#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p5w s SER 2 N 0.00 3.07 0.13 1.61 0.01 -1.26 -3.99 113.70 113.27 2p5w s SER 2 Ca 0.00 1.92 -0.05 0.00 1.31 0.00 0.00 55.95 59.13 2p5w s SER 2 Cb 0.00 -2.47 -0.02 0.00 0.21 0.00 0.00 66.02 63.74 2p5w s SER 2 CO 0.00 -2.96 0.16 -1.00 0.41 0.00 0.00 173.24 169.85 2p5w s HIS 3 N -2.72 0.53 0.06 2.43 4.02 -0.53 -4.93 115.29 114.15 2p5w s HIS 3 Ca 0.65 -0.93 -0.22 0.00 1.02 0.00 0.00 55.06 55.58 2p5w s HIS 3 Cb -0.21 -0.24 0.05 0.00 -1.02 0.00 0.00 32.58 31.16 2p5w s HIS 3 CO 0.58 -0.59 0.51 -1.54 1.02 0.00 0.00 174.74 174.73 2p5w s SER 4 N -2.97 -0.43 -0.04 1.40 1.04 -1.26 -0.67 113.70 110.77 2p5w s SER 4 Ca 0.16 0.14 0.04 0.00 0.48 0.00 0.00 55.95 56.77 2p5w s SER 4 Cb 0.05 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 66.66 2p5w s SER 4 CO -0.02 -0.74 -0.16 -0.32 0.98 0.00 0.00 173.24 172.98 2p5w s MET 5 N -2.58 1.66 -0.12 4.02 0.00 -0.58 -0.26 119.30 121.44 2p5w s MET 5 Ca -0.05 -0.58 -0.12 0.00 0.00 0.00 0.00 55.69 54.94 2p5w s MET 5 Cb -0.01 -1.47 0.03 0.00 0.00 0.00 0.00 34.83 33.39 2p5w s MET 5 CO -0.03 0.25 0.34 0.50 0.00 0.00 0.00 175.02 176.08 2p5w s ARG 6 N -0.01 0.43 -0.09 4.11 3.52 0.33 -1.77 118.95 125.48 2p5w s ARG 6 Ca -0.02 0.40 0.02 0.00 -0.13 0.00 0.00 55.73 56.00 2p5w s ARG 6 Cb -0.11 0.21 -0.02 0.00 -1.56 0.00 0.00 34.95 33.47 2p5w s ARG 6 CO 0.02 -0.06 -0.15 0.71 -0.81 0.00 0.00 175.30 175.01 2p5w s TYR 7 N 0.01 2.74 -0.12 5.12 1.51 -0.40 -0.67 117.35 125.53 2p5w s TYR 7 Ca -0.02 -0.44 0.03 0.00 -1.01 0.00 0.00 57.07 55.63 2p5w s TYR 7 Cb -0.03 -1.73 0.00 0.00 -0.11 0.00 0.00 41.96 40.09 2p5w s TYR 7 CO 0.01 -0.04 -0.22 -0.06 -1.11 0.00 0.00 175.55 174.13 2p5w s PHE 8 N -0.16 2.62 -0.08 2.71 0.40 -0.30 -2.30 117.98 120.87 2p5w s PHE 8 Ca -0.01 -1.12 0.04 0.00 -0.60 0.00 0.00 56.93 55.24 2p5w s PHE 8 Cb -0.13 -1.76 0.00 0.00 0.51 0.00 0.00 43.02 41.64 2p5w s PHE 8 CO 0.03 -0.47 -0.20 -0.06 0.70 0.00 0.00 175.22 175.22 2p5w s PHE 9 N 0.52 2.19 -0.08 0.36 0.40 0.44 -1.29 117.98 120.52 2p5w s PHE 9 Ca -0.14 -0.85 0.02 0.00 -0.60 0.00 0.00 56.93 55.36 2p5w s PHE 9 Cb -0.17 -1.49 0.02 0.00 0.51 0.00 0.00 43.02 41.89 2p5w s PHE 9 CO 0.05 -0.35 -0.12 0.99 0.70 0.00 0.00 175.22 176.48 2p5w s THR 10 N 0.37 1.22 -0.09 0.64 2.01 -0.12 -1.12 115.64 118.56 2p5w s THR 10 Ca -0.16 -0.49 0.02 0.00 0.31 0.00 0.00 61.69 61.37 2p5w s THR 10 Cb -0.17 -1.13 0.01 0.00 0.01 0.00 0.00 72.50 71.23 2p5w s THR 10 CO 0.07 0.38 -0.14 -0.55 -0.69 0.00 0.00 174.62 173.69 2p5w s SER 11 N 0.91 2.17 -0.11 3.53 0.15 0.37 -0.98 113.70 119.74 2p5w s SER 11 Ca -0.10 -0.37 0.01 0.00 0.70 0.00 0.00 55.95 56.19 2p5w s SER 11 Cb -0.15 -0.98 0.02 0.00 -1.71 0.00 0.00 66.02 63.20 2p5w s SER 11 CO 0.01 0.03 -0.12 -0.69 1.20 0.00 0.00 173.24 173.66 2p5w s VAL 12 N 0.83 1.30 0.33 4.45 1.01 -0.12 -1.08 120.40 127.12 2p5w s VAL 12 Ca -0.11 -0.51 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 2p5w s VAL 12 Cb -0.15 -1.23 -0.09 0.00 0.00 0.00 0.00 36.38 34.90 2p5w s VAL 12 CO 0.01 0.41 1.11 -0.94 0.00 0.00 0.00 175.10 175.69 2p5w s SER 13 N 1.21 7.01 -0.53 3.32 1.04 -0.47 -0.72 113.70 124.56 2p5w s SER 13 Ca -0.03 2.26 0.06 0.00 0.48 0.00 0.00 55.95 58.72 2p5w s SER 13 Cb -0.14 -2.62 0.21 0.00 0.10 0.00 0.00 66.02 63.58 2p5w s SER 13 CO -0.04 -0.33 0.53 0.54 0.98 0.00 0.00 173.24 174.93 2p5w n ARG 14 N 0.72 1.30 -1.24 4.02 1.74 -1.26 -4.11 116.66 117.84 2p5w n ARG 14 Ca 0.01 -3.86 -0.50 0.00 -0.77 0.00 0.00 57.85 52.73 2p5w n ARG 14 Cb 0.46 -1.83 -0.08 0.00 -1.02 0.00 0.00 32.46 30.00 2p5w n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2p5w n PRO 15 N 1.72 0.00 -3.03 5.56 -0.02 -1.26 -0.35 135.00 137.61 2p5w n PRO 15 Ca 0.25 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.53 2p5w n PRO 15 Cb 0.45 -1.12 0.04 0.00 -0.02 0.00 0.00 33.50 32.85 2p5w n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2p5w n GLY 16 N 3.48 -0.42 2.75 -1.23 0.00 -1.26 -4.91 105.19 103.60 2p5w n GLY 16 Ca 0.27 0.07 -0.03 0.00 0.00 0.00 0.00 46.02 46.33 2p5w n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p5w n ARG 17 N -3.88 1.48 0.00 1.61 5.12 0.52 -5.15 116.66 116.36 2p5w n ARG 17 Ca -0.09 -2.73 0.00 0.00 -1.93 0.00 0.00 57.85 53.10 2p5w n ARG 17 Cb 0.60 -0.88 0.00 0.00 -1.16 0.00 0.00 32.46 31.02 2p5w n ARG 17 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2p5w n GLY 18 N -0.74 -0.79 3.67 -0.13 0.00 -1.26 -4.86 105.19 101.09 2p5w n GLY 18 Ca 0.00 -1.17 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 2p5w n GLY 18 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2p5w n GLU 19 N 0.00 -0.01 -0.84 1.61 2.13 -1.26 -4.69 120.64 117.58 2p5w n GLU 19 Ca 0.00 0.08 -0.29 0.00 0.66 0.00 0.00 57.16 57.60 2p5w n GLU 19 Cb 0.00 -2.39 0.20 0.00 0.27 0.00 0.00 31.44 29.51 2p5w n GLU 19 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2p5w s PRO 20 N -4.21 0.17 0.06 5.31 0.02 -1.26 -4.63 135.00 130.46 2p5w s PRO 20 Ca 0.71 0.91 -0.20 0.00 0.02 0.00 0.00 61.00 62.44 2p5w s PRO 20 Cb -0.27 -1.68 -0.06 0.00 0.02 0.00 0.00 34.50 32.51 2p5w s PRO 20 CO 0.53 -3.01 0.59 0.50 -0.33 0.00 0.00 177.00 175.28 2p5w s ARG 21 N -4.69 4.25 -0.08 5.54 6.06 0.10 -4.88 118.95 125.25 2p5w s ARG 21 Ca 0.66 0.76 0.00 0.00 -2.50 0.00 0.00 55.73 54.66 2p5w s ARG 21 Cb -0.22 -3.26 0.02 0.00 0.06 0.00 0.00 34.95 31.55 2p5w s ARG 21 CO 0.60 0.58 -0.06 0.12 -2.50 0.00 0.00 175.30 174.05 2p5w s PHE 22 N -0.93 1.11 -0.07 5.12 5.36 -1.26 -0.95 117.98 126.35 2p5w s PHE 22 Ca 0.30 -0.43 0.02 0.00 -0.96 0.00 0.00 56.93 55.85 2p5w s PHE 22 Cb -0.19 -0.95 0.02 0.00 -0.34 0.00 0.00 43.02 41.55 2p5w s PHE 22 CO 0.19 -0.34 -0.11 0.42 -1.46 0.00 0.00 175.22 173.92 2p5w s ILE 23 N 1.34 1.09 -0.08 3.12 1.01 -0.15 -0.60 121.20 126.93 2p5w s ILE 23 Ca -0.03 -0.44 0.04 0.00 0.00 0.00 0.00 60.65 60.22 2p5w s ILE 23 Cb -0.14 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.32 2p5w s ILE 23 CO -0.03 0.35 -0.21 0.00 0.00 0.00 0.00 174.94 175.05 2p5w s ALA 24 N 0.83 1.93 0.06 9.38 0.00 0.17 -0.94 121.76 133.19 2p5w s ALA 24 Ca -0.11 -0.84 0.06 0.00 0.00 0.00 0.00 51.96 51.07 2p5w s ALA 24 Cb -0.15 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.22 2p5w s ALA 24 CO 0.02 0.26 -0.16 0.14 0.00 0.00 0.00 175.76 176.02 2p5w s VAL 25 N 0.34 1.30 -0.02 0.00 -7.23 -0.41 -1.03 120.40 113.34 2p5w s VAL 25 Ca -0.15 -1.18 0.06 0.00 -1.81 0.00 0.00 61.98 58.90 2p5w s VAL 25 Cb -0.17 -1.18 -0.01 0.00 0.56 0.00 0.00 36.38 35.58 2p5w s VAL 25 CO 0.07 -0.02 -0.21 -0.83 -0.31 0.00 0.00 175.10 173.81 2p5w s GLY 26 N -1.38 1.03 0.05 2.32 0.00 -0.90 -1.15 107.32 107.29 2p5w s GLY 26 Ca 0.03 -0.89 0.05 0.00 0.00 0.00 0.00 44.72 43.90 2p5w s GLY 26 CO 0.02 -0.70 -0.13 -0.19 0.00 0.00 0.00 173.10 172.10 2p5w s TYR 27 N -0.42 1.13 -0.19 1.90 1.51 0.15 -0.26 117.35 121.18 2p5w s TYR 27 Ca 0.06 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.72 2p5w s TYR 27 Cb -0.09 -0.66 0.03 0.00 -0.11 0.00 0.00 41.96 41.14 2p5w s TYR 27 CO -0.00 0.03 -0.14 0.08 -1.11 0.00 0.00 175.55 174.41 2p5w s VAL 28 N -1.09 1.83 0.00 0.71 1.01 -0.41 -0.51 120.40 121.94 2p5w s VAL 28 Ca -0.01 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2p5w s VAL 28 Cb -0.09 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.50 2p5w s VAL 28 CO 0.02 0.32 0.00 0.47 0.00 0.00 0.00 175.10 175.91 2p5w n ASP 29 N 4.65 0.00 -1.90 3.32 8.00 0.64 -1.53 116.55 129.73 2p5w n ASP 29 Ca -0.17 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.38 2p5w n ASP 29 Cb 0.48 0.00 0.39 0.00 -0.02 0.00 0.00 41.12 41.97 2p5w n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2p5w n ASP 30 N 5.32 5.64 -4.16 -2.24 8.00 -1.26 -4.91 116.55 122.93 2p5w n ASP 30 Ca 0.00 -2.97 -0.34 0.00 0.71 0.00 0.00 54.79 52.19 2p5w n ASP 30 Cb 0.00 -0.69 -0.15 0.00 -0.02 0.00 0.00 41.12 40.26 2p5w n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2p5w s THR 31 N -2.81 2.48 0.17 -3.53 2.01 -0.58 -5.01 115.64 108.38 2p5w s THR 31 Ca 0.55 -0.97 -0.30 0.00 0.31 0.00 0.00 61.69 61.28 2p5w s THR 31 Cb 0.42 -2.16 -0.08 0.00 0.01 0.00 0.00 72.50 70.70 2p5w s THR 31 CO 0.16 0.38 1.13 -1.58 -0.69 0.00 0.00 174.62 174.01 2p5w s GLN 32 N 1.31 4.56 0.00 4.92 0.74 -1.26 -1.29 119.66 128.63 2p5w s GLN 32 Ca 0.02 1.76 0.00 0.00 0.05 0.00 0.00 55.36 57.20 2p5w s GLN 32 Cb -0.15 -3.27 0.00 0.00 1.10 0.00 0.00 33.01 30.69 2p5w s GLN 32 CO -0.09 0.01 0.00 1.97 -0.55 0.00 0.00 175.29 176.64 2p5w n PHE 33 N 2.46 0.00 -4.10 1.67 -1.74 0.64 -3.93 117.46 112.46 2p5w n PHE 33 Ca 0.03 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.84 2p5w n PHE 33 Cb 0.46 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.36 2p5w n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 2p5w s VAL 34 N -1.91 0.17 -0.08 1.97 -7.23 -1.20 -0.29 120.40 111.83 2p5w s VAL 34 Ca 0.00 -1.82 -0.18 0.00 -1.81 0.00 0.00 61.98 58.17 2p5w s VAL 34 Cb 0.00 -1.71 0.04 0.00 0.56 0.00 0.00 36.38 35.27 2p5w s VAL 34 CO 0.00 -0.79 0.43 -0.60 -0.31 0.00 0.00 175.10 173.84 2p5w s ARG 35 N -3.96 0.68 -0.13 4.82 3.52 -0.33 -2.13 118.95 121.43 2p5w s ARG 35 Ca 0.13 0.22 -0.07 0.00 -0.13 0.00 0.00 55.73 55.88 2p5w s ARG 35 Cb 0.08 0.32 0.05 0.00 -1.56 0.00 0.00 34.95 33.83 2p5w s ARG 35 CO -0.06 -0.16 0.30 0.12 -0.81 0.00 0.00 175.30 174.70 2p5w s PHE 36 N -0.67 -0.42 -0.12 5.12 5.36 -0.20 0.36 117.98 127.41 2p5w s PHE 36 Ca -0.08 0.95 -0.02 0.00 -0.96 0.00 0.00 56.93 56.82 2p5w s