS 197 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1im3 s GLU 198 N -2.32 1.17 0.01 -0.41 2.02 -1.25 0.99 118.70 118.92 1im3 s GLU 198 Ca -0.08 -1.33 -0.03 0.00 0.02 0.00 0.00 54.97 53.55 1im3 s GLU 198 Cb 0.04 -1.17 -0.01 0.00 0.10 0.00 0.00 34.13 33.09 1im3 s GLU 198 CO 0.52 0.23 0.04 0.00 0.02 0.00 0.00 175.26 176.08 1im3 s ALA 199 N -2.05 -0.08 -0.19 5.21 0.00 0.62 -1.45 121.76 123.83 1im3 s ALA 199 Ca 0.13 -0.39 -0.06 0.00 0.00 0.00 0.00 51.96 51.64 1im3 s ALA 199 Cb -0.06 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 1im3 s ALA 199 CO 0.05 -0.18 0.03 0.99 0.00 0.00 0.00 175.76 176.65 1im3 s THR 200 N -1.43 4.35 -0.19 0.00 2.01 0.28 0.16 115.64 120.83 1im3 s THR 200 Ca -0.15 -0.18 -0.06 0.00 0.31 0.00 0.00 61.69 61.61 1im3 s THR 200 Cb -0.09 -2.96 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 1im3 s THR 200 CO 0.00 0.44 0.02 -0.76 -0.69 0.00 0.00 174.62 173.63 1im3 s LEU 201 N 0.72 3.43 -0.13 4.42 1.43 -0.38 -1.45 118.68 126.72 1im3 s LEU 201 Ca 0.02 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.03 1im3 s LEU 201 Cb -0.14 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1im3 s LEU 201 CO 0.02 0.10 -0.21 -0.60 0.23 0.00 0.00 176.35 175.89 1im3 s ARG 202 N 0.79 3.08 -0.26 1.70 3.52 -0.15 -1.46 118.95 126.17 1im3 s ARG 202 Ca 0.01 -0.83 -0.10 0.00 -0.13 0.00 0.00 55.73 54.68 1im3 s ARG 202 Cb -0.14 -2.44 -0.04 0.00 -1.56 0.00 0.00 34.95 30.76 1im3 s ARG 202 CO 0.02 0.06 0.15 0.00 -0.81 0.00 0.00 175.30 174.71 1im3 s TRP 204 N 1.56 3.31 -0.14 0.00 0.52 0.02 -1.50 118.94 122.72 1im3 s TRP 204 Ca 0.07 0.28 -0.00 0.00 0.02 0.00 0.00 56.10 56.47 1im3 s TRP 204 Cb -0.15 -1.87 0.03 0.00 -1.15 0.00 0.00 33.47 30.33 1im3 s TRP 204 CO 0.08 0.52 -0.08 0.00 0.02 0.00 0.00 176.95 177.49 1im3 s ALA 205 N -0.79 1.50 0.13 0.98 0.00 0.01 -2.83 121.76 120.76 1im3 s ALA 205 Ca 0.13 -0.74 0.06 0.00 0.00 0.00 0.00 51.96 51.41 1im3 s ALA 205 Cb -0.12 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 1im3 s ALA 205 CO 0.03 -0.56 -0.14 -0.51 0.00 0.00 0.00 175.76 174.58 1im3 s LEU 206 N 1.63 2.42 -1.42 0.00 1.43 -0.45 -1.02 118.68 121.27 1im3 s LEU 206 Ca 0.03 -0.83 -0.09 0.00 -1.03 0.00 0.00 54.13 52.21 1im3 s LEU 206 Cb -0.14 -0.54 0.04 0.00 0.03 0.00 0.00 46.19 45.58 1im3 s LEU 206 CO -0.08 -0.16 1.01 -0.24 0.23 0.00 0.00 176.35 177.11 1im3 n SER 207 N 0.46 -4.50 -4.72 2.29 2.88 -0.69 -0.54 113.62 108.80 1im3 n SER 207 Ca -0.15 -0.70 -0.24 0.00 -1.33 0.00 0.00 58.87 56.46 1im3 n SER 207 Cb 0.57 -4.37 -0.06 0.00 -0.75 0.00 0.00 64.21 59.60 1im3 n SER 207 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1im3 