#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nwi s ASN 2 N 0.00 3.04 0.22 -1.43 2.20 -1.26 -4.83 114.94 112.89 2nwi s ASN 2 Ca 0.00 0.08 -0.07 0.00 -0.94 0.00 0.00 52.86 51.93 2nwi s ASN 2 Cb 0.00 -0.09 0.18 0.00 -2.00 0.00 0.00 41.25 39.35 2nwi s ASN 2 CO 0.00 -2.76 1.79 0.00 -2.94 0.00 0.00 177.10 173.19 2nwi h ALA 3 N -1.59 1.07 -0.30 3.54 0.00 -1.99 -0.60 119.26 119.38 2nwi h ALA 3 Ca -0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 2nwi h ALA 3 Cb 1.22 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2nwi h ALA 3 CO 0.33 0.66 0.15 0.82 0.00 0.00 0.00 179.25 181.21 2nwi h ILE 4 N 1.15 1.15 -0.66 0.00 1.08 -1.95 -1.88 117.51 116.39 2nwi h ILE 4 Ca 0.26 -0.41 0.08 0.00 -0.39 0.00 0.00 64.86 64.40 2nwi h ILE 4 Cb 0.21 0.88 -0.07 0.00 -3.07 0.00 0.00 36.82 34.78 2nwi h ILE 4 CO -0.02 0.15 0.32 0.45 -0.69 0.00 0.00 178.15 178.35 2nwi h HIS 5 N 0.35 0.57 -0.12 1.37 3.86 -1.73 -0.53 115.15 118.91 2nwi h HIS 5 Ca 0.10 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.22 2nwi h HIS 5 Cb 0.11 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 2nwi h HIS 5 CO -0.02 0.21 -0.45 0.00 0.86 0.00 0.00 177.93 178.52 2nwi h ARG 6 N 0.55 0.29 -0.42 2.45 3.08 -0.91 -1.12 114.38 118.31 2nwi h ARG 6 Ca 0.32 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 60.11 2nwi h ARG 6 Cb 0.32 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 2nwi h ARG 6 CO -0.25 0.69 -0.18 0.82 -1.07 0.00 0.00 179.97 179.98 2nwi h ILE 7 N 0.24 1.27 -0.31 2.04 2.04 -0.79 -2.50 117.51 119.48 2nwi h ILE 7 Ca 0.02 -1.28 -0.07 0.00 1.00 0.00 0.00 64.86 64.53 2nwi h ILE 7 Cb 0.90 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 2nwi h ILE 7 CO 0.07 0.43 -0.09 -0.07 0.00 0.00 0.00 178.15 178.50 2nwi h LEU 8 N 0.71 0.50 -1.46 1.44 3.38 -0.63 0.32 115.31 119.57 2nwi h LEU 8 Ca 0.11 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2nwi h LEU 8 Cb 0.68 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2nwi h LEU 8 CO 0.05 0.63 -0.26 0.24 0.09 0.00 0.00 178.44 179.19 2nwi h MET 9 N 0.49 0.00 0.00 1.13 2.86 -0.77 -3.35 114.93 115.29 2nwi h MET 9 Ca 0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2nwi h MET 9 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2nwi h MET 9 CO 0.02 0.26 0.00 0.25 1.06 0.00 0.00 176.91 178.51 2nwi n THR 10 N -3.87 0.00 -2.27 2.22 -2.24 -1.06 -4.78 114.28 102.27 2nwi n THR 10 Ca -0.02 -0.46 -0.33 0.00 -2.27 0.00 0.00 64.05 60.97 2nwi n THR 10 Cb 0.35 1.00 -0.01 0.00 -2.10 0.00 0.00 70.33 69.57 2nwi n THR 10 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2nwi s THR 11 N -0.89 3.83 -0.42 4.28 -1.32 0.08 -4.94 115.64 116.25 2nwi s THR 11 Ca 0.00 0.98 0.10 0.00 -1.21 0.00 0.00 61.69 61.56 2nwi s THR 11 Cb 0.00 -3.43 0.26 0.00 -1.51 0.00 0.00 72.50 67.82 2nwi s THR 11 CO 0.00 -0.40 1.20 -0.90 -2.21 0.00 0.00 174.62 172.31 2nwi n ASP 12 N -1.56 2.78 -4.83 8.08 3.85 -1.26 -5.01 116.55 118.60 2nwi n ASP 12 Ca 0.09 -2.33 -0.24 0.00 -0.71 0.00 0.00 54.79 51.60 2nwi n ASP 12 Cb 0.53 -0.25 0.08 0.00 -1.35 0.00 0.00 41.12 40.12 2nwi n ASP 12 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 2nwi s GLY 13 N -1.41 1.75 0.07 6.12 0.00 -1.26 -4.92 107.32 107.67 2nwi s GLY 13 Ca 0.21 -1.25 -0.33 0.00 0.00 0.00 0.00 44.72 43.36 2nwi s GLY 13 CO 0.08 -0.81 1.76 -1.26 0.00 0.00 0.00 173.10 172.87 2nwi n SER 14 N -2.79 3.53 0.17 1.64 2.88 -1.26 -4.90 113.62 112.89 2nwi n SER 14 Ca 0.10 1.02 0.03 0.00 -1.33 0.00 0.00 58.87 58.69 2nwi n SER 14 Cb 0.60 -1.45 0.25 0.00 -0.75 0.00 