PHE 36 Cb -0.03 0.12 0.04 0.00 -0.34 0.00 0.00 43.02 42.81 2p5w s PHE 36 CO 0.04 -0.26 0.03 0.34 -1.46 0.00 0.00 175.22 173.91 2p5w s ASP 37 N 1.17 2.00 0.58 6.13 2.15 -1.26 -0.65 116.67 126.79 2p5w s ASP 37 Ca -0.08 -0.34 0.28 0.00 0.43 0.00 0.00 52.55 52.84 2p5w s ASP 37 Cb -0.09 -0.42 1.51 0.00 -0.30 0.00 0.00 42.92 43.62 2p5w s ASP 37 CO -0.09 -0.25 1.96 0.77 -0.17 0.00 0.00 175.17 177.39 2p5w h SER 38 N 8.33 0.00 1.09 -0.34 4.64 -1.25 -2.12 113.55 123.90 2p5w h SER 38 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2p5w h SER 38 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2p5w h SER 38 CO 0.27 0.00 -0.62 0.44 -0.87 0.00 0.00 176.83 176.05 2p5w h ASP 39 N 0.00 0.00 -4.19 4.97 3.32 -1.95 -3.48 116.42 115.09 2p5w h ASP 39 Ca 0.19 -0.11 -0.52 0.00 0.02 0.00 0.00 57.03 56.62 2p5w h ASP 39 Cb 1.01 0.00 0.12 0.00 0.22 0.00 0.00 39.33 40.68 2p5w h ASP 39 CO -0.00 0.05 0.38 0.00 -1.72 0.00 0.00 179.24 177.95 2p5w s ALA 40 N -3.23 2.34 0.25 3.45 0.00 -0.80 -4.95 121.76 118.82 2p5w s ALA 40 Ca 0.05 0.67 0.04 0.00 0.00 0.00 0.00 51.96 52.72 2p5w s ALA 40 Cb 0.11 -3.37 0.31 0.00 0.00 0.00 0.00 23.12 20.17 2p5w s ALA 40 CO 0.73 -1.49 1.61 0.00 0.00 0.00 0.00 175.76 176.61 2p5w h ALA 41 N -0.08 0.94 -0.70 0.00 0.00 -1.91 -3.33 119.26 114.17 2p5w h ALA 41 Ca -0.47 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 53.98 2p5w h ALA 41 Cb 1.26 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 2p5w h ALA 41 CO 0.52 0.66 0.45 0.66 0.00 0.00 0.00 179.25 181.55 2p5w h SER 42 N 0.24 0.78 -3.04 0.00 4.64 -1.93 -3.46 113.55 110.77 2p5w h SER 42 Ca 0.01 -0.01 -0.33 0.00 -0.47 0.00 0.00 61.79 60.98 2p5w h SER 42 Cb 0.97 -0.19 0.02 0.00 -0.31 0.00 0.00 62.40 62.89 2p5w h SER 42 CO 0.08 0.55 -0.46 0.00 -0.87 0.00 0.00 176.83 176.13 2p5w n GLN 43 N -4.62 -2.66 -4.25 4.77 1.13 -1.25 -5.00 117.38 105.49 2p5w n GLN 43 Ca 0.07 0.78 -0.21 0.00 -1.94 0.00 0.00 57.00 55.69 2p5w n GLN 43 Cb 0.04 -5.24 -0.12 0.00 0.11 0.00 0.00 30.24 25.03 2p5w n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2p5w s ARG 44 N -5.16 1.03 0.12 -1.09 1.81 -1.26 -5.03 118.95 109.37 2p5w s ARG 44 Ca 0.12 -1.14 -0.30 0.00 -1.72 0.00 0.00 55.73 52.69 2p5w s ARG 44 Cb -0.05 -1.14 -0.07 0.00 -0.45 0.00 0.00 34.95 33.24 2p5w s ARG 44 CO 0.15 0.25 1.22 1.41 -0.68 0.00 0.00 175.30 177.66 2p5w s MET 45 N -2.07 4.44 0.11 3.54 -2.45 -1.26 -4.70 119.30 116.91 2p5w s MET 45 Ca 0.05 1.85 0.10 0.00 -1.25 0.00 0.00 55.69 56.45 2p5w s MET 45 Cb -0.09 -3.29 -0.04 0.00 1.25 0.00 0.00 34.83 32.67 2p5w s MET 45 CO 0.04 -0.21 -0.26 -1.21 1.05 0.00 0.00 175.02 174.43 2p5w s GLU 46 N 0.52 1.53 0.21 4.11 2.02 0.16 -4.93 118.70 122.32 2p5w s GLU 46 Ca 0.57 -1.28 -0.30 0.00 0.02 0.00 0.00 54.97 53.98 2p5w s GLU 46 Cb -0.32 -1.94 -0.08 0.00 0.10 0.00 0.00 34.13 31.89 2p5w s GLU 46 CO 0.32 0.47 1.14 -1.25 0.02 0.00 0.00 175.26 175.96 2p5w s PRO 47 N -1.90 4.57 0.00 0.39 0.04 -1.26 -1.18 135.00 135.65 2p5w s PRO 47 Ca 0.14 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.99 2p5w s PRO 47 Cb -0.10 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2p5w s PRO 47 CO 0.06 0.05 0.41 0.54 0.04 0.00 0.00 177.00 178.10 2p5w n ARG 48 N 2.02 -0.24 -4.04 4.56 5.12 0.60 -4.90 116.66 119.78 2p5w n ARG 48 Ca 0.02 -0.46 -0.13 0.00 -1.93 0.00 0.00 57.85 55.35 2p5w n ARG 48 Cb 0.45 -0.83 -0.12 0.00 -1.16 0.00 0.00 32.46 30.80 2p5w n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2p5w s ALA 49 N -0.11 0.37 0.15 7.54 0.00 -1.22 -4.71 121.76 123.79 2p5w s ALA 49 Ca 0.00 -0.52 -0.17 0.00 0.00 0.00 0.00 51.96 51.27 2p5w s ALA 49 Cb 0.00 0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2p5w s ALA 49 CO 0.00 -0.02 1.78 -1.35 0.00 0.00 0.00 175.76 176.17 2p5w h PRO 50 N 5.05 0.37 0.00 0.00 0.11 -1.94 -3.22 132.00 132.36 2p5w h PRO 50 Ca -0.32 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.77 2p5w h PRO 50 Cb 1.20 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2p5w h PRO 50 CO 0.44 0.24 -0.02 0.11 -0.21 0.00 0.00 178.00 178.56 2p5w h TRP 51 N 0.38 0.00 0.00 0.65 0.09 -1.95 -2.44 115.95 112.68 2p5w h TRP 51 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.12 2p5w h TRP 51 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.28 2p5w h TRP 51 CO -0.09 0.02 0.00 0.97 0.09 0.00 0.00 178.44 179.43 2p5w h ILE 52 N 0.00 0.00 0.00 0.12 6.09 -1.91 -3.10 117.51 118.70 2p5w h ILE 52 Ca -0.00 -0.79 0.00 0.00 -1.37 0.00 0.00 64.86 62.70 2p5w h ILE 52 Cb 0.07 1.78 0.00 0.00 0.47 0.00 0.00 36.82 39.14 2p5w h ILE 52 CO 0.00 0.00 0.00 -0.62 -3.07 0.00 0.00 178.15 174.46 2p5w n GLU 53 N -3.01 0.07 0.03 2.19 1.02 -0.92 -1.72 120.64 118.30 2p5w n GLU 53 Ca 0.03 0.22 0.13 0.00 -0.02 0.00 0.00 57.16 57.52 2p5w n GLU 53 Cb 0.44 -1.50 0.53 0.00 -0.02 0.00 0.00 31.44 30.89 2p5w n GLU 53 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2p5w n GLN 54 N -1.42 0.06 -2.38 3.49 10.64 -1.17 -4.78 117.38 121.82 2p5w n GLN 54 Ca 0.05 0.10 -0.36 0.00 -1.83 0.00 0.00 57.00 54.95 2p5w n GLN 54 Cb 0.15 -1.58 -0.02 0.00 -0.86 0.00 0.00 30.24 27.93 2p5w n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 2p5w s GLU 55 N -3.04 3.79 0.70 2.61 0.41 -0.70 -5.03 118.70 117.44 2p5w s GLU 55 Ca 0.12 1.61 -0.08 0.00 -0.41 0.00 0.00 54.97 56.21 2p5w s GLU 55 Cb 0.16 -2.32 0.15 0.00 -1.78 0.00 0.00 34.13 30.35 2p5w s GLU 55 CO 0.50 -0.49 0.95 0.41 -0.49 0.00 0.00 175.26 176.14 2p5w n GLY 56 N 0.25 -0.57 0.36 -1.39 0.00 -1.26 -4.88 105.19 97.70 2p5w n GLY 56 Ca 0.08 -1.83 0.04 0.00 0.00 0.00 0.00 46.02 44.31 2p5w n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2p5w h PRO 57 N 0.00 0.92 -0.49 1.61 0.11 -1.98 -2.44 132.00 129.73 2p5w h PRO 57 Ca -0.31 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.75 2p5w h PRO 57 Cb 0.95 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.83 2p5w h PRO 57 CO 0.26 0.61 0.32 0.93 -0.21 0.00 0.00 178.00 179.91 2p5w h GLU 58 N 0.95 0.64 0.51 1.05 5.08 -1.98 0.13 114.58 120.95 2p5w h GLU 58 Ca 0.35 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 2p5w h GLU 58 Cb 0.16 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2p5w h GLU 58 CO -0.12 0.43 -0.28 -0.92 -1.00 0.00 0.00 179.01 177.11 2p5w h TYR 59 N 0.66 -0.74 -0.80 4.33 3.20 -1.81 0.19 116.97 122.00 2p5w h TYR 59 Ca 0.18 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2p5w h TYR 59 Cb -0.07 0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2p5w h TYR 59 CO -0.04 -0.44 0.48 -1.49 -1.64 0.00 0.00 178.16 175.02 2p5w h TRP 60 N -0.74 1.06 -0.52 -3.82 4.06 -1.33 0.16 115.95 114.82 2p5w h TRP 60 Ca -0.06 -0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.84 2p5w h TRP 60 Cb 0.59 -0.35 -0.02 0.00 -1.00 0.00 0.00 29.16 28.38 2p5w h TRP 60 CO -0.07 0.71 0.13 -0.44 -3.56 0.00 0.00 178.44 175.21 2p5w h ASP 61 N 1.11 0.78 -0.17 -3.49 3.32 -0.63 -1.19 116.42 116.14 2p5w h ASP 61 Ca 0.29 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 2p5w h ASP 61 Cb -0.04 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.31 2p5w h ASP 61 CO -0.05 0.80 -0.13 1.23 -1.72 0.00 0.00 179.24 179.37 2p5w h GLY 62 N 0.72 0.43 1.76 2.75 0.00 -0.37 -1.98 103.07 106.38 2p5w h GLY 62 Ca 0.16 -0.42 -0.08 0.00 0.00 0.00 0.00 47.33 46.99 2p5w h GLY 62 CO 0.00 0.38 -0.26 0.83 0.00 0.00 0.00 176.54 177.49 2p5w h GLU 63 N 0.06 0.29 -0.18 4.80 4.39 -0.73 -0.77 114.58 122.43 2p5w h GLU 63 Ca 0.03 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.59 2p5w h GLU 63 Cb 0.65 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 2p5w h GLU 63 CO 0.03 0.53 -0.06 1.15 -1.16 0.00 0.00 179.01 179.51 2p5w h THR 64 N 0.26 1.30 -0.72 1.13 2.02 -1.16 -1.22 112.91 114.52 2p5w h THR 64 Ca 0.04 -1.06 -0.07 0.00 0.77 0.00 0.00 66.41 66.09 2p5w h THR 64 Cb 0.60 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.61 2p5w h THR 64 CO 0.04 0.32 0.19 -0.09 0.37 0.00 0.00 175.52 176.35 2p5w h ARG 65 N 0.06 1.14 -0.34 6.66 2.43 -1.16 -1.39 114.38 121.78 2p5w h ARG 65 Ca 0.04 -0.27 -0.07 0.00 -0.81 0.00 0.00 59.98 58.88 2p5w h ARG 65 Cb 0.52 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 2p5w h ARG 65 CO 0.02 0.99 -0.05 0.87 -1.51 0.00 0.00 179.97 180.30 2p5w h LYS 66 N 1.08 0.63 -0.06 0.20 1.57 -1.12 -1.97 116.57 116.90 2p5w h LYS 66 Ca 0.23 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 2p5w h LYS 66 Cb 0.35 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2p5w h LYS 66 CO -0.00 0.79 -0.31 -0.24 -0.57 0.00 0.00 179.45 179.11 2p5w h VAL 67 N 0.43 1.25 -0.30 0.50 3.04 -1.00 -1.00 116.25 119.16 2p5w h VAL 67 Ca 0.09 -1.18 -0.16 0.00 -1.01 0.00 0.00 66.70 64.44 2p5w h VAL 67 Cb 0.53 1.56 -0.00 0.00 -2.01 0.00 0.00 31.29 31.37 2p5w h VAL 67 CO 0.03 0.35 -0.45 0.11 -1.01 0.00 0.00 177.57 176.60 2p5w h LYS 68 N 0.10 0.83 -0.33 4.17 1.57 -1.14 -1.20 116.57 120.57 2p5w h LYS 68 Ca 0.01 -0.50 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2p5w h LYS 68 Cb 0.61 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2p5w h LYS 68 CO 0.04 1.13 0.22 0.00 -0.57 0.00 0.00 179.45 180.27 2p5w h ALA 69 N 0.69 0.42 -0.86 3.86 0.00 -1.05 -1.42 119.26 120.90 2p5w h ALA 69 Ca 0.03 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.03 2p5w h ALA 69 Cb 1.05 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.62 2p5w h ALA 69 CO 0.10 -0.11 0.48 0.45 0.00 0.00 0.00 179.25 180.17 2p5w h HIS 70 N 0.45 0.86 -0.36 0.00 3.86 -1.04 -1.48 115.15 117.44 2p5w h HIS 70 Ca 0.12 