s PHE 208 N -3.37 2.90 -0.23 0.66 -0.12 -0.96 -4.58 117.98 112.28 1im3 s PHE 208 Ca 0.48 -0.15 -0.17 0.00 -0.05 0.00 0.00 56.93 57.04 1im3 s PHE 208 Cb -0.23 -1.33 0.06 0.00 -0.63 0.00 0.00 43.02 40.90 1im3 s PHE 208 CO 0.79 0.56 0.58 -0.47 -0.05 0.00 0.00 175.22 176.63 1im3 s TYR 209 N -2.08 -0.75 1.12 3.49 5.04 -0.44 -0.20 117.35 123.52 1im3 s TYR 209 Ca 0.31 1.68 -0.16 0.00 -2.44 0.00 0.00 57.07 56.45 1im3 s TYR 209 Cb -0.08 0.35 0.25 0.00 0.35 0.00 0.00 41.96 42.83 1im3 s TYR 209 CO 0.21 -0.38 1.10 -1.25 -1.34 0.00 0.00 175.55 173.90 1im3 s PRO 210 N 0.90 -0.56 0.36 4.97 0.04 -1.26 -0.61 135.00 138.83 1im3 s PRO 210 Ca -0.05 0.17 0.07 0.00 0.04 0.00 0.00 61.00 61.23 1im3 s PRO 210 Cb -0.05 -1.65 0.68 0.00 0.04 0.00 0.00 34.50 33.52 1im3 s PRO 210 CO -0.08 -3.32 1.89 0.00 0.04 0.00 0.00 177.00 175.53 1im3 h ALA 211 N -2.31 1.42 -2.03 8.56 0.00 -1.95 -3.44 119.26 119.51 1im3 h ALA 211 Ca -0.49 -0.21 -0.62 0.00 0.00 0.00 0.00 54.91 53.58 1im3 h ALA 211 Cb 1.31 -0.12 0.04 0.00 0.00 0.00 0.00 17.79 19.02 1im3 h ALA 211 CO 0.45 0.40 0.85 -1.91 0.00 0.00 0.00 179.25 179.03 1im3 n GLU 212 N -4.27 1.91 -3.46 0.00 4.07 -1.26 -4.96 120.64 112.67 1im3 n GLU 212 Ca 0.00 0.69 -0.13 0.00 -0.06 0.00 0.00 57.16 57.67 1im3 n GLU 212 Cb 0.26 -2.46 -0.03 0.00 -0.06 0.00 0.00 31.44 29.16 1im3 n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1im3 s ILE 213 N 2.07 0.00 -0.10 6.31 2.07 -1.26 -4.71 121.20 125.59 1im3 s ILE 213 Ca 0.86 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 60.09 1im3 s ILE 213 Cb -0.76 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 40.85 1im3 s ILE 213 CO 0.46 0.00 -0.05 -0.89 -1.91 0.00 0.00 174.94 172.55 1im3 s THR 214 N -3.05 0.83 -0.18 4.00 2.01 -0.74 -5.00 115.64 113.52 1im3 s THR 214 Ca -0.01 -0.17 -0.02 0.00 0.31 0.00 0.00 61.69 61.80 1im3 s THR 214 Cb -0.01 -0.88 -0.01 0.00 0.01 0.00 0.00 72.50 71.61 1im3 s THR 214 CO -0.07 0.33 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.33 1im3 s LEU 215 N 1.72 2.75 0.01 4.42 1.02 -1.26 -1.15 118.68 126.19 1im3 s LEU 215 Ca 0.04 -0.38 0.00 0.00 0.02 0.00 0.00 54.13 53.81 1im3 s LEU 215 Cb -0.13 -1.66 -0.01 0.00 0.02 0.00 0.00 46.19 44.41 1im3 s LEU 215 CO -0.07 0.07 -0.03 0.42 0.02 0.00 0.00 176.35 176.76 1im3 s THR 216 N 0.95 0.14 0.01 5.49 -4.23 -0.57 -4.98 115.64 112.45 1im3 s THR 216 Ca -0.02 -0.55 -0.00 0.00 -1.18 0.00 0.00 61.69 59.94 1im3 s THR 216 Cb -0.15 -0.21 -0.04 0.00 1.34 0.00 0.00 72.50 73.44 1im3 s THR 216 CO -0.00 -0.26 0.12 0.26 -0.54 0.00 0.00 174.62 174.19 1im3 s TRP 217 N -0.83 3.37 0.03 3.99 