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.27 2p5w h HIS 70 Cb -0.05 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.15 2p5w h HIS 70 CO -0.05 0.29 -0.18 0.66 0.86 0.00 0.00 177.93 179.51 2p5w h SER 71 N 0.74 0.67 -0.46 2.45 4.64 -0.47 -2.53 113.55 118.58 2p5w h SER 71 Ca 0.44 -0.22 -0.11 0.00 -0.47 0.00 0.00 61.79 61.44 2p5w h SER 71 Cb 0.51 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 2p5w h SER 71 CO -0.30 0.85 -0.14 -0.61 -0.87 0.00 0.00 176.83 175.77 2p5w h GLN 72 N 0.60 0.90 -0.62 4.77 5.75 -0.39 -1.63 115.11 124.49 2p5w h GLN 72 Ca 0.09 -0.36 -0.06 0.00 -0.15 0.00 0.00 58.65 58.18 2p5w h GLN 72 Cb 0.64 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.12 2p5w h GLN 72 CO 0.05 1.01 0.16 1.15 -2.65 0.00 0.00 178.83 178.54 2p5w h THR 73 N 0.74 1.25 -0.20 2.39 2.02 -1.24 -2.52 112.91 115.35 2p5w h THR 73 Ca 0.11 -0.91 -0.12 0.00 0.77 0.00 0.00 66.41 66.26 2p5w h THR 73 Cb 0.69 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 2p5w h THR 73 CO 0.05 0.34 -0.38 0.45 0.37 0.00 0.00 175.52 176.35 2p5w h HIS 74 N 0.91 0.53 -0.67 3.16 3.86 -1.41 -0.98 115.15 120.55 2p5w h HIS 74 Ca 0.20 -0.14 -0.03 0.00 -1.16 0.00 0.00 60.37 59.23 2p5w h HIS 74 Cb 0.35 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.67 2p5w h HIS 74 CO 0.03 0.77 0.29 -0.09 0.86 0.00 0.00 177.93 179.79 2p5w h ARG 75 N 0.38 0.98 -0.06 2.45 2.43 -1.17 -1.51 114.38 117.88 2p5w h ARG 75 Ca 0.04 -0.15 -0.03 0.00 -0.81 0.00 0.00 59.98 59.03 2p5w h ARG 75 Cb 0.84 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.22 2p5w h ARG 75 CO 0.07 0.78 -0.08 0.28 -1.51 0.00 0.00 179.97 179.51 2p5w h VAL 76 N 0.96 1.39 -0.94 0.20 2.07 -1.16 -3.25 116.25 115.52 2p5w h VAL 76 Ca 0.23 -1.29 0.18 0.00 0.82 0.00 0.00 66.70 66.63 2p5w h VAL 76 Cb 0.15 2.11 -0.08 0.00 -1.52 0.00 0.00 31.29 31.94 2p5w h VAL 76 CO -0.02 0.36 0.60 0.44 0.02 0.00 0.00 177.57 178.96 2p5w h ASP 77 N -0.29 0.64 -0.98 0.57 3.32 -0.92 -0.54 116.42 118.21 2p5w h ASP 77 Ca 0.01 0.06 0.05 0.00 0.02 0.00 0.00 57.03 57.17 2p5w h ASP 77 Cb 0.62 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 40.04 2p5w h ASP 77 CO 0.02 0.27 0.63 -0.07 -1.72 0.00 0.00 179.24 178.38 2p5w h LEU 78 N 0.65 1.03 -0.08 1.55 3.38 -1.31 0.37 115.31 120.89 2p5w h LEU 78 Ca 0.50 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.29 2p5w h LEU 78 Cb 0.91 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 41.45 2p5w h LEU 78 CO -0.25 0.68 -0.68 1.23 0.09 0.00 0.00 178.44 179.50 2p5w h GLY 79 N 1.18 0.66 1.00 0.83 0.00 -1.24 -2.95 103.07 102.55 2p5w h GLY 79 Ca 0.41 -1.01 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 2p5w h GLY 79 CO -0.15 0.90 -0.02 -0.84 0.00 0.00 0.00 176.54 176.43 2p5w h THR 80 N 0.22 0.97 -0.86 4.70 2.02 -0.96 -2.30 112.91 116.70 2p5w h THR 80 Ca -0.06 -0.01 0.01 0.00 0.77 0.00 0.00 66.41 67.11 2p5w h THR 80 Cb 1.34 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 68.68 2p5w h THR 80 CO 0.14 0.00 0.56 -0.07 0.37 0.00 0.00 175.52 176.52 2p5w h LEU 81 N -0.05 1.00 -1.01 2.58 3.38 -1.03 0.83 115.31 121.01 2p5w h LEU 81 Ca -0.00 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 57.98 2p5w h LEU 81 Cb 0.04 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.48 2p5w h LEU 81 CO 0.01 0.74 0.65 -0.09 0.09 0.00 0.00 178.44 179.84 2p5w h ARG 82 N 1.17 1.20 -0.31 1.13 2.43 -1.44 -0.84 114.38 117.71 2p5w h ARG 82 Ca 0.31 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.36 2p5w h ARG 82 Cb -0.11 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 29.15 2p5w h ARG 82 CO -0.07 0.79 -0.01 0.78 -1.51 0.00 0.00 179.97 179.96 2p5w h GLY 83 N 1.23 0.60 1.14 2.80 0.00 -0.62 0.24 103.07 108.46 2p5w h GLY 83 Ca 0.41 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 2p5w h GLY 83 CO -0.15 0.41 0.41 -0.97 0.00 0.00 0.00 176.54 176.24 2p5w h TYR 84 N 0.35 1.10 -0.03 5.60 0.05 -0.32 -2.41 116.97 121.32 2p5w h TYR 84 Ca 0.09 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2p5w h TYR 84 Cb 0.45 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.85 2p5w h TYR 84 CO 0.04 0.78 0.00 0.66 -1.05 0.00 0.00 178.16 178.59 2p5w n TYR 85 N -4.33 0.01 -3.67 4.88 4.01 -0.37 -4.91 117.16 112.78 2p5w n TYR 85 Ca 0.08 -0.01 -0.30 0.00 -0.16 0.00 0.00 57.90 57.51 2p5w n TYR 85 Cb 0.12 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.19 2p5w n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2p5w n ASN 86 N 0.27 -5.13 -4.84 7.72 4.05 0.55 -4.97 115.26 112.92 2p5w n ASN 86 Ca 0.19 -1.00 -0.23 0.00 0.45 0.00 0.00 54.58 53.99 2p5w n ASN 86 Cb 0.37 -3.48 -0.04 0.00 1.23 0.00 0.00 39.78 37.86 2p5w n ASN 86 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 2p5w s GLN 87 N -5.91 2.40 0.03 1.20 -0.21 0.37 -5.03 119.66 112.50 2p5w s GLN 87 Ca 0.45 -1.69 -0.39 0.00 0.02 0.00 0.00 55.36 53.75 2p5w s GLN 87 Cb -0.15 -2.22 -0.19 0.00 1.00 0.00 0.00 33.01 31.45 2p5w s GLN 87 CO 0.85 -0.22 1.15 -1.13 -2.12 0.00 0.00 175.29 173.83 2p5w n SER 88 N -1.48 0.50 0.08 5.90 3.41 -1.26 -4.85 113.62 115.92 2p5w n SER 88 Ca 0.02 1.15 -0.10 0.00 -0.26 0.00 0.00 58.87 59.68 2p5w n SER 88 Cb 0.63 -1.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.50 2p5w n SER 88 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2p5w h GLU 89 N 3.48 0.13 -0.39 4.33 4.57 -1.98 -3.32 114.58 121.40 2p5w h GLU 89 Ca -0.50 -0.19 -0.10 0.00 -1.18 0.00 0.00 59.36 57.39 2p5w h GLU 89 Cb 1.40 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 29.99 2p5w h GLU 89 CO 0.69 1.03 0.04 0.00 -1.18 0.00 0.00 179.01 179.58 2p5w n ALA 90 N -2.44 3.72 -2.73 2.92 0.00 -1.26 -4.89 120.51 115.84 2p5w n ALA 90 Ca -0.03 -2.59 -0.32 0.00 0.00 0.00 0.00 53.44 50.50 2p5w n ALA 90 Cb 0.91 -0.83 -0.08 0.00 0.00 0.00 0.00 19.45 19.45 2p5w n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2p5w s GLY 91 N -1.96 1.95 -0.12 0.00 0.00 -1.25 -4.73 107.32 101.21 2p5w s GLY 91 Ca 0.45 -0.96 -0.25 0.00 0.00 0.00 0.00 44.72 43.96 2p5w s GLY 91 CO 0.07 -0.87 0.82 -0.45 0.00 0.00 0.00 173.10 172.66 2p5w s SER 92 N -1.86 7.02 0.18 1.64 0.15 -1.26 -4.71 113.70 114.86 2p5w s SER 92 Ca 0.23 1.25 0.06 0.00 0.70 0.00 0.00 55.95 58.19 2p5w s SER 92 Cb -0.12 -2.46 -0.05 0.00 -1.71 0.00 0.00 66.02 61.69 2p5w s SER 92 CO 0.15 -0.30 -0.12 -1.00 1.20 0.00 0.00 173.24 173.17 2p5w s HIS 93 N 1.61 1.53 -0.03 3.44 3.76 -1.26 -4.95 115.29 119.39 2p5w s HIS 93 Ca 0.40 -0.67 0.05 0.00 -0.15 0.00 0.00 55.06 54.69 2p5w s HIS 93 Cb -0.17 -0.75 -0.01 0.00 1.11 0.00 0.00 32.58 32.76 2p5w s HIS 93 CO 0.16 0.23 -0.18 0.99 -0.85 0.00 0.00 174.74 175.09 2p5w s THR 94 N -3.14 1.44 -0.09 1.30 2.01 -1.26 -1.36 115.64 114.53 2p5w s THR 94 Ca 0.21 -0.75 0.03 0.00 0.31 0.00 0.00 61.69 61.48 2p5w s THR 94 Cb 0.01 -1.21 0.01 0.00 0.01 0.00 0.00 72.50 71.31 2p5w s THR 94 CO 0.04 0.41 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.51 2p5w s VAL 95 N -0.22 1.66 0.06 3.82 1.01 -0.24 -0.00 120.40 126.49 2p5w s VAL 95 Ca 0.02 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.30 2p5w s VAL 95 Cb -0.09 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 2p5w s VAL 95 CO 0.01 0.47 -0.20 -1.10 0.00 0.00 0.00 175.10 174.28 2p5w s GLN 96 N 0.61 1.25 -0.03 2.72 -0.21 -0.76 -0.48 119.66 122.77 2p5w s GLN 96 Ca -0.14 -0.98 -0.03 0.00 0.02 0.00 0.00 55.36 54.23 2p5w s GLN 96 Cb -0.16 -1.39 0.01 0.00 1.00 0.00 0.00 33.01 32.46 2p5w s GLN 96 CO 0.04 0.34 0.09 0.50 -2.12 0.00 0.00 175.29 174.15 2p5w s ARG 97 N -1.38 0.13 -0.00 2.91 3.52 -0.27 -1.00 118.95 122.86 2p5w s ARG 97 Ca 0.06 0.08 0.01 0.00 -0.13 0.00 0.00 55.73 55.75 2p5w s ARG 97 Cb -0.09 0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.36 2p5w s ARG 97 CO 0.02 -0.02 -0.01 1.41 -0.81 0.00 0.00 175.30 175.89 2p5w s MET 98 N -0.07 0.14 0.13 5.12 -2.45 -0.67 -0.42 119.30 121.09 2p5w s MET 98 Ca -0.01 -0.04 -0.13 0.00 -1.25 0.00 0.00 55.69 54.26 2p5w s MET 98 Cb -0.01 -0.17 0.02 0.00 1.25 0.00 0.00 34.83 35.92 2p5w s MET 98 CO 0.00 0.02 0.33 1.52 1.05 0.00 0.00 175.02 177.94 2p5w s TYR 99 N 0.09 0.01 -5.00 4.11 -0.85 -0.97 -1.22 117.35 113.52 2p5w s TYR 99 Ca -0.01 -0.38 0.00 0.00 -0.52 0.00 0.00 57.07 56.17 2p5w s TYR 99 Cb -0.02 0.12 0.00 0.00 0.38 0.00 0.00 41.96 42.44 2p5w s TYR 99 CO -0.00 -0.68 0.00 0.41 -1.52 0.00 0.00 175.55 173.76 2p5w n GLY 100 N -0.18 -0.90 3.07 5.49 0.00 -1.00 -1.28 105.19 110.38 2p5w n GLY 100 Ca -0.14 -1.41 -0.08 0.00 0.00 0.00 0.00 46.02 44.40 2p5w n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p5w s ASP 102 N -2.47 3.28 0.11 0.00 1.01 -0.15 -1.53 116.67 116.93 2p5w s ASP 102 Ca -0.00 -0.42 0.06 0.00 0.71 0.00 0.00 52.55 52.89 2p5w s ASP 102 Cb 0.02 -0.45 -0.04 0.00 1.01 0.00 0.00 42.92 43.47 2p5w s ASP 102 CO -0.07 0.32 -0.14 0.68 0.21 0.00 0.00 175.17 176.16 2p5w s VAL 103 N -0.66 1.30 0.00 -1.27 -7.23 0.16 -0.52 120.40 112.18 2p5w s VAL 103 Ca 0.11 -1.65 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 2p5w s VAL 103 Cb -0.10 -1.46 0.00 0.00 0.56 0.00 0.00 36.38 35.38 2p5w s VAL 103 CO -0.00 -0.38 0.00 0.61 -0.31 0.00 0.00 175.10 175.02 2p5w n GLY 104 N 0.66 -0.47 0.29 2.32 0.00 -0.57 -1.46 105.19 105.96 2p5w n GLY 104 Ca -0.16 -1.75 0.04 0.00 0.00 0.00 0.00 46.02 44.14 2p5w n GLY 104 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2p5w h SER 105 N 0.00 0.42 -0.08 1.61 0.02 -1.91 -1.18 113.55 112.44 2p5w h SER 105 Ca 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2p5w h SER 105 Cb 0.00 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.43 2p5w h SER 105 CO 0.00 0.35 0.00 -0.90 -1.14 0.00 0.00 176.83 175.14 2p5w n ASP 106 N -4.44 0.88 -0.43 3.07 5.75 -1.26 -4.74 116.55 115.38 2p5w n ASP 106 Ca 0.02 -1.54 -0.06 0.00 -0.01 0.00 0.00 54.79 53.21 2p5w n ASP 106 Cb 0.10 -0.05 -0.02 0.00 -1.03 0.00 0.00 41.12 40.12 2p5w n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2p5w n TRP 107 N -0.21 0.00 -3.50 2.11 7.02 -0.44 -5.03 117.44 117.38 2p5w n TRP 107 Ca 0.16 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.28 2p5w n TRP 107 Cb 0.21 -1.39 -0.06 0.00 -2.42 0.00 0.00 31.31 27.65 2p5w n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2p5w s ARG 108 N -2.11 3.87 -0.00 -0.99 0.52 -1.26 -4.75 118.95 114.23 2p5w s ARG 108 Ca 0.00 0.33 -0.38 0.00 -0.52 0.00 0.00 55.73 55.17 2p5w s ARG 108 Cb 0.00 -3.08 -0.17 0.00 0.52 0.00 0.00 34.95 32.23 2p5w s ARG 108 CO 0.00 0.60 1.43 0.34 0.02 0.00 0.00 175.30 177.69 2p5w n PHE 109 N 1.25 1.62 -0.08 -0.53 7.35 -1.26 -1.52 117.46 124.28 2p5w n PHE 109 Ca -0.10 0.63 -0.17 0.00 -0.76 0.00 0.00 57.45 57.05 2p5w n PHE 109 Cb 0.52 -2.36 -0.06 0.00 0.35 0.00 0.00 39.48 37.94 2p5w n PHE 109 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2p5w n LEU 110 N 3.18 1.38 -3.75 -2.13 4.77 0.32 -4.83 117.00 115.94 2p5w n LEU 110 Ca 0.20 0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 56.36 2p5w n LEU 110 Cb 0.17 -0.56 -0.02 0.00 -2.33 0.00 0.00 43.42 40.69 2p5w n LEU 110 CO 0.67 0.23 0.57 0.00 -1.33 0.00 0.00 177.39 177.53 2p5w s ARG 111 N -2.39 1.44 0.27 3.23 3.03 -1.16 -5.01 118.95 118.36 2p5w s ARG 111 Ca -0.25 -0.76 0.03 0.00 2.03 0.00 0.00 55.73 56.79 2p5w s ARG 111 Cb 0.09 0.51 -0.06 0.00 -1.03 0.00 0.00 34.95 34.46 2p5w s ARG 111 CO 0.32 -0.66 0.03 0.20 -1.13 0.00 0.00 175.30 174.06 2p5w s GLY 112 N -2.88 1.78 -0.03 3.88 0.00 -1.26 -0.97 107.32 107.83 2p5w s GLY 112 Ca 0.10 -1.89 -0.10 0.00 0.00 0.00 0.00 44.72 42.83 2p5w s GLY 112 CO 0.02 -1.72 0.23 -0.19 0.00 0.00 0.00 173.10 171.44 2p5w s TYR 113 N -3.40 -0.12 -0.29 1.90 1.51 -0.23 -4.89 117.35 111.83 2p5w s TYR 113 Ca 0.33 0.23 0.04 0.00 -1.01 0.00 0.00 57.07 56.65 2p5w s TYR 113 Cb 0.07 0.04 0.20 0.00 -0.11 0.00 0.00 41.96 42.16 2p5w s TYR 113 CO 0.12 -0.28 0.59 -1.58 -1.11 0.00 0.00 175.55 173.29 2p5w s HIS 114 N -0.93 -1.77 0.12 2.71 2.46 -1.25 -2.36 115.29 114.26 2p5w s HIS 114 Ca -0.10 1.29 0.07 0.00 0.47 0.00 0.00 55.06 56.79 2p5w s HIS 114 Cb -0.05 0.40 -0.04 0.00 -0.13 0.00 0.00 32.58 32.76 2p5w s HIS 114 CO 0.02 -1.02 -0.17 -0.65 -2.47 0.00 0.00 174.74 170.45 2p5w s GLN 115 N 2.84 1.07 -0.00 2.88 -0.21 -0.36 -1.66 119.66 124.22 2p5w s GLN 115 Ca 0.14 -1.20 0.01 0.00 0.02 0.00 0.00 55.36 54.33 2p5w s GLN 115 Cb -0.12 -1.14 -0.00 0.00 1.00 0.00 0.00 33.01 32.75 2p5w s GLN 115 CO -0.24 0.24 -0.04 -0.47 -2.12 0.00 0.00 175.29 172.67 2p5w s TYR 116 N -1.65 0.32 0.05 0.91 6.14 -0.14 -1.66 117.35 121.32 2p5w s TYR 116 Ca 0.08 -0.08 0.03 0.00 0.64 0.00 0.00 57.07 57.74 2p5w s TYR 116 Cb -0.08 -0.20 -0.03 0.00 0.42 0.00 0.00 41.96 42.07 2p5w s TYR 116 CO 0.04 -0.01 -0.10 0.00 0.64 0.00 0.00 175.55 176.12 2p5w s ALA 117 N -0.13 0.82 -0.10 3.97 0.00 -0.17 -1.22 121.76 124.93 2p5w s ALA 117 Ca 0.01 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.13 2p5w s ALA 117 Cb -0.02 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.10 2p5w s ALA 117 CO -0.00 0.06 -0.14 -0.47 0.00 0.00 0.00 175.76 175.21 2p5w s TYR 118 N -1.32 1.79 -1.58 0.00 5.04 -0.53 -1.82 117.35 118.93 2p5w s TYR 118 Ca -0.07 -0.80 -0.16 0.00 -2.44 0.00 0.00 57.07 53.61 2p5w s TYR 118 Cb -0.10 -1.31 0.13 0.00 0.35 0.00 0.00 41.96 41.03 2p5w s TYR 118 CO 0.01 -0.42 0.78 -0.25 -1.34 0.00 0.00 175.55 174.33 2p5w n ASP 119 N 4.14 -3.78 -0.03 4.32 10.43 1.00 -1.98 116.55 130.65 2p5w n ASP 119 Ca -0.19 -0.82 -0.00 0.00 2.57 0.00 0.00 54.79 56.34 2p5w n ASP 119 Cb 0.51 -3.08 -0.00 0.00 1.84 0.00 0.00 41.12 40.39 2p5w n ASP 119 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2p5w n GLY 120 N -1.41 0.47 3.26 0.44 0.00 -1.26 -5.02 105.19 101.66 2p5w n GLY 120 Ca 0.05 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 2p5w n GLY 120 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2p5w s LYS 121 N -0.53 1.43 0.18 1.61 2.47 -0.84 -5.10 119.74 118.97 2p5w s LYS 121 Ca 0.00 -0.95 -0.33 0.00 -1.56 0.00 0.00 55.97 53.13 2p5w s LYS 121 Cb 0.00 -1.55 -0.14 0.00 -1.46 0.00 0.00 37.83 34.68 2p5w s LYS 121 CO 0.00 0.40 1.47 -0.25 0.16 0.00 0.00 175.35 177.13 2p5w n ASP 122 N 1.86 2.73 -0.02 1.43 8.00 -1.26 -1.45 116.55 127.83 2p5w n ASP 122 Ca -0.17 1.11 -0.04 0.00 0.71 0.00 0.00 54.79 56.40 2p5w n ASP 122 Cb 0.53 -1.39 -0.01 0.00 -0.02 0.00 0.00 41.12 40.23 2p5w n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2p5w n TYR 123 N 2.67 0.00 -3.71 1.24 9.36 -0.35 -4.72 117.16 121.65 2p5w n TYR 123 Ca 0.15 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.23 2p5w n TYR 123 Cb 0.29 -0.22 -0.09 0.00 -0.63 0.00 0.00 39.34 38.68 2p5w n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 2p5w s ILE 124 N -2.22 0.01 0.02 2.97 2.07 -1.14 -1.58 121.20 121.33 2p5w s ILE 124 Ca -0.13 -0.07 -0.18 0.00 -1.41 0.00 0.00 60.65 58.87 2p5w s ILE 124 Cb 0.02 -0.67 0.03 0.00 0.13 0.00 0.00 42.46 41.98 2p5w s ILE 124 CO 0.19 -0.04 0.39 0.00 -1.91 0.00 0.00 174.94 173.57 2p5w s ALA 125 N -0.08 -0.96 0.22 1.50 0.00 -0.90 -0.97 121.76 120.57 2p5w s ALA 125 Ca -0.03 0.36 -0.30 0.00 0.00 0.00 0.00 51.96 52.00 2p5w s ALA 125 Cb -0.03 0.23 -0.08 0.00 0.00 0.00 0.00 23.12 23.23 2p5w s ALA 125 CO 0.02 -0.38 0.96 -1.17 0.00 0.00 0.00 175.76 175.19 2p5w s LEU 126 N -1.74 4.61 1.01 0.00 2.96 -0.66 -0.85 118.68 124.01 2p5w s LEU 126 Ca -0.08 1.95 -0.12 0.00 -0.22 0.00 0.00 54.13 55.66 2p5w s LEU 126 Cb -0.02 -3.61 0.20 0.00 0.50 0.00 0.00 46.19 43.26 2p5w s LEU 126 CO 0.01 0.09 1.08 -0.54 -1.32 0.00 0.00 176.35 175.66 2p5w s LYS 127 N -0.97 0.30 0.37 1.98 1.02 0.71 -4.75 119.74 118.39 2p5w s LYS 127 Ca 0.43 0.80 0.18 0.00 0.02 0.00 0.00 55.97 57.39 2p5w s LYS 127 Cb -0.26 -1.70 1.13 0.00 -0.52 0.00 0.00 37.83 36.48 2p5w s LYS 127 CO 0.32 -2.90 1.69 1.49 -0.92 0.00 0.00 175.35 175.04 2p5w h GLU 128 N -2.02 0.32 -0.40 1.68 4.81 -1.91 0.90 114.58 117.96 2p5w h GLU 128 Ca -0.54 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 2p5w h GLU 128 Cb 1.31 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.62 2p5w h GLU 128 CO 0.53 0.21 0.00 -0.40 -0.73 0.00 0.00 179.01 178.62 2p5w n ASP 129 N -4.88 2.87 0.00 1.04 3.85 -1.26 -4.62 116.55 113.56 2p5w n ASP 129 Ca 0.31 -1.93 0.00 0.00 -0.71 0.00 0.00 54.79 52.46 2p5w n ASP 129 Cb 1.01 -0.26 0.00 0.00 -1.35 0.00 0.00 41.12 40.52 2p5w n ASP 129 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 2p5w n LEU 130 N 1.09 0.65 -0.55 -2.12 4.77 0.31 -4.87 117.00 116.28 2p5w n LEU 130 Ca 0.18 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.30 2p5w n LEU 130 Cb 0.49 -1.41 0.46 0.00 -2.33 0.00 0.00 43.42 40.63 2p5w n LEU 130 CO 0.14 -0.50 0.83 0.54 -1.33 0.00 0.00 177.39 177.08 2p5w n ARG 131 N -1.17 1.76 -3.78 3.23 1.74 -1.26 -4.85 116.66 112.34 2p5w n ARG 131 Ca 0.00 -1.11 -0.05 0.00 -0.77 0.00 0.00 57.85 55.91 2p5w n ARG 131 Cb 0.17 -1.47 -0.02 0.00 -1.02 0.00 0.00 32.46 30.12 2p5w n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2p5w s SER 132 N -1.96 -0.23 0.15 0.55 1.04 -1.26 -5.04 113.70 106.95 2p5w s SER 132 Ca 0.36 -0.47 0.06 0.00 0.48 0.00 0.00 55.95 56.39 2p5w s SER 132 Cb 0.21 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.88 2p5w s SER 132 CO 0.32 -1.08 0.04 0.26 0.98 0.00 0.00 173.24 173.76 2p5w s TRP 133 N -3.56 2.97 -0.18 5.02 0.52 -1.26 -0.21 118.94 122.24 2p5w s TRP 133 Ca 0.11 -0.07 0.00 0.00 0.02 0.00 0.00 56.10 56.16 2p5w s TRP 133 Cb -0.03 -1.46 0.01 0.00 -1.15 0.00 0.00 33.47 30.84 2p5w s TRP 133 CO 0.03 0.51 -0.17 0.99 0.02 0.00 0.00 176.95 178.33 2p5w s THR 134 N -1.62 2.31 -0.16 2.01 2.01 -0.03 -4.86 115.64 115.29 2p5w s THR 134 Ca 0.28 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.43 2p5w s THR 134 Cb -0.10 -1.98 0.01 0.00 0.01 0.00 0.00 72.50 70.44 2p5w s THR 134 CO 0.20 0.52 -0.20 0.00 -0.69 0.00 0.00 174.62 174.45 2p5w s ALA 135 N 1.26 2.32 0.10 7.40 0.00 -1.26 -2.11 121.76 129.46 2p5w s ALA 135 Ca 0.04 -1.16 -0.30 0.00 0.00 0.00 0.00 51.96 50.55 2p5w s ALA 135 Cb -0.14 -1.12 -0.13 0.00 0.00 0.00 0.00 23.12 21.74 2p5w s ALA 135 CO -0.10 -0.20 1.63 0.00 0.00 0.00 0.00 175.76 177.09 2p5w h ALA 136 N 7.65 -0.63 -3.04 0.00 0.00 -1.58 -3.46 119.26 118.20 2p5w h ALA 136 Ca -0.39 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2p5w h ALA 136 Cb 1.16 0.42 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2p5w h ALA 136 CO 0.60 -0.89 0.00 -0.40 0.00 0.00 0.00 179.25 178.56 2p5w n ASP 137 N -5.41 0.08 -0.10 0.00 5.68 -1.26 -5.02 116.55 110.52 2p5w n ASP 137 Ca -0.09 -0.86 0.00 0.00 -0.50 0.00 0.00 54.79 53.34 2p5w n ASP 137 Cb 0.32 0.00 0.28 0.00 -1.14 0.00 0.00 41.12 40.58 2p5w n ASP 137 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 2p5w h MET 138 N 0.00 0.76 0.11 0.11 1.85 -1.98 -0.24 114.93 115.53 2p5w h MET 138 Ca 0.00 -0.09 -0.01 0.00 -0.61 0.00 0.00 59.70 58.99 2p5w h MET 138 Cb 0.00 -0.15 0.00 0.00 0.43 0.00 0.00 31.60 31.88 2p5w h MET 138 CO 0.00 0.59 -0.05 0.00 -0.40 0.00 0.00 176.91 177.05 2p5w h ALA 139 N 1.52 -0.15 0.00 0.39 0.00 -1.97 -2.30 119.26 116.76 2p5w h ALA 139 