0.52 -1.26 -0.06 118.94 124.70 1im3 s TRP 217 Ca -0.08 0.23 0.03 0.00 0.02 0.00 0.00 56.10 56.30 1im3 s TRP 217 Cb -0.06 -1.75 -0.02 0.00 -1.15 0.00 0.00 33.47 30.50 1im3 s TRP 217 CO -0.00 0.58 -0.10 -0.65 0.02 0.00 0.00 176.95 176.80 1im3 s GLN 218 N -1.98 0.64 -0.18 4.98 -0.21 0.59 -0.84 119.66 122.67 1im3 s GLN 218 Ca 0.26 -0.66 0.01 0.00 0.02 0.00 0.00 55.36 55.00 1im3 s GLN 218 Cb -0.12 -0.54 0.02 0.00 1.00 0.00 0.00 33.01 33.37 1im3 s GLN 218 CO 0.18 0.12 -0.18 0.50 -2.12 0.00 0.00 175.29 173.80 1im3 s ARG 219 N -1.17 2.76 -1.51 2.91 3.52 0.52 -0.69 118.95 125.28 1im3 s ARG 219 Ca -0.04 -0.81 -0.13 0.00 -0.13 0.00 0.00 55.73 54.62 1im3 s ARG 219 Cb -0.08 -2.49 0.08 0.00 -1.56 0.00 0.00 34.95 30.90 1im3 s ARG 219 CO 0.01 -0.25 1.01 -0.25 -0.81 0.00 0.00 175.30 175.00 1im3 n ASP 220 N 4.64 -4.95 0.00 -2.12 8.00 -0.53 -1.62 116.55 119.97 1im3 n ASP 220 Ca -0.19 -0.75 0.00 0.00 0.71 0.00 0.00 54.79 54.55 1im3 n ASP 220 Cb 0.49 -4.01 0.00 0.00 -0.02 0.00 0.00 41.12 37.58 1im3 n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1im3 n GLY 221 N -1.73 0.42 3.36 0.44 0.00 -1.26 -5.03 105.19 101.40 1im3 n GLY 221 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1im3 n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1im3 s GLU 222 N -0.38 2.03 0.43 1.61 2.02 -0.64 -5.04 118.70 118.73 1im3 s GLU 222 Ca 0.00 -0.98 -0.25 0.00 0.02 0.00 0.00 54.97 53.76 1im3 s GLU 222 Cb 0.00 -2.07 -0.10 0.00 0.10 0.00 0.00 34.13 32.06 1im3 s GLU 222 CO 0.00 0.55 1.18 -0.25 0.02 0.00 0.00 175.26 176.76 1im3 n ASP 223 N 2.05 2.10 -3.99 -0.19 8.00 -1.26 -0.36 116.55 122.90 1im3 n ASP 223 Ca -0.16 1.08 -0.27 0.00 0.71 0.00 0.00 54.79 56.15 1im3 n ASP 223 Cb 0.52 -1.45 -0.17 0.00 -0.02 0.00 0.00 41.12 40.00 1im3 n ASP 223 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1im3 s GLN 224 N -2.17 1.82 -0.10 -1.24 -1.52 -0.02 -4.75 119.66 111.67 1im3 s GLN 224 Ca 0.62 -0.41 0.00 0.00 -1.95 0.00 0.00 55.36 53.62 1im3 s GLN 224 Cb -0.52 -1.63 -0.06 0.00 -0.22 0.00 0.00 33.01 30.58 1im3 s GLN 224 CO 0.57 -0.10 -0.09 2.41 -0.25 0.00 0.00 175.29 177.82 1im3 n THR 225 N 4.32 0.56 -1.92 -0.19 -1.04 -1.26 -4.41 114.28 110.35 1im3 n THR 225 Ca -0.18 -0.21 -0.41 0.00 -2.04 0.00 0.00 64.05 61.21 1im3 n THR 225 Cb 0.51 -0.94 -0.01 0.00 -1.82 0.00 0.00 70.33 68.07 1im3 n THR 225 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1im3 s GLN 226 N -2.20 4.21 -1.57 -2.82 0.74 -1.26 -2.60 119.66 114.16 1im3 s GLN 226 Ca -0.13 2.43 0.00 0.00 0.05 0.00 0.00 55.36 57.70 1im3 s GLN 226 Cb 0.04 -3.03 0.00 0.00 1.10 0.00 0.00 33.01 31.11 1im3 s GLN 