Ca 0.19 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2p5w h ALA 139 Cb 0.09 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2p5w h ALA 139 CO -0.02 -0.50 -0.14 0.00 0.00 0.00 0.00 179.25 178.58 2p5w h ALA 140 N 0.56 1.47 -0.16 0.00 0.00 -1.78 -0.46 119.26 118.90 2p5w h ALA 140 Ca -0.02 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2p5w h ALA 140 Cb 0.25 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2p5w h ALA 140 CO 0.02 0.18 -0.27 1.96 0.00 0.00 0.00 179.25 181.14 2p5w h GLN 141 N 0.00 0.30 -0.34 0.00 1.08 -0.78 0.26 115.11 115.63 2p5w h GLN 141 Ca -0.00 -0.11 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 2p5w h GLN 141 Cb 0.31 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 2p5w h GLN 141 CO 0.02 0.55 -0.23 1.15 -0.95 0.00 0.00 178.83 179.37 2p5w h THR 142 N 0.26 1.29 -0.14 -0.54 2.02 -0.52 -1.23 112.91 114.05 2p5w h THR 142 Ca 0.04 -1.37 -0.02 0.00 0.77 0.00 0.00 66.41 65.83 2p5w h THR 142 Cb 0.62 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 2p5w h THR 142 CO 0.04 0.45 0.02 0.74 0.37 0.00 0.00 175.52 177.14 2p5w h THR 143 N 0.52 1.23 -0.42 3.16 2.02 -1.16 -2.88 112.91 115.39 2p5w h THR 143 Ca 0.07 -0.74 0.07 0.00 0.77 0.00 0.00 66.41 66.58 2p5w h THR 143 Cb 0.79 1.46 -0.06 0.00 -1.74 0.00 0.00 68.15 68.59 2p5w h THR 143 CO 0.06 0.22 0.02 0.50 0.37 0.00 0.00 175.52 176.69 2p5w h LYS 144 N -0.00 0.13 -0.72 6.66 3.64 -0.42 0.07 116.57 125.93 2p5w h LYS 144 Ca 0.04 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2p5w h LYS 144 Cb 0.32 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 2p5w h LYS 144 CO 0.00 0.09 0.39 0.45 -2.27 0.00 0.00 179.45 178.10 2p5w h HIS 145 N 0.13 0.98 -0.47 1.91 3.86 -1.17 -0.23 115.15 120.16 2p5w h HIS 145 Ca 0.21 -0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.31 2p5w h HIS 145 Cb 0.29 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 2p5w h HIS 145 CO -0.26 0.68 -0.04 0.87 0.86 0.00 0.00 177.93 180.05 2p5w h LYS 146 N 1.00 0.86 -0.21 2.45 1.57 -1.15 -2.34 116.57 118.75 2p5w h LYS 146 Ca 0.25 -0.29 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 2p5w h LYS 146 Cb 0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2p5w h LYS 146 CO -0.04 0.92 -0.29 -1.49 -0.57 0.00 0.00 179.45 177.99 2p5w h TRP 147 N 0.71 0.47 0.00 -1.35 4.06 -0.59 -2.46 115.95 116.78 2p5w h TRP 147 Ca 0.13 -0.10 -0.17 0.00 2.06 0.00 0.00 58.89 60.80 2p5w h TRP 147 Cb 0.56 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 28.58 2p5w h TRP 147 CO 0.04 0.67 -0.82 1.05 -3.56 0.00 0.00 178.44 175.82 2p5w h GLU 148 N 0.36 0.03 -0.02 0.49 4.11 -0.94 -0.51 114.58 118.10 2p5w h GLU 148 Ca 0.05 -0.03 -0.11 0.00 0.07 0.00 0.00 59.36 59.34 2p5w h GLU 148 Cb 0.69 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2p5w h GLU 148 CO 0.05 0.83 -0.48 0.00 0.07 0.00 0.00 179.01 179.48 2p5w h ALA 149 N 1.16 1.16 -0.10 1.06 0.00 -1.27 -2.84 119.26 118.43 2p5w h ALA 149 Ca -0.01 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2p5w h ALA 149 Cb 1.44 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2p5w h ALA 149 CO 0.11 0.62 0.00 0.00 0.00 0.00 0.00 179.25 179.97 2p5w n ALA 150 N -2.45 2.51 -3.70 0.00 0.00 -0.94 -4.96 120.51 110.97 2p5w n ALA 150 Ca -0.02 -0.59 -0.24 0.00 0.00 0.00 0.00 53.44 52.59 2p5w n ALA 150 Cb 0.51 -1.03 0.05 0.00 0.00 0.00 0.00 19.45 18.98 2p5w n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2p5w n HIS 151 N 0.65 -2.30 -0.25 0.00 -0.00 -0.92 -4.93 115.22 107.47 2p5w n HIS 151 Ca 0.17 0.92 -0.07 0.00 -0.00 0.00 0.00 57.72 58.74 2p5w n HIS 151 Cb 0.44 -4.53 0.05 0.00 -0.00 0.00 0.00 29.99 25.95 2p5w n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2p5w h VAL 152 N -2.13 1.26 -0.47 1.59 2.07 -1.38 -2.33 116.25 114.85 2p5w h VAL 152 Ca -0.59 -0.91 0.04 0.00 0.82 0.00 0.00 66.70 66.07 2p5w h VAL 152 Cb 1.36 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 2p5w h VAL 152 CO 0.59 0.35 0.23 0.00 0.02 0.00 0.00 177.57 178.76 2p5w h ALA 153 N 1.10 0.60 -0.65 1.67 0.00 -1.92 -0.88 119.26 119.19 2p5w h ALA 153 Ca 0.23 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 2p5w h ALA 153 Cb 0.32 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2p5w h ALA 153 CO -0.01 -0.13 0.08 0.93 0.00 0.00 0.00 179.25 180.12 2p5w h GLU 154 N 0.45 1.08 -0.52 0.00 5.08 -1.87 -1.14 114.58 117.66 2p5w h GLU 154 Ca 0.21 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2p5w h GLU 154 Cb 0.14 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2p5w h GLU 154 CO -0.16 1.01 0.32 1.96 -1.00 0.00 0.00 179.01 181.13 2p5w h GLN 155 N 1.01 0.70 0.04 2.33 4.20 -0.90 -2.69 115.11 119.80 2p5w h GLN 155 Ca 0.19 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 2p5w h GLN 155 Cb 0.47 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.10 2p5w h GLN 155 CO 0.02 0.51 -0.02 -0.07 -0.67 0.00 0.00 178.83 178.59 2p5w h LEU 156 N 0.70 -0.04 -1.54 1.46 3.38 -1.02 -3.11 115.31 115.12 2p5w h LEU 156 Ca 0.19 -0.31 0.12 0.00 0.09 0.00 0.00 57.88 57.97 2p5w h LEU 156 Cb -0.02 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2p5w h LEU 156 CO -0.04 0.29 0.48 0.03 0.09 0.00 0.00 178.44 179.29 2p5w h ARG 157 N -0.38 0.47 -0.75 1.13 3.08 -1.20 0.83 114.38 117.56 2p5w h ARG 157 Ca -0.01 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 2p5w h ARG 157 Cb 0.35 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 2p5w h ARG 157 CO 0.01 0.31 0.46 0.00 -1.07 0.00 0.00 179.97 179.68 2p5w h ALA 158 N 1.65 1.40 0.00 0.04 0.00 -1.41 -1.06 119.26 119.88 2p5w h ALA 158 Ca 0.35 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2p5w h ALA 158 Cb 0.69 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2p5w h ALA 158 CO -0.11 0.53 -0.08 -0.92 0.00 0.00 0.00 179.25 178.66 2p5w h TYR 159 N 1.03 0.02 -0.08 0.00 3.20 -0.66 -2.91 116.97 117.56 2p5w h TYR 159 Ca 0.27 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.10 2p5w h TYR 159 Cb -0.06 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 2p5w h TYR 159 CO 0.00 1.03 -0.08 -0.07 -1.64 0.00 0.00 178.16 177.40 2p5w h LEU 160 N -0.98 0.11 0.00 2.82 3.38 0.58 0.27 115.31 121.49 2p5w h LEU 160 Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2p5w h LEU 160 Cb 1.03 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2p5w h LEU 160 CO -0.00 0.21 -1.61 -0.62 0.09 0.00 0.00 178.44 176.51 2p5w n GLU 161 N -4.38 0.54 0.00 1.13 1.02 -0.41 -4.35 120.64 114.20 2p5w n GLU 161 Ca -0.02 -0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 2p5w n GLU 161 Cb 0.20 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 2p5w n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2p5w n GLY 162 N 1.28 0.47 0.32 0.62 0.00 -1.10 -4.71 105.19 102.07 2p5w n GLY 162 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.10 2p5w n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2p5w h THR 163 N 0.00 0.15 -0.36 2.61 2.02 -1.61 -0.82 112.91 114.90 2p5w h THR 163 Ca 0.00 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.19 2p5w h THR 163 Cb 0.00 0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.48 2p5w h THR 163 CO 0.00 0.01 0.17 0.00 0.37 0.00 0.00 175.52 176.07 2p5w h VAL 165 N 0.35 1.34 -0.34 0.00 2.07 -1.39 -1.90 116.25 116.37 2p5w h VAL 165 Ca 0.15 -1.65 -0.17 0.00 0.82 0.00 0.00 66.70 65.86 2p5w h VAL 165 Cb 0.08 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2p5w h VAL 165 CO -0.12 0.48 -0.44 -0.33 0.02 0.00 0.00 177.57 177.18 2p5w h GLU 166 N 0.07 0.90 -0.05 1.57 5.08 -0.88 -2.66 114.58 118.61 2p5w h GLU 166 Ca 0.00 -0.51 -0.24 0.00 -1.00 0.00 0.00 59.36 57.61 2p5w h GLU 166 Cb 0.86 0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.16 2p5w h GLU 166 CO 0.07 1.16 -0.92 -1.49 -1.00 0.00 0.00 179.01 176.82 2p5w h TRP 167 N 0.70 0.89 -0.59 4.33 4.06 -1.20 -2.43 115.95 121.72 2p5w h TRP 167 Ca 0.04 -0.45 0.09 0.00 2.06 0.00 0.00 58.89 60.63 2p5w h TRP 167 Cb 1.04 -0.12 -0.07 0.00 -1.00 0.00 0.00 29.16 29.02 2p5w h TRP 167 CO 0.07 1.28 0.22 1.25 -3.56 0.00 0.00 178.44 177.70 2p5w h LEU 168 N 0.38 0.23 -0.85 -4.49 5.85 -1.37 0.14 115.31 115.20 2p5w h LEU 168 Ca -0.09 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 2p5w h LEU 168 Cb 1.55 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.61 2p5w h LEU 168 CO 0.18 0.14 -0.04 0.03 -0.34 0.00 0.00 178.44 178.40 2p5w h ARG 169 N 0.41 0.81 -0.48 1.25 3.08 -1.46 -1.22 114.38 116.78 2p5w h ARG 169 Ca 0.29 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 2p5w h ARG 169 Cb 0.34 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2p5w h ARG 169 CO -0.29 0.84 0.11 -0.09 -1.07 0.00 0.00 179.97 179.48 2p5w h ARG 170 N 0.75 0.77 -0.01 0.04 2.43 -0.74 -2.60 114.38 115.02 2p5w h ARG 170 Ca 0.14 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2p5w h ARG 170 Cb 0.51 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2p5w h ARG 170 CO 0.03 0.76 0.00 1.88 -1.51 0.00 0.00 179.97 181.12 2p5w h TYR 171 N 0.65 0.01 -0.88 2.20 0.05 -0.60 -1.98 116.97 116.43 2p5w h TYR 171 Ca 0.15 -0.00 0.18 0.00 0.05 0.00 0.00 58.73 59.10 2p5w h TYR 171 Cb 0.34 -0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.01 2p5w h TYR 171 CO 0.02 0.31 0.57 -0.07 -1.05 0.00 0.00 178.16 177.95 2p5w h LEU 172 N -0.28 0.49 0.01 3.88 3.38 -1.21 0.99 115.31 122.57 2p5w h LEU 172 Ca 0.00 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2p5w h LEU 172 Cb 0.30 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2p5w