226 CO 0.22 -0.44 0.00 -0.25 -0.55 0.00 0.00 175.29 174.27 1im3 n ASP 227 N 1.24 -4.93 -4.51 6.67 10.43 -1.26 -4.87 116.55 119.32 1im3 n ASP 227 Ca 0.03 0.19 -0.25 0.00 2.57 0.00 0.00 54.79 57.33 1im3 n ASP 227 Cb 0.40 -3.96 -0.10 0.00 1.84 0.00 0.00 41.12 39.30 1im3 n ASP 227 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1im3 s THR 228 N -2.72 2.76 -0.01 -3.53 -4.23 -1.07 -0.66 115.64 106.17 1im3 s THR 228 Ca 0.00 -2.11 0.01 0.00 -1.18 0.00 0.00 61.69 58.41 1im3 s THR 228 Cb 0.00 -2.41 0.01 0.00 1.34 0.00 0.00 72.50 71.44 1im3 s THR 228 CO 0.00 -0.28 -0.01 -0.70 -0.54 0.00 0.00 174.62 173.08 1im3 s GLU 229 N -3.24 0.19 -0.16 3.99 2.12 0.10 -4.96 118.70 116.75 1im3 s GLU 229 Ca 0.27 -0.01 -0.00 0.00 0.36 0.00 0.00 54.97 55.59 1im3 s GLU 229 Cb -0.07 -0.26 0.04 0.00 0.26 0.00 0.00 34.13 34.10 1im3 s GLU 229 CO 0.15 -0.02 -0.07 -1.17 -0.54 0.00 0.00 175.26 173.61 1im3 s LEU 230 N 0.34 1.58 0.59 2.70 2.96 -1.26 0.13 118.68 125.72 1im3 s LEU 230 Ca -0.03 -0.59 -0.09 0.00 -0.22 0.00 0.00 54.13 53.20 1im3 s LEU 230 Cb -0.05 -0.94 -0.03 0.00 0.50 0.00 0.00 46.19 45.66 1im3 s LEU 230 CO -0.01 -0.16 0.97 0.68 -1.32 0.00 0.00 176.35 176.51 1im3 s VAL 231 N 1.62 4.62 0.37 1.68 -7.23 -1.11 -5.01 120.40 115.34 1im3 s VAL 231 Ca 0.02 0.64 -0.28 0.00 -1.81 0.00 0.00 61.98 60.55 1im3 s VAL 231 Cb -0.15 -3.82 -0.10 0.00 0.56 0.00 0.00 36.38 32.87 1im3 s VAL 231 CO -0.08 -1.00 1.38 -0.70 -0.31 0.00 0.00 175.10 174.39 1im3 s GLU 232 N -5.07 4.14 0.35 4.82 2.12 -1.26 -4.66 118.70 119.13 1im3 s GLU 232 Ca 0.53 2.35 -0.29 0.00 0.36 0.00 0.00 54.97 57.93 1im3 s GLU 232 Cb -0.11 -2.94 -0.11 0.00 0.26 0.00 0.00 34.13 31.23 1im3 s GLU 232 CO 0.51 -0.42 1.52 2.41 -0.54 0.00 0.00 175.26 178.74 1im3 n THR 233 N 0.47 1.69 -4.13 -1.70 -1.04 -1.26 -4.84 114.28 103.47 1im3 n THR 233 Ca 0.01 -0.42 -0.16 0.00 -2.04 0.00 0.00 64.05 61.45 1im3 n THR 233 Cb 0.41 -1.97 -0.12 0.00 -1.82 0.00 0.00 70.33 66.83 1im3 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1im3 s ARG 234 N -1.59 0.70 0.08 -2.82 1.70 0.07 -4.96 118.95 112.13 1im3 s ARG 234 Ca 0.57 -0.90 -0.30 0.00 -0.47 0.00 0.00 55.73 54.62 1im3 s ARG 234 Cb -0.48 -0.56 -0.06 0.00 -0.57 0.00 0.00 34.95 33.28 1im3 s ARG 234 CO 0.59 0.11 1.15 -1.25 -1.08 0.00 0.00 175.30 174.83 1im3 s PRO 235 N -1.84 4.48 0.46 3.89 0.04 -1.26 -0.38 135.00 140.40 1im3 s PRO 235 Ca -0.04 1.72 0.26 0.00 0.04 0.00 0.00 61.00 62.98 1im3 s PRO 235 Cb -0.09 -3.34 0.77 0.00 0.04 0.00 0.00 34.50 31.88 1im3 s PRO 235 CO 0.01 -0.17 1.76 0.00 0.04 0.00 0.00 177.00 178.65 1im3 h ALA 236 N 6.44 0.97 0.00 8.56 0.00 -1.45 -3.47 119.26 130.32 1im3 h ALA 236 Ca -0.42 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1im3 h ALA 236 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1im3 h ALA 236 CO 0.79 0.11 0.00 0.41 0.00 0.00 0.00 179.25 180.56 1im3 n GLY 237 N 0.58 0.42 0.57 0.00 0.00 -1.26 -4.92 105.19 100.57 1im3 n GLY 237 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 1im3 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1im3 n ASP 238 N 0.00 3.10 0.00 1.61 5.68 -1.26 -4.95 116.55 120.73 1im3 n ASP 238 Ca 0.00 -2.57 0.00 0.00 -0.50 0.00 0.00 54.79 51.72 1im3 n ASP 238 Cb 0.00 -0.36 0.00 0.00 -1.14 0.00 0.00 41.12 39.62 1im3 n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1im3 n GLY 239 N -0.33 1.97 4.00 6.12 0.00 -1.26 -5.08 105.19 110.62 1im3 n GLY 239 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 1im3 n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1im3 s THR 240 N -2.47 2.24 0.27 2.61 -4.23 -1.26 -4.88 115.64 107.92 1im3 s THR 240 Ca 0.00 -1.09 0.05 0.00 -1.18 0.00 0.00 61.69 59.46 1im3 s THR 240 Cb 0.00 -2.34 -0.06 0.00 1.34 0.00 0.00 72.50 71.45 1im3 s THR 240 CO 0.00 0.00 -0.01 -0.36 -0.54 0.00 0.00 174.62 173.71 1im3 s PHE 241 N -2.62 1.79 0.05 3.99 0.08 0.73 -1.15 117.98 120.85 1im3 s PHE 241 Ca 0.56 -0.85 0.01 0.00 0.12 0.00 0.00 56.93 56.77 1im3 s PHE 241 Cb -0.06 -1.06 -0.03 0.00 -0.57 0.00 0.00 43.02 41.30 1im3 s PHE 241 CO 0.35 0.09 -0.05 -0.65 -0.10 0.00 0.00 175.22 174.85 1im3 s GLN 242 N -3.82 0.55 -0.14 0.44 -0.21 0.49 -1.70 119.66 115.27 1im3 s GLN 242 Ca 0.30 -0.94 -0.30 0.00 0.02 0.00 0.00 55.36 54.44 1im3 s GLN 242 Cb 0.06 -0.05 0.11 0.00 1.00 0.00 0.00 33.01 34.13 1im3 s GLN 242 CO 0.11 -0.03 0.91 0.21 -2.12 0.00 0.00 175.29 174.37 1im3 s LYS 243 N -2.55 0.72 0.07 2.91 2.20 -0.18 -0.75 119.74 122.15 1im3 s LYS 243 Ca -0.03 0.24 -0.01 0.00 -0.36 0.00 0.00 55.97 55.81 1im3 s LYS 243 Cb -0.03 0.34 -0.04 0.00 -1.51 0.00 0.00 37.83 36.59 1im3 s LYS 243 CO -0.03 -0.21 -0.02 1.67 -0.36 0.00 0.00 175.35 176.40 1im3 s TRP 244 N -0.96 0.60 -0.02 4.03 1.48 -1.26 -0.81 118.94 122.00 1im3 s TRP 244 Ca -0.04 -1.09 0.01 0.00 -1.06 0.00 0.00 56.10 53.92 1im3 s TRP 244 Cb -0.01 -0.41 0.02 0.00 -1.16 0.00 0.00 33.47 31.90 1im3 s TRP 244 CO 0.03 -0.39 -0.01 0.00 -4.06 0.00 0.00 176.95 172.52 1im3 s ALA 245 N -3.93 0.26 0.19 2.67 0.00 -0.56 -2.74 121.76 117.66 1im3 s ALA 245 Ca 0.10 0.07 0.10 0.00 0.00 0.00 0.00 51.96 52.23 1im3 s ALA 245 Cb 0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 1im3 s ALA 245 CO -0.08 -0.02 -0.21 0.00 0.00 0.00 0.00 175.76 175.45 1im3 s ALA 246 N 