h LEU 172 CO 0.00 0.22 -0.14 -0.08 0.09 0.00 0.00 178.44 178.53 2p5w h GLU 173 N 0.50 0.07 -0.37 1.13 4.57 -1.39 -1.92 114.58 117.17 2p5w h GLU 173 Ca 0.45 -0.09 -0.06 0.00 -1.18 0.00 0.00 59.36 58.48 2p5w h GLU 173 Cb 0.98 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.58 2p5w h GLU 173 CO -0.19 0.95 -0.01 -0.91 -1.18 0.00 0.00 179.01 177.67 2p5w h ASN 174 N -0.77 0.55 -0.55 1.04 -0.26 -1.05 -2.84 115.58 111.70 2p5w h ASN 174 Ca -0.02 -0.12 -0.12 0.00 -0.56 0.00 0.00 56.30 55.48 2p5w h ASN 174 Cb 1.01 -0.15 -0.07 0.00 -1.06 0.00 0.00 38.32 38.05 2p5w h ASN 174 CO 0.03 0.63 0.12 0.61 -1.06 0.00 0.00 177.43 177.76 2p5w n GLY 175 N -0.80 3.81 0.35 2.83 0.00 0.32 -4.73 105.19 106.98 2p5w n GLY 175 Ca 0.02 -1.03 0.14 0.00 0.00 0.00 0.00 46.02 45.15 2p5w n GLY 175 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2p5w h LYS 176 N 2.46 0.69 -0.97 1.61 2.10 -1.09 0.41 116.57 121.78 2p5w h LYS 176 Ca 0.15 -0.04 0.17 0.00 -2.00 0.00 0.00 60.65 58.93 2p5w h LYS 176 Cb 1.98 -0.16 -0.09 0.00 -0.90 0.00 0.00 32.23 33.07 2p5w h LYS 176 CO 0.53 0.46 0.61 0.93 -2.00 0.00 0.00 179.45 179.98 2p5w h GLU 177 N 0.71 0.71 0.00 0.07 3.07 -1.86 -2.07 114.58 115.22 2p5w h GLU 177 Ca 0.59 -0.04 -0.24 0.00 -0.50 0.00 0.00 59.36 59.17 2p5w h GLU 177 Cb 0.99 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 28.70 2p5w h GLU 177 CO -0.40 0.47 -1.92 0.25 -1.40 0.00 0.00 179.01 176.02 2p5w n THR 178 N -4.65 0.92 0.08 1.13 -2.24 -0.54 -4.38 114.28 104.60 2p5w n THR 178 Ca 0.21 -0.41 -0.06 0.00 -2.27 0.00 0.00 64.05 61.52 2p5w n THR 178 Cb 0.53 -0.97 0.10 0.00 -2.10 0.00 0.00 70.33 67.90 2p5w n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2p5w h LEU 179 N 0.00 0.31 -3.23 3.22 3.38 -0.27 -3.14 115.31 115.58 2p5w h LEU 179 Ca -0.36 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.42 2p5w h LEU 179 Cb 1.63 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.29 2p5w h LEU 179 CO -0.04 0.86 0.00 0.00 0.09 0.00 0.00 178.44 179.36 2p5w n GLN 180 N -3.86 3.92 -2.96 1.13 6.02 -0.78 -4.94 117.38 115.91 2p5w n GLN 180 Ca -0.03 -2.93 -0.40 0.00 -0.01 0.00 0.00 57.00 53.64 2p5w n GLN 180 Cb 0.64 -1.95 -0.06 0.00 1.02 0.00 0.00 30.24 29.89 2p5w n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2p5w s ARG 181 N -2.05 4.56 -0.21 -1.09 1.70 -1.19 -5.03 118.95 115.64 2p5w s ARG 181 Ca 0.51 1.16 -0.02 0.00 -0.47 0.00 0.00 55.73 56.91 2p5w s ARG 181 Cb 0.34 -3.30 0.01 0.00 -0.57 0.00 0.00 34.95 31.43 2p5w s ARG 181 CO 0.22 0.45 -0.10 -0.08 -1.08 0.00 0.00 175.30 174.72 2p5w s THR 182 N -0.72 2.86 -0.47 4.99 -1.32 -1.26 -4.69 115.64 115.03 2p5w s THR 182 Ca 0.38 -0.74 -0.09 0.00 -1.21 0.00 0.00 61.69 60.02 2p5w s THR 182 Cb -0.22 -2.31 0.12 0.00 -1.51 0.00 0.00 72.50 68.57 2p5w s THR 182 CO 0.26 0.41 0.34 -1.81 -2.21 0.00 0.00 174.62 171.61 2p5w s ASP 183 N 1.39 5.70 0.48 8.08 1.11 -0.56 -4.91 116.67 127.95 2p5w s ASP 183 Ca 0.04 -1.88 -0.24 0.00 0.18 0.00 0.00 52.55 50.65 2p5w s ASP 183 Cb -0.14 -2.01 -0.07 0.00 1.07 0.00 0.00 42.92 41.77 2p5w s ASP 183 CO -0.07 -0.68 1.36 0.00 1.18 0.00 0.00 175.17 176.96 2p5w s ALA 184 N 1.37 3.07 0.33 5.23 0.00 -1.26 -2.07 121.76 128.42 2p5w s ALA 184 Ca 0.05 1.34 -0.29 0.00 0.00 0.00 0.00 51.96 53.07 2p5w s ALA 184 Cb -0.26 -3.55 -0.10 0.00 0.00 0.00 0.00 23.12 19.21 2p5w s ALA 184 CO -0.00 -1.16 1.29 -1.25 0.00 0.00 0.00 175.76 174.64 2p5w s PRO 185 N -2.61 4.35 -0.14 0.00 0.04 -1.26 -4.64 135.00 130.75 2p5w s PRO 185 Ca 0.64 2.18 -0.23 0.00 0.04 0.00 0.00 61.00 63.64 2p5w s PRO 185 Cb -0.40 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.05 2p5w s PRO 185 CO 0.50 -0.18 0.69 0.15 0.04 0.00 0.00 177.00 178.21 2p5w s LYS 186 N -1.80 4.32 0.20 4.56 1.02 0.24 -4.82 119.74 123.46 2p5w s LYS 186 Ca 0.49 0.80 0.10 0.00 0.02 0.00 0.00 55.97 57.38 2p5w s LYS 186 Cb -0.39 -3.52 -0.04 0.00 -0.52 0.00 0.00 37.83 33.36 2p5w s LYS 186 CO 0.52 -0.12 -0.20 0.95 -0.92 0.00 0.00 175.35 175.58 2p5w s THR 187 N 1.47 2.07 0.10 2.17 -4.23 -1.26 -0.58 115.64 115.38 2p5w s THR 187 Ca 0.34 -2.06 -0.26 0.00 -1.18 0.00 0.00 61.69 58.53 2p5w s THR 187 Cb -0.17 -2.02 0.08 0.00 1.34 0.00 0.00 72.50 71.73 2p5w s THR 187 CO 0.14 -0.30 0.93 -1.38 -0.54 0.00 0.00 174.62 173.47 2p5w s HIS 188 N -2.10 -0.21 -0.05 3.99 -3.43 -1.16 -5.01 115.29 107.33 2p5w s HIS 188 Ca 0.20 -0.04 0.03 0.00 -0.80 0.00 0.00 55.06 54.44 2p5w s HIS 188 Cb -0.06 0.61 0.01 0.00 -1.43 0.00 0.00 32.58 31.71 2p5w s HIS 188 CO 0.09 -0.74 -0.12 1.41 -2.00 0.00 0.00 174.74 173.38 2p5w s MET 189 N -3.25 1.47 0.29 -0.38 1.75 -1.26 -0.70 119.30 117.23 2p5w s MET 189 Ca 0.10 -0.42 0.07 0.00 -1.25 0.00 0.00 55.69 54.19 2p5w s MET 189 Cb -0.01 -1.27 -0.03 0.00 2.84 0.00 0.00 34.83 36.35 2p5w s MET 189 CO -0.02 0.10 0.23 0.95 -0.65 0.00 0.00 175.02 175.63 2p5w s THR 190 N 0.39 3.97 -0.03 10.11 -4.23 -0.09 -4.94 115.64 120.82 2p5w s THR 190 Ca -0.09 -1.42 -0.00 0.00 -1.18 0.00 0.00 61.69 59.00 2p5w s THR 190 Cb -0.13 -3.27 0.03 0.00 1.34 0.00 0.00 72.50 70.47 2p5w s THR 190 CO 0.02 -0.27 0.05 -2.28 -0.54 0.00 0.00 174.62 171.60 2p5w s HIS 191 N -2.23 0.00 0.00 3.99 5.04 -1.26 -1.67 115.29 119.17 2p5w s HIS 191 Ca 0.36 0.18 0.02 0.00 -1.54 0.00 0.00 55.06 54.08 2p5w s HIS 191 Cb -0.07 -0.21 -0.01 0.00 0.04 0.00 0.00 32.58 32.34 2p5w s HIS 191 CO 0.25 -0.10 -0.06 -1.01 -2.34 0.00 0.00 174.74 171.49 2p5w s HIS 192 N 1.05 0.52 -0.30 3.88 3.76 -0.36 -4.99 115.29 118.85 2p5w s HIS 192 Ca -0.09 -0.16 -0.28 0.00 -0.15 0.00 0.00 55.06 54.39 2p5w s HIS 192 Cb -0.12 -0.33 0.01 0.00 1.11 0.00 0.00 32.58 33.25 2p5w s HIS 192 CO -0.03 -0.02 1.00 0.00 -0.85 0.00 0.00 174.74 174.84 2p5w s ALA 193 N -0.32 3.53 -0.01 -1.40 0.00 -1.26 -0.25 121.76 122.05 2p5w s ALA 193 Ca 0.00 -0.11 -0.17 0.00 0.00 0.00 0.00 51.96 51.68 2p5w s ALA 193 Cb -0.03 -3.57 -0.33 0.00 0.00 0.00 0.00 23.12 19.19 2p5w s ALA 193 CO -0.00 -1.36 0.89 0.28 0.00 0.00 0.00 175.76 175.57 2p5w h VAL 194 N 5.66 1.27 -0.99 0.00 2.07 -1.70 -3.47 116.25 119.08 2p5w h VAL 194 Ca -0.21 -2.61 0.00 0.00 0.82 0.00 0.00 66.70 64.70 2p5w h VAL 194 Cb 1.07 3.02 0.00 0.00 -1.52 0.00 0.00 31.29 33.86 2p5w h VAL 194 CO 0.99 0.78 0.00 -0.24 0.02 0.00 0.00 177.57 179.12 2p5w n SER 195 N -3.83 0.00 0.28 0.57 2.88 -1.01 -4.97 113.62 107.54 2p5w n SER 195 Ca -0.18 -0.30 0.12 0.00 -1.33 0.00 0.00 58.87 57.18 2p5w n SER 195 Cb 1.01 0.00 0.79 0.00 -0.75 0.00 0.00 64.21 65.26 2p5w n SER 195 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 2p5w h ASP 196 N 0.00 0.00 0.00 -3.46 -0.00 -2.04 -3.27 116.42 107.66 2p5w h ASP 196 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 2p5w h ASP 196 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 2p5w h ASP 196 CO 0.00 0.03 0.00 1.41 -0.00 0.00 0.00 179.24 180.68 2p5w n HIS 197 N -4.04 0.00 -4.19 4.15 8.25 -1.26 -4.94 115.22 113.19 2p5w n HIS 197 Ca -0.03 -0.09 -0.14 0.00 -0.26 0.00 0.00 57.72 57.20 2p5w n HIS 197 Cb 0.12 -0.01 -0.11 0.00 1.12 0.00 0.00 29.99 31.11 2p5w n HIS 197 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2p5w s GLU 198 N -0.18 0.89 -0.06 -0.41 8.01 -1.23 -1.27 118.70 124.44 2p5w s GLU 198 Ca 0.00 -1.23 -0.05 0.00 0.01 0.00 0.00 54.97 53.70 2p5w s GLU 198 Cb 0.00 -0.54 0.02 0.00 -4.31 0.00 0.00 34.13 29.30 2p5w s GLU 198 CO 0.00 0.08 0.16 0.00 0.01 0.00 0.00 175.26 175.50 2p5w s ALA 199 N -2.69 -0.39 -0.11 5.21 0.00 -0.37 -1.85 121.76 121.56 2p5w s ALA 199 Ca 0.08 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.45 2p5w s ALA 199 Cb -0.01 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 2p5w s ALA 199 CO -0.00 -0.08 0.11 0.99 0.00 0.00 0.00 175.76 176.78 2p5w s THR 200 N 0.15 5.23 -0.12 0.00 2.01 0.65 -0.42 115.64 123.14 2p5w s THR 200 Ca -0.01 0.09 0.03 0.00 0.31 0.00 0.00 61.69 62.12 2p5w s THR 200 Cb -0.02 -3.27 0.01 0.00 0.01 0.00 0.00 72.50 69.23 2p5w s THR 200 CO -0.00 0.61 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.56 2p5w s LEU 201 N -1.02 2.03 -0.20 4.42 1.43 -0.13 -1.22 118.68 123.98 2p5w s LEU 201 Ca 0.15 -0.55 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 2p5w s LEU 201 Cb -0.12 -1.36 0.03 0.00 0.03 0.00 0.00 46.19 44.77 2p5w s LEU 201 CO 0.04 0.09 -0.17 -0.60 0.23 0.00 0.00 176.35 175.95 2p5w s ARG 202 N 0.69 2.68 -0.26 1.70 6.06 -0.67 -0.95 118.95 128.21 2p5w s ARG 202 Ca -0.11 -0.97 -0.12 0.00 -2.50 0.00 0.00 55.73 52.04 2p5w s ARG 202 Cb -0.16 -2.63 -0.05 0.00 0.06 0.00 0.00 34.95 32.17 2p5w s ARG 202 CO 0.02 -0.33 0.23 0.00 -2.50 0.00 0.00 175.30 172.72 2p5w s TRP 204 N 1.58 3.19 -0.16 0.00 0.52 0.12 -1.49 118.94 122.71 2p5w s TRP 204 Ca 0.09 0.07 -0.04 0.00 0.02 0.00 0.00 56.10 56.24 2p5w s TRP 204 Cb -0.15 -1.61 0.05 0.00 -1.15 0.00 0.00 33.47 30.61 2p5w s TRP 204 CO 0.09 0.52 0.07 0.00 0.02 0.00 0.00 176.95 177.64 2p5w s ALA 205 N -1.43 0.58 0.26 0.98 0.00 -0.56 -2.97 121.76 118.61 2p5w s ALA 205 Ca 0.29 -0.34 0.08 0.00 0.00 0.00 0.00 51.96 51.99 2p5w s ALA 205 Cb -0.12 -1.01 -0.05 0.00 0.00 0.00 0.00 23.12 21.94 2p5w s ALA 205 CO 0.22 -1.05 -0.11 -0.51 0.00 0.00 0.00 175.76 174.32 2p5w s LEU 206 N 2.05 2.53 -1.40 0.00 1.43 0.25 -1.36 118.68 122.19 2p5w s LEU 206 Ca 0.02 -1.11 -0.10 0.00 -1.03 0.00 0.00 54.13 51.90 2p5w s LEU 206 Cb -0.16 -0.72 0.07 0.00 0.03 0.00 0.00 46.19 45.41 2p5w s LEU 206 CO -0.08 -0.23 0.62 -1.20 0.23 0.00 0.00 176.35 175.69 2p5w n SER 207 N -0.53 -4.26 -4.85 2.29 7.64 -1.02 -0.59 113.62 112.30 2p5w n SER 207 Ca -0.06 -0.49 -0.30 0.00 1.01 0.00 0.00 58.87 59.03 2p5w n SER 207 Cb 0.62 -3.48 -0.05 0.00 -1.01 0.00 0.00 64.21 60.29 2p5w n SER 207 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2p5w s PHE 208 N -3.06 3.34 -0.16 1.43 -0.12 -0.89 -4.72 117.98 113.80 2p5w s PHE 208 Ca 0.46 0.13 -0.11 0.00 -0.05 0.00 0.00 56.93 57.36 2p5w s PHE 208 Cb -0.24 -1.66 0.05 0.00 -0.63 0.00 0.00 43.02 40.54 2p5w s PHE 208 CO 0.57 0.55 0.40 -0.47 -0.05 0.00 0.00 175.22 176.21 2p5w s TYR 209 N -1.52 -0.52 1.12 3.49 5.04 -0.88 -0.39 117.35 123.68 2p5w s TYR 209 Ca 0.32 1.18 -0.18 0.00 -2.44 0.00 0.00 57.07 55.95 2p5w s TYR 209 Cb -0.12 0.21 0.25 0.00 0.35 0.00 0.00 41.96 42.65 2p5w s TYR 209 CO 0.25 -0.29 1.17 -1.25 -1.34 0.00 0.00 175.55 174.09 2p5w s PRO 210 N 0.92 -0.56 0.48 4.97 0.04 -1.26 -1.50 135.00 138.10 2p5w s PRO 210 Ca -0.06 -0.13 0.25 0.00 0.04 0.00 0.00 61.00 61.10 2p5w s PRO 210 Cb -0.06 -1.68 1.24 0.00 0.04 0.00 0.00 34.50 34.03 2p5w s PRO 210 CO -0.07 -3.26 1.99 0.00 0.04 0.00 0.00 177.00 175.69 2p5w h ALA 211 N -2.25 1.24 -2.47 8.56 0.00 -1.95 -3.44 119.26 118.94 2p5w h ALA 211 Ca -0.45 -0.16 -0.53 0.00 0.00 0.00 0.00 54.91 53.77 2p5w h ALA 211 Cb 1.28 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 19.07 2p5w h ALA 211 CO 0.37 0.22 1.02 -2.00 0.00 0.00 0.00 179.25 178.86 2p5w s GLU 212 N -4.08 4.18 0.16 0.00 2.56 -1.26 -4.96 118.70 115.31 2p5w s GLU 212 Ca -0.02 2.40 -0.23 0.00 0.00 0.00 0.00 54.97 57.12 2p5w s GLU 212 Cb 0.13 -3.57 0.07 0.00 2.00 0.00 0.00 34.13 32.75 2p5w s GLU 212 CO 0.61 -0.76 0.60 -1.50 -0.56 0.00 0.00 175.26 173.66 2p5w s ILE 213 N 2.58 0.00 -0.09 -3.70 2.07 -1.26 -4.57 121.20 116.23 2p5w s ILE 213 Ca 0.76 -0.03 -0.01 0.00 -1.41 0.00 0.00 60.65 59.95 2p5w s ILE 213 Cb -0.42 -1.03 0.03 0.00 0.13 0.00 0.00 42.46 41.17 2p5w s ILE 213 CO 0.33 -0.00 -0.00 -0.89 -1.91 0.00 0.00 174.94 172.47 2p5w s THR 214 N -3.76 0.46 -0.14 4.00 2.01 -0.31 -5.00 115.64 112.91 2p5w s THR 214 Ca 0.01 0.02 -0.01 0.00 0.31 0.00 0.00 61.69 62.03 2p5w s THR 214 Cb -0.01 -0.63 -0.01 0.00 0.01 0.00 0.00 72.50 71.85 2p5w s THR 214 CO -0.12 0.23 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.16 2p5w s LEU 215 N 1.93 2.72 0.02 4.42 1.43 -1.26 -1.50 118.68 126.45 2p5w s LEU 215 Ca 0.04 -0.35 -0.05 0.00 -1.03 0.00 0.00 54.13 52.75 2p5w s LEU 215 Cb -0.13 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 2p5w s LEU 215 CO -0.06 0.14 0.08 0.42 0.23 0.00 0.00 176.35 177.16 2p5w s THR 216 N 0.52 0.12 0.06 5.49 -4.23 -0.81 -4.98 115.64 111.81 2p5w s THR 216 Ca -0.08 -0.96 0.06 0.00 -1.18 0.00 0.00 61.69 59.52 2p5w s THR 216 Cb -0.16 -0.65 -0.04 0.00 1.34 0.00 0.00 72.50 73.00 2p5w s THR 216 CO 0.04 -0.53 -0.09 0.26 -0.54 0.00 0.00 174.62 173.76 2p5w s TRP 217 N -2.05 2.79 0.06 3.99 0.52 -1.26 -0.85 118.94 122.14 2p5w s TRP 217 Ca -0.10 -0.12 0.04 0.00 0.02 0.00 0.00 56.10 55.95 2p5w s TRP 217 Cb -0.05 -1.50 -0.03 0.00 -1.15 0.00 0.00 33.47 30.74 2p5w s TRP 217 CO -0.02 0.40 -0.12 -0.65 0.02 0.00 0.00 176.95 176.57 2p5w s GLN 218 N -1.88 0.74 -0.09 4.98 -0.21 -0.49 -0.18 119.66 122.52 2p5w s GLN 218 Ca 0.20 -0.90 -0.01 0.00 0.02 0.00 0.00 55.36 54.67 2p5w s GLN 218 Cb -0.11 -0.67 0.03 0.00 1.00 0.00 0.00 33.01 33.25 2p5w s GLN 218 CO 0.11 0.14 -0.04 0.50 -2.12 0.00 0.00 175.29 173.89 2p5w s ARG 219 N -1.71 1.10 -1.55 2.91 3.52 0.15 -1.74 118.95 121.64 2p5w s ARG 219 Ca -0.04 -0.09 -0.05 0.00 -0.13 0.00 0.00 55.73 55.42 2p5w s ARG 219 Cb -0.10 -1.30 0.01 0.00 -1.56 0.00 0.00 34.95 32.00 2p5w s ARG 219 CO 0.02 -0.28 0.61 -0.25 -0.81 0.00 0.00 175.30 174.59 2p5w n ASP 220 N 5.01 -6.12 0.00 -2.12 10.43 -0.67 -1.98 116.55 121.10 2p5w n ASP 220 Ca -0.10 -0.28 0.00 0.00 2.57 0.00 0.00 54.79 56.97 2p5w n ASP 220 Cb 0.50 -4.93 0.00 0.00 1.84 0.00 0.00 41.12 38.53 2p5w n ASP 220 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2p5w n GLY 221 N -1.53 0.86 3.65 0.44 0.00 -1.26 -5.03 105.19 102.33 2p5w n GLY 221 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.58 2p5w n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p5w s GLU 222 N -0.14 2.73 0.16 1.61 0.41 -0.84 -5.02 118.70 117.62 2p5w s GLU 222 Ca 0.00 -0.63 -0.33 0.00 -0.41 0.00 0.00 54.97 53.60 2p5w s GLU 222 Cb 0.00 -2.62 -0.16 0.00 -1.78 0.00 0.00 34.13 29.57 2p5w s GLU 222 CO 0.00 0.63 1.22 -0.25 -0.49 0.00 0.00 175.26 176.37 2p5w n ASP 223 N 1.53 1.56 -4.16 -0.19 10.43 -1.26 0.34 116.55 124.81 2p5w n ASP 223 Ca -0.15 1.14 -0.32 0.00 2.57 0.00 0.00 54.79 58.02 2p5w n ASP 223 Cb 0.53 -1.24 -0.16 0.00 1.84 0.00 0.00 41.12 42.09 2p5w n ASP 223 CO 0.00 0.00 0.00 -1.58 -1.07 0.00 0.00 177.20 174.55 2p5w s GLN 224 N -0.20 2.97 0.00 -1.24 2.00 0.75 -4.70 119.66 119.23 2p5w s GLN 224 Ca 0.75 -0.84 0.00 0.00 -2.00 0.00 0.00 55.36 53.27 2p5w s GLN 224 Cb -0.85 -2.41 0.00 0.00 0.80 0.00 0.00 33.01 30.55 2p5w s GLN 224 CO 0.51 -0.03 0.00 2.41 -0.50 0.00 0.00 175.29 177.67 2p5w n THR 225 N 4.12 0.00 -1.98 -0.34 -1.04 -1.26 -4.33 114.28 109.45 2p5w n THR 225 Ca -0.20 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.39 2p5w n THR 225 Cb 0.51 -0.14 -0.03 0.00 -1.82 0.00 0.00 70.33 68.86 2p5w n THR 225 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2p5w s GLN 226 N -1.63 4.24 -1.64 -2.82 2.00 -1.26 -2.52 119.66 116.04 2p5w s GLN 226 Ca 0.00 2.32 -0.02 0.00 -2.00 0.00 0.00 55.36 55.66 2p5w s GLN 226 Cb 0.00 -3.14 0.00 0.00 0.80 0.00 0.00 33.01 30.67 2p5w s GLN 226 CO 0.00 -0.52 0.27 -0.25 -0.50 0.00 0.00 175.29 174.29 2p5w n ASP 227 N 3.22 -5.90 -4.64 6.67 10.43 -1.26 -4.78 116.55 120.28 2p5w n ASP 227 Ca 0.10 -0.14 -0.25 0.00 2.57 0.00 0.00 54.79 57.08 2p5w n ASP 227 Cb 0.39 -4.83 -0.08 0.00 1.84 0.00 0.00 41.12 38.45 2p5w n ASP 227 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2p5w s THR 228 N -3.08 3.52 -0.06 -3.53 -4.23 -1.05 -1.76 115.64 105.45 2p5w s THR 228 Ca 0.13 -1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 58.97 2p5w s THR 228 Cb -0.06 -2.80 0.04 0.00 1.34 0.00 0.00 72.50 71.02 2p5w s THR 228 CO 0.16 -0.21 0.11 -0.70 -0.54 0.00 0.00 174.62 173.45 2p5w s GLU 229 N -3.19 0.01 -0.21 3.99 2.12 -0.49 -4.99 118.70 115.94 2p5w s GLU 229 Ca 0.28 0.42 0.02 0.00 0.36 0.00 0.00 54.97 56.04 2p5w s GLU 229 Cb -0.08 -0.30 0.04 0.00 0.26 0.00 0.00 34.13 34.05 2p5w s GLU 229 CO 0.18 -0.26 -0.13 -1.17 -0.54 0.00 0.00 175.26 173.34 2p5w s LEU 230 N 1.80 2.63 0.46 2.70 2.96 -1.26 -0.18 118.68 127.79 2p5w s LEU 230 Ca -0.01 -0.99 -0.12 0.00 -0.22 0.00 0.00 54.13 52.78 2p5w s LEU 230 Cb -0.12 -1.41 -0.06 0.00 0.50 0.00 0.00 46.19 45.10 2p5w s LEU 230 CO -0.05 -0.12 0.86 0.68 -1.32 0.00 0.00 176.35 176.40 2p5w s VAL 231 N 1.27 4.71 0.50 1.68 -7.23 -0.81 -5.02 120.40 115.49 2p5w s VAL 231 Ca -0.02 0.80 -0.23 0.00 -1.81 0.00 0.00 61.98 60.72 2p5w s VAL 231 Cb -0.17 -3.75 -0.06 0.00 0.56 0.00 0.00 36.38 32.96 2p5w s VAL 231 CO -0.08 -0.65 1.34 -0.70 -0.31 0.00 0.00 175.10 174.70 2p5w s GLU 232 N -4.08 3.42 0.23 4.82 2.12 -1.26 -4.56 118.70 119.39 2p5w s GLU 232 Ca 0.54 2.21 -0.31 0.00 0.36 0.00 0.00 54.97 57.77 2p5w s GLU 232 Cb -0.10 -2.41 -0.11 0.00 0.26 0.00 0.00 34.13 31.77 2p5w s GLU 232 CO 0.34 -0.96 1.58 0.99 -0.54 0.00 0.00 175.26 176.67 2p5w s THR 233 N -1.31 2.35 0.08 -1.70 2.01 -1.26 -4.85 115.64 110.96 2p5w s THR 233 Ca 0.67 0.27 0.05 0.00 0.31 0.00 0.00 61.69 63.00 2p5w s THR 233 Cb -0.39 -3.18 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2p5w s THR 233 CO 0.48 0.03 -0.15 0.00 -0.69 0.00 0.00 174.62 174.29 2p5w s ARG 234 N 0.32 0.86 0.14 4.92 1.70 -0.74 -4.98 118.95 121.17 2p5w s ARG 234 Ca 0.66 -0.99 -0.30 0.00 -0.47 0.00 0.00 55.73 54.63 2p5w s ARG 234 Cb -0.46 -0.89 -0.07 0.00 -0.57 0.00 0.00 34.95 32.97 2p5w s ARG 234 CO 0.39 0.20 1.03 -1.25 -1.08 0.00 0.00 175.30 174.59 2p5w s PRO 235 N -1.81 4.65 0.28 3.89 0.04 -1.26 -0.32 135.00 140.47 2p5w s PRO 235 Ca -0.01 1.58 0.10 0.00 0.04 0.00 0.00 61.00 62.71 2p5w s PRO 235 Cb -0.10 -3.33 0.39 0.00 0.04 0.00 0.00 34.50 31.51 2p5w s PRO 235 CO 0.02 0.15 1.64 0.00 0.04 0.00 0.00 177.00 178.85 2p5w h ALA 236 N 5.36 1.02 0.00 8.56 0.00 -1.37 -3.47 119.26 129.37 2p5w h ALA 236 Ca -0.44 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 53.95 2p5w h ALA 236 Cb 1.