0.60 2.28 -0.05 0.00 0.00 0.12 -0.01 121.76 124.69 1im3 s ALA 246 Ca -0.06 -1.58 -0.03 0.00 0.00 0.00 0.00 51.96 50.29 1im3 s ALA 246 Cb -0.09 -0.25 0.03 0.00 0.00 0.00 0.00 23.12 22.82 1im3 s ALA 246 CO -0.01 0.31 0.12 0.54 0.00 0.00 0.00 175.76 176.73 1im3 s VAL 247 N -1.95 -0.04 -0.22 0.00 0.11 -0.53 0.03 120.40 117.80 1im3 s VAL 247 Ca 0.19 0.14 -0.18 0.00 -2.93 0.00 0.00 61.98 59.20 1im3 s VAL 247 Cb -0.06 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.55 1im3 s VAL 247 CO 0.09 0.06 0.50 -0.69 -3.33 0.00 0.00 175.10 171.72 1im3 s VAL 248 N 0.89 5.10 0.23 2.04 1.01 0.16 -1.25 120.40 128.59 1im3 s VAL 248 Ca -0.07 0.89 0.09 0.00 0.00 0.00 0.00 61.98 62.89 1im3 s VAL 248 Cb -0.09 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1im3 s VAL 248 CO -0.04 0.15 -0.16 0.68 0.00 0.00 0.00 175.10 175.73 1im3 s VAL 249 N 1.86 1.93 0.24 2.92 -7.23 0.12 -4.92 120.40 115.32 1im3 s VAL 249 Ca 0.22 -2.26 -0.30 0.00 -1.81 0.00 0.00 61.98 57.83 1im3 s VAL 249 Cb -0.15 -2.13 -0.09 0.00 0.56 0.00 0.00 36.38 34.57 1im3 s VAL 249 CO 0.09 -0.53 1.23 -2.84 -0.31 0.00 0.00 175.10 172.74 1im3 s PRO 250 N -3.61 4.47 0.28 4.82 0.02 -1.26 -0.27 135.00 139.45 1im3 s PRO 250 Ca 0.25 1.98 -0.30 0.00 0.02 0.00 0.00 61.00 62.95 1im3 s PRO 250 Cb -0.02 -3.18 -0.13 0.00 0.02 0.00 0.00 34.50 31.19 1im3 s PRO 250 CO 0.09 -0.09 1.35 0.43 -0.33 0.00 0.00 177.00 178.46 1im3 n SER 251 N 1.95 2.75 0.00 2.53 7.64 0.28 -2.00 113.62 126.77 1im3 n SER 251 Ca 0.03 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.08 1im3 n SER 251 Cb 0.44 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.18 1im3 n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1im3 n GLY 252 N 1.58 0.96 0.12 0.23 0.00 -1.26 -4.88 105.19 101.94 1im3 n GLY 252 Ca 0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.12 1im3 n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1im3 n GLN 253 N -2.00 2.03 -0.33 1.61 6.02 -0.85 -4.73 117.38 119.14 1im3 n GLN 253 Ca 0.00 -1.36 0.27 0.00 -0.01 0.00 0.00 57.00 55.90 1im3 n GLN 253 Cb 0.00 -1.05 0.51 0.00 1.02 0.00 0.00 30.24 30.72 1im3 n GLN 253 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1im3 h GLU 254 N 0.42 0.07 0.00 -1.09 3.07 -1.90 0.37 114.58 115.52 1im3 h GLU 254 Ca 0.00 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1im3 h GLU 254 Cb 0.43 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1im3 h GLU 254 CO 0.00 0.05 0.00 1.96 -1.40 0.00 0.00 179.01 179.62 1im3 h GLN 255 N 0.08 0.00 0.00 2.33 1.08 -1.87 -2.31 115.11 114.42 1im3 h GLN 255 Ca 0.78 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.92 