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2p5w h ALA 236 CO 0.72 0.72 0.00 0.41 0.00 0.00 0.00 179.25 181.10 2p5w n GLY 237 N 0.14 0.67 0.30 0.00 0.00 -1.26 -4.95 105.19 100.09 2p5w n GLY 237 Ca -0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 2p5w n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2p5w n ASP 238 N 0.00 2.68 0.00 1.61 5.68 -1.26 -4.94 116.55 120.32 2p5w n ASP 238 Ca 0.00 -2.70 0.00 0.00 -0.50 0.00 0.00 54.79 51.59 2p5w n ASP 238 Cb 0.00 -0.33 0.00 0.00 -1.14 0.00 0.00 41.12 39.65 2p5w n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2p5w n GLY 239 N -0.79 0.59 3.89 6.12 0.00 -1.26 -5.07 105.19 108.66 2p5w n GLY 239 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 2p5w n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2p5w s THR 240 N -2.27 2.14 0.24 2.61 -4.23 -1.26 -4.89 115.64 107.98 2p5w s THR 240 Ca 0.00 -1.42 0.07 0.00 -1.18 0.00 0.00 61.69 59.16 2p5w s THR 240 Cb 0.00 -2.56 -0.05 0.00 1.34 0.00 0.00 72.50 71.23 2p5w s THR 240 CO 0.00 0.00 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.63 2p5w s PHE 241 N -2.63 1.80 0.10 3.99 0.40 0.48 -0.99 117.98 121.13 2p5w s PHE 241 Ca 0.42 -0.67 0.03 0.00 -0.60 0.00 0.00 56.93 56.11 2p5w s PHE 241 Cb -0.02 -0.96 -0.04 0.00 0.51 0.00 0.00 43.02 42.51 2p5w s PHE 241 CO 0.25 0.27 -0.08 -0.65 0.70 0.00 0.00 175.22 175.71 2p5w s GLN 242 N -3.71 0.86 -0.19 0.44 -0.21 0.56 -2.10 119.66 115.32 2p5w s GLN 242 Ca 0.26 -1.27 -0.29 0.00 0.02 0.00 0.00 55.36 54.08 2p5w s GLN 242 Cb 0.02 -0.37 0.13 0.00 1.00 0.00 0.00 33.01 33.79 2p5w s GLN 242 CO 0.09 0.03 1.04 0.21 -2.12 0.00 0.00 175.29 174.54 2p5w s LYS 243 N -3.40 0.53 0.04 2.91 2.20 -0.46 -1.79 119.74 119.77 2p5w s LYS 243 Ca 0.10 0.20 -0.07 0.00 -0.36 0.00 0.00 55.97 55.84 2p5w s LYS 243 Cb 0.02 0.25 -0.01 0.00 -1.51 0.00 0.00 37.83 36.58 2p5w s LYS 243 CO -0.02 -0.15 0.12 1.67 -0.36 0.00 0.00 175.35 176.61 2p5w s TRP 244 N -0.89 0.16 -0.05 4.03 1.48 -1.26 -1.50 118.94 120.91 2p5w s TRP 244 Ca -0.00 -0.43 0.02 0.00 -1.06 0.00 0.00 56.10 54.63 2p5w s TRP 244 Cb -0.01 -0.11 0.01 0.00 -1.16 0.00 0.00 33.47 32.20 2p5w s TRP 244 CO -0.01 -0.38 -0.11 0.00 -4.06 0.00 0.00 176.95 172.40 2p5w s ALA 245 N -2.56 1.09 0.23 2.67 0.00 -0.55 -1.93 121.76 120.71 2p5w s ALA 245 Ca -0.05 -0.37 0.07 0.00 0.00 0.00 0.00 51.96 51.61 2p5w s ALA 245 Cb -0.01 -0.46 -0.05 0.00 0.00 0.00 0.00 23.12 22.59 2p5w s ALA 245 CO -0.04 0.13 -0.10 0.00 0.00 0.00 0.00 175.76 175.74 2p5w s ALA 246 N 0.48 2.09 -0.10 0.00 0.00 0.75 0.44 121.76 125.42 2p5w s ALA 246 Ca -0.10 -1.75 -0.16 0.00 0.00 0.00 0.00 51.96 49.95 2p5w s ALA 246 Cb -0.13 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.09 2p5w s ALA 246 CO 0.02 -0.02 0.41 0.54 0.00 0.00 0.00 175.76 176.72 2p5w s VAL 247 N -3.04 0.02 -0.19 0.00 0.11 -0.12 -1.39 120.40 115.79 2p5w s VAL 247 Ca 0.25 -0.15 -0.09 0.00 -2.93 0.00 0.00 61.98 59.06 2p5w s VAL 247 Cb 0.02 -0.64 -0.05 0.00 -1.53 0.00 0.00 36.38 34.18 2p5w s VAL 247 CO 0.08 -0.08 0.11 -0.69 -3.33 0.00 0.00 175.10 171.19 2p5w s VAL 248 N -0.41 5.25 0.16 2.04 1.01 -0.72 -0.95 120.40 126.77 2p5w s VAL 248 Ca -0.05 0.13 0.05 0.00 0.00 0.00 0.00 61.98 62.11 2p5w s VAL 248 Cb -0.03 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 2p5w s VAL 248 CO 0.03 0.46 -0.11 0.68 0.00 0.00 0.00 175.10 176.16 2p5w s VAL 249 N 0.25 1.31 0.36 2.92 -7.23 0.44 -4.88 120.40 113.58 2p5w s VAL 249 Ca 0.07 -2.10 -0.28 0.00 -1.81 0.00 0.00 61.98 57.87 2p5w s VAL 249 Cb -0.11 -1.90 -0.10 0.00 0.56 0.00 0.00 36.38 34.83 2p5w s VAL 249 CO -0.01 -0.71 1.30 -2.84 -0.31 0.00 0.00 175.10 172.54 2p5w s PRO 250 N -3.72 4.23 0.24 4.82 0.02 -1.26 -1.24 135.00 138.09 2p5w s PRO 250 Ca 0.18 2.19 -0.31 0.00 0.02 0.00 0.00 61.00 63.08 2p5w s PRO 250 Cb 0.02 -2.96 -0.11 0.00 0.02 0.00 0.00 34.50 31.47 2p5w s PRO 250 CO 0.02 -0.29 1.56 0.45 -0.33 0.00 0.00 177.00 178.42 2p5w s SER 251 N -0.58 6.49 0.00 2.53 0.15 -0.40 -2.20 113.70 119.70 2p5w s SER 251 Ca 0.52 2.79 0.00 0.00 0.70 0.00 0.00 55.95 59.96 2p5w s SER 251 Cb -0.39 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.30 2p5w s SER 251 CO 0.51 -0.85 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2p5w n GLY 252 N 2.76 1.56 0.66 9.45 0.00 -1.26 -4.91 105.19 113.46 2p5w n GLY 252 Ca 0.10 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.19 2p5w n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2p5w n GLN 253 N -2.00 2.71 0.28 1.61 6.02 -0.93 -4.77 117.38 120.30 2p5w n GLN 253 Ca 0.00 -2.52 0.12 0.00 -0.01 0.00 0.00 57.00 54.60 2p5w n GLN 253 Cb 0.00 -1.60 0.81 0.00 1.02 0.00 0.00 30.24 30.47 2p5w n GLN 253 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 2p5w h GLU 254 N 1.51 0.00 0.00 -1.09 9.09 -1.91 -2.86 114.58 119.31 2p5w h GLU 254 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2p5w h GLU 254 Cb 1.14 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.24 2p5w h GLU 254 CO 0.12 0.02 0.00 1.04 0.05 0.00 0.00 179.01 180.24 2p5w n GLN 255 N -4.06 0.71 0.00 1.06 6.02 -1.26 -2.88 117.38 116.96 2p5w n GLN 255 Ca -0.03 0.01 0.13 0.00 -0.01 0.00 0.00 57.00 57.11 2p5w n GLN 255 Cb 0.10 -1.50 0.50 0.00 1.02 0.00 0.00 30.24 30.36 2p5w n GLN 255 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2p5w n ARG 256 N -1.08 0.56 -4.20 -1.09 1.74 -1.08 -4.85 116.66 106.66 2p5w n ARG 256 Ca 0.18 -0.25 -0.35 0.00 -0.77 0.00 0.00 57.85 56.66 2p5w n ARG 256 Cb 0.12 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 29.98 2p5w n ARG 256 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2p5w s TYR 257 N -2.61 3.28 0.04 -1.55 1.51 -1.14 -1.67 117.35 115.21 2p5w s TYR 257 Ca 0.24 0.24 0.04 0.00 -1.01 0.00 0.00 57.07 56.58 2p5w s TYR 257 Cb 0.19 -1.87 -0.02 0.00 -0.11 0.00 0.00 41.96 40.15 2p5w s TYR 257 CO 0.53 0.48 -0.13 0.95 -1.11 0.00 0.00 175.55 176.26 2p5w s THR 258 N -0.70 0.99 -0.17 -0.71 -4.23 -0.71 -4.38 115.64 105.72 2p5w s THR 258 Ca 0.12 -0.96 -0.03 0.00 -1.18 0.00 0.00 61.69 59.63 2p5w s THR 258 Cb -0.12 -0.91 -0.02 0.00 1.34 0.00 0.00 72.50 72.79 2p5w s THR 258 CO 0.02 -0.04 -0.05 0.00 -0.54 0.00 0.00 174.62 174.02 2p5w s HIS 260 N 0.61 2.92 -0.19 0.00 3.76 -0.03 -0.19 115.29 122.16 2p5w s HIS 260 Ca -0.03 -0.69 -0.01 0.00 -0.15 0.00 0.00 55.06 54.18 2p5w s HIS 260 Cb -0.15 -1.97 0.01 0.00 1.11 0.00 0.00 32.58 31.58 2p5w s HIS 260 CO 0.03 -0.31 -0.13 0.08 -0.85 0.00 0.00 174.74 173.55 2p5w s VAL 261 N 0.81 2.63 -0.14 -0.90 1.01 -0.30 -1.92 120.40 121.59 2p5w s VAL 261 Ca -0.03 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2p5w s VAL 261 Cb -0.15 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2p5w s VAL 261 CO 0.01 0.49 -0.21 -1.10 0.00 0.00 0.00 175.10 174.29 2p5w s GLN 262 N 1.32 3.05 -0.04 2.72 -0.21 -0.56 -1.56 119.66 124.37 2p5w s GLN 262 Ca 0.04 -0.85 -0.18 0.00 0.02 0.00 0.00 55.36 54.39 2p5w s GLN 262 Cb -0.14 -2.44 0.04 0.00 1.00 0.00 0.00 33.01 31.47 2p5w s GLN 262 CO -0.08 0.02 0.40 -1.58 -2.12 0.00 0.00 175.29 171.93 2p5w s HIS 263 N 0.74 -0.32 0.57 0.91 2.46 -1.26 -1.16 115.29 117.23 2p5w s HIS 263 Ca -0.09 0.56 0.27 0.00 0.47 0.00 0.00 55.06 56.27 2p5w s HIS 263 Cb -0.16 0.17 1.56 0.00 -0.13 0.00 0.00 32.58 34.02 2p5w s HIS 263 CO -0.00 -0.42 2.08 1.49 -2.47 0.00 0.00 174.74 175.42 2p5w h GLU 264 N 3.88 0.00 -0.00 2.88 4.81 -1.94 -2.43 114.58 121.78 2p5w h GLU 264 Ca -0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2p5w h GLU 264 Cb 1.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2p5w h GLU 264 CO 0.38 0.00 -0.02 0.41 -0.73 0.00 0.00 179.01 179.04 2p5w n GLY 265 N -1.47 -1.25 3.50 1.92 0.00 -1.26 -4.74 105.19 101.88 2p5w n GLY 265 Ca 0.03 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 2p5w n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p5w s LEU 266 N -2.59 4.17 0.53 0.99 1.43 -0.92 -4.38 118.68 117.92 2p5w s LEU 266 Ca 0.28 -0.38 0.33 0.00 -1.03 0.00 0.00 54.13 53.33 2p5w s LEU 266 Cb 0.20 -2.06 1.82 0.00 0.03 0.00 0.00 46.19 46.18 2p5w s LEU 266 CO 0.47 -0.17 2.02 -0.65 0.23 0.00 0.00 176.35 178.25 2p5w h PRO 267 N 8.39 0.00 -2.57 1.29 0.11 -1.87 -3.41 132.00 133.93 2p5w h PRO 267 Ca -0.33 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.68 2p5w h PRO 267 Cb 1.16 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.04 2p5w h PRO 267 CO 0.61 0.00 -0.15 0.21 -0.21 0.00 0.00 178.00 178.46 2p5w s LYS 268 N -3.89 0.57 0.44 1.05 2.20 -1.26 -5.15 119.74 113.70 2p5w s LYS 268 Ca -0.04 0.65 -0.26 0.00 -0.36 0.00 0.00 55.97 55.96 2p5w s LYS 268 Cb 0.10 0.28 -0.09 0.00 -1.51 0.00 0.00 37.83 36.61 2p5w s LYS 268 CO 0.30 -0.07 1.43 -2.14 -0.36 0.00 0.00 175.35 174.51 2p5w s PRO 269 N 0.20 3.76 0.18 4.03 0.02 -1.26 -4.99 135.00 136.93 2p5w s PRO 269 Ca -0.00 2.43 -0.09 0.00 0.02 0.00 0.00 61.00 63.35 2p5w s PRO 269 Cb -0.03 -2.71 -0.07 0.00 0.02 0.00 0.00 34.50 31.72 2p5w s PRO 269 CO 0.01 -0.76 0.48 -0.51 -0.33 0.00 0.00 177.00 175.89 2p5w s LEU 270 N -2.62 4.24 -0.18 -5.54 1.43 -0.60 -4.93 118.68 110.48 2p5w s LEU 270 Ca 0.60 0.83 0.00 0.00 -1.03 0.00 0.00 54.13 54.53 2p5w s LEU 270 Cb -0.44 -3.44 0.04 0.00 0.03 0.00 0.00 46.19 42.38 2p5w s LEU 270 CO 0.57 0.01 -0.10 -0.89 0.23 0.00 0.00 176.35 176.17 2p5w s THR 271 N -1.68 1.50 -0.01 5.49 2.01 -1.26 -1.16 115.64 120.54 2p5w s THR 271 Ca 0.43 -0.85 -0.01 0.00 0.31 0.00 0.00 61.69 61.57 2p5w s THR 271 Cb -0.12 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.78 2p5w s THR 271 CO 0.21 0.21 0.09 -0.76 -0.69 0.00 0.00 174.62 173.69 2p5w s LEU 272 N 1.47 3.95 0.02 4.42 2.01 0.73 -4.94 118.68 126.33 2p5w s LEU 272 Ca 0.00 0.17 -0.02 0.00 0.01 0.00 0.00 54.13 54.30 2p5w s LEU 272 Cb -0.15 -2.29 -0.01 0.00 0.01 0.00 0.00 46.19 43.74 2p5w s LEU 272 CO -0.08 0.28 0.02 -0.60 1.01 0.00 0.00 176.35 176.97 2p5w s ARG 273 N -1.72 0.37 -0.18 1.70 3.52 -1.26 -0.74 118.95 120.64 2p5w s ARG 273 Ca 0.23 -0.58 -0.29 0.00 -0.13 0.00 0.00 55.73 54.96 2p5w s ARG 273 Cb -0.12 0.14 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 2p5w s ARG 273 CO 0.14 -0.07 1.44 -0.46 -0.81 0.00 0.00 175.30 175.53 2p5w s TRP 274 N -1.55 2.45 -0.35 5.12 -0.11 -1.26 -4.96 118.94 118.28 2p5w s TRP 274 Ca -0.15 0.70 0.03 0.00 1.22 0.00 0.00 56.10 57.90 2p5w s TRP 274 Cb -0.09 -3.78 0.10 0.00 -1.50 0.00 0.00 33.47 28.20 2p5w s TRP 274 CO -0.01 -2.45 0.07 -2.00 -4.62 0.00 0.00 176.95 167.94 2p5w s GLU 275 N 4.03 1.63 0.00 5.86 -6.30 -1.26 -4.75 118.70 117.91 2p5w s GLU 275 Ca 0.63 -1.83 0.00 0.00 -2.50 0.00 0.00 54.97 51.27 2p5w s GLU 275 Cb -0.24 -3.25 0.00 0.00 0.00 0.00 0.00 34.13 30.64 2p5w s GLU 275 CO 0.23 -0.94 0.00 -2.30 0.02 0.00 0.00 175.26 172.27