1im3 h GLN 255 Cb 1.93 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.36 1im3 h GLN 255 CO -0.75 0.00 -0.27 0.00 -0.95 0.00 0.00 178.83 176.85 1im3 h ARG 256 N 0.00 0.00 -6.23 1.46 3.08 -0.62 -3.46 114.38 108.61 1im3 h ARG 256 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 1im3 h ARG 256 Cb 0.10 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 1im3 h ARG 256 CO 0.00 0.27 -0.03 0.71 -1.07 0.00 0.00 179.97 179.85 1im3 s TYR 257 N -3.37 3.80 0.01 3.04 1.51 -0.87 -1.45 117.35 120.02 1im3 s TYR 257 Ca 0.03 1.28 0.03 0.00 -1.01 0.00 0.00 57.07 57.39 1im3 s TYR 257 Cb 0.09 -2.51 -0.01 0.00 -0.11 0.00 0.00 41.96 39.42 1im3 s TYR 257 CO 0.67 0.58 -0.09 0.95 -1.11 0.00 0.00 175.55 176.55 1im3 s THR 258 N -1.06 0.67 -0.18 -0.71 -4.23 0.13 -4.34 115.64 105.92 1im3 s THR 258 Ca 0.29 -0.51 -0.07 0.00 -1.18 0.00 0.00 61.69 60.22 1im3 s THR 258 Cb -0.20 -0.59 -0.04 0.00 1.34 0.00 0.00 72.50 73.01 1im3 s THR 258 CO 0.19 0.09 0.05 0.00 -0.54 0.00 0.00 174.62 174.41 1im3 s HIS 260 N 0.31 2.83 -0.23 0.00 3.76 0.91 -0.45 115.29 122.43 1im3 s HIS 260 Ca 0.03 -0.83 -0.03 0.00 -0.15 0.00 0.00 55.06 54.07 1im3 s HIS 260 Cb -0.12 -1.90 -0.00 0.00 1.11 0.00 0.00 32.58 31.66 1im3 s HIS 260 CO 0.00 -0.36 -0.05 0.08 -0.85 0.00 0.00 174.74 173.57 1im3 s VAL 261 N 0.69 3.26 -0.11 -0.90 1.01 0.01 -1.51 120.40 122.84 1im3 s VAL 261 Ca -0.06 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1im3 s VAL 261 Cb -0.15 -2.51 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 1im3 s VAL 261 CO 0.02 0.38 -0.13 -1.10 0.00 0.00 0.00 175.10 174.27 1im3 s GLN 262 N 1.45 3.17 -0.26 2.72 -0.21 -0.30 -1.51 119.66 124.72 1im3 s GLN 262 Ca 0.05 -0.69 -0.26 0.00 0.02 0.00 0.00 55.36 54.49 1im3 s GLN 262 Cb -0.15 -2.57 0.09 0.00 1.00 0.00 0.00 33.01 31.38 1im3 s GLN 262 CO -0.04 0.32 0.81 -1.58 -2.12 0.00 0.00 175.29 172.68 1im3 s HIS 263 N 0.08 -0.68 0.52 0.91 2.46 -1.26 -1.79 115.29 115.53 1im3 s HIS 263 Ca -0.05 1.63 0.36 0.00 0.47 0.00 0.00 55.06 57.47 1im3 s HIS 263 Cb -0.15 0.31 1.97 0.00 -0.13 0.00 0.00 32.58 34.58 1im3 s HIS 263 CO 0.04 -0.35 2.10 0.93 -2.47 0.00 0.00 174.74 174.99 1im3 h GLU 264 N 4.59 0.00 -0.08 2.88 5.08 -1.94 -1.10 114.58 124.01 1im3 h GLU 264 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1im3 h GLU 264 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1im3 h GLU 264 CO 0.09 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.51 1im3 n GLY 265 N -1.16 -0.38 3.49 -3.84 0.00 -1.26 -4.83 105.19 97.21 1im3 n GLY 265 Ca -0.02 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 1im3 n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1im3 s LEU 266 N -1.58 2.93 0.25 0.99 1.43 -0.42 -4.38 118.68 117.89 1im3 s LEU 266 Ca 0.30 -0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.19 1im3 s LEU 266 Cb 0.15 -1.63 0.31 0.00 0.03 0.00 0.00 46.19 45.05 1im3 s LEU 266 CO 0.24 0.30 1.91 -0.65 0.23 0.00 0.00 176.35 178.37 1im3 h PRO 267 N 5.71 1.23 -3.39 1.29 0.11 -1.88 -3.44 132.00 131.63 1im3 h PRO 267 Ca -0.42 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 1im3 h PRO 267 Cb 1.17 -0.28 -0.17 0.00 0.11 0.00 0.00 31.00 31.84 1im3 h PRO 267 CO 0.53 0.81 -0.28 -1.59 -0.21 0.00 0.00 178.00 177.27 1im3 s LYS 268 N -6.09 0.80 0.51 1.05 -2.85 -1.26 -5.15 119.74 106.75 1im3 s LYS 268 Ca -0.13 -0.57 -0.20 0.00 -1.00 0.00 0.00 55.97 54.07 1im3 s LYS 268 Cb 0.19 0.34 -0.10 0.00 -2.06 0.00 0.00 37.83 36.20 1im3 s LYS 268 CO 0.81 -0.26 0.65 -2.30 0.10 0.00 0.00 175.35 174.36 1im3 n PRO 269 N 0.52 0.70 -4.01 1.78 -0.02 -1.26 -4.98 135.00 127.73 1im3 n PRO 269 Ca -0.18 0.26 -0.31 0.00 -2.02 0.00 0.00 63.50 61.26 1im3 n PRO 269 Cb 0.60 -1.75 -0.06 0.00 -0.02 0.00 0.00 33.50 32.27 1im3 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1im3 s LEU 270 N 0.54 3.98 -0.09 2.45 1.43 -0.57 -4.94 118.68 121.49 1im3 s LEU 270 Ca 0.67 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.87 1im3 s LEU 270 Cb -0.50 -2.64 0.01 0.00 0.03 0.00 0.00 46.19 43.10 1im3 s LEU 270 CO 0.55 0.17 -0.13 -0.89 0.23 0.00 0.00 176.35 176.28 1im3 s THR 271 N -1.43 1.27 0.05 5.49 2.01 -1.26 -0.81 115.64 120.95 1im3 s THR 271 Ca 0.31 -0.52 0.09 0.00 0.31 0.00 0.00 61.69 61.88 1im3 s THR 271 Cb -0.12 -1.17 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 1im3 s THR 271 CO 0.24 0.39 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.55 1im3 s LEU 272 N 0.89 2.27 0.06 4.42 1.02 0.41 -4.94 118.68 122.80 1im3 s LEU 272 Ca -0.10 -0.56 0.03 0.00 0.02 0.00 0.00 54.13 53.53 1im3 s LEU 272 Cb -0.15 -1.33 -0.03 0.00 0.02 0.00 0.00 46.19 44.70 1im3 s LEU 272 CO 0.01 0.26 -0.11 -0.60 0.02 0.00 0.00 176.35 175.93 1im3 s ARG 273 N -1.31 0.66 0.08 1.70 3.52 -1.26 -0.73 118.95 121.60 1im3 s ARG 273 Ca 0.12 -0.85 -0.31 0.00 -0.13 0.00 0.00 55.73 54.57 1im3 s ARG 273 Cb -0.10 -0.53 -0.08 0.00 -1.56 0.00 0.00 34.95 32.69 1im3 s ARG 273 CO 0.03 0.11 1.51 -0.46 -0.81 0.00 0.00 175.30 175.68 1im3 s TRP 274 N -1.35 2.82 0.00 5.12 -0.00 -1.26 -5.01 118.94 119.25 1im3 s TRP 274 Ca -0.06 0.64 0.00 0.00 -0.00 0.00 0.00 56.10 56.68 1im3 s TRP 274 Cb -0.10 -3.81 0.00 0.00 -0.00 0.00 0.00 33.47 29.56 1im3 s TRP 274 CO 0.01 -3.08 0.00 0.39 -0.00 0.00 0.00 176.95 174.27