0.00 64.21 62.86 2nwi n SER 14 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2nwi h ILE 15 N 4.53 1.07 -0.64 2.46 1.08 -1.99 -3.04 117.51 120.97 2nwi h ILE 15 Ca -0.46 -1.81 -0.08 0.00 -0.39 0.00 0.00 64.86 62.12 2nwi h ILE 15 Cb 1.25 2.06 -0.03 0.00 -3.07 0.00 0.00 36.82 37.03 2nwi h ILE 15 CO 0.93 0.47 0.11 0.74 -0.69 0.00 0.00 178.15 179.70 2nwi h THR 16 N 0.00 1.26 -0.33 -0.27 2.02 -1.99 -1.79 112.91 111.81 2nwi h THR 16 Ca -0.00 -1.02 -0.06 0.00 0.77 0.00 0.00 66.41 66.10 2nwi h THR 16 Cb 1.02 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2nwi h THR 16 CO 0.06 0.38 -0.03 0.00 0.37 0.00 0.00 175.52 176.30 2nwi h ALA 17 N 1.04 1.34 0.04 6.16 0.00 -1.94 -0.17 119.26 125.73 2nwi h ALA 17 Ca 0.20 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2nwi h ALA 17 Cb 0.43 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2nwi h ALA 17 CO 0.01 0.45 -0.02 0.82 0.00 0.00 0.00 179.25 180.51 2nwi h ILE 18 N 0.49 1.22 -0.59 0.00 2.04 -1.40 -0.96 117.51 118.30 2nwi h ILE 18 Ca 0.10 -0.89 0.08 0.00 1.00 0.00 0.00 64.86 65.16 2nwi h ILE 18 Cb 0.37 1.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.19 2nwi h ILE 18 CO 0.02 0.22 0.24 0.40 0.00 0.00 0.00 178.15 179.03 2nwi h ILE 19 N -0.46 0.81 -0.56 -0.67 2.04 -1.19 0.19 117.51 117.67 2nwi h ILE 19 Ca -0.01 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 2nwi h ILE 19 Cb 0.41 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2nwi h ILE 19 CO 0.01 0.08 0.06 -0.33 0.00 0.00 0.00 178.15 177.97 2nwi h GLU 20 N 0.43 0.95 -0.40 2.37 5.08 -0.99 -0.38 114.58 121.64 2nwi h GLU 20 Ca 0.29 -0.27 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 2nwi h GLU 20 Cb 0.33 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2nwi h GLU 20 CO -0.27 0.93 -0.02 0.00 -1.00 0.00 0.00 179.01 178.64 2nwi h ALA 21 N 0.98 1.20 -0.02 3.43 0.00 -0.85 0.23 119.26 124.24 2nwi h ALA 21 Ca 0.17 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2nwi h ALA 21 Cb 0.46 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2nwi h ALA 21 CO 0.02 0.52 -0.25 0.28 0.00 0.00 0.00 179.25 179.82 2nwi h VAL 22 N 0.62 1.51 0.00 0.00 2.07 -0.71 -3.32 116.25 116.42 2nwi h VAL 22 Ca 0.12 -1.86 0.00 0.00 0.82 0.00 0.00 66.70 65.78 2nwi h VAL 22 Cb 0.43 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 2nwi h VAL 22 CO 0.02 0.51 -0.44 0.71 0.02 0.00 0.00 177.57 178.39 2nwi h THR 23 N -0.43 0.00 -3.79 2.57 1.35 -1.10 -3.47 112.91 108.03 2nwi h THR 23 Ca -0.03 -0.83 -0.26 0.00 -0.55 0.00 0.00 66.41 64.73 2nwi h THR 23 Cb 0.97 1.59 -0.01 0.00 -1.73 0.00 0.00 68.15 68.97 2nwi h THR 23 CO 0.05 0.00 -0.34 0.00 -0.25 0.00 0.00 175.52 174.98 2nwi n GLN 24 N -2.67 -2.22 -4.30 4.72 6.02 0.79 -4.94 117.38 114.78 2nwi n GLN 24 Ca 0.03 0.63 -0.19 0.00 -0.01 0.00 0.00 57.00 57.46 2nwi n GLN 24 Cb 0.51 -5.24 -0.11 0.00 1.02 0.00 0.00 30.24 26.42 2nwi n GLN 24 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2nwi s LYS 25 N -5.05 1.19 0.29 -1.09 -0.14 -1.21 -5.04 119.74 108.69 2nwi s LYS 25 Ca 0.01 -1.42 -0.29 0.00 -1.36 0.00 0.00 55.97 52.91 2nwi s LYS 25 Cb -0.00 -1.05 -0.09 0.00 -1.68 0.00 0.00 37.83 35.00 2nwi s LYS 25 CO 0.01 0.19 1.08 0.15 -0.76 0.00 0.00 175.35 176.02 2nwi s LYS 26 N -3.15 4.60 0.11 1.68 -0.14 -1.26 -4.24 119.74 117.34 2nwi s LYS 26 Ca 0.16 1.74 -0.30 0.00 -1.36 0.00 0.00 55.97 56.21 2nwi s LYS 26 Cb -0.03 -3.12 -0.06 0.00 -1.68 0.00 0.00 37.83 32.94 2nwi s LYS 26 CO 0.05 0.20 1.08 0.08 -0.76 0.00 0.00 175.35 176.00 2nwi s VAL 27 N -1.22 4.18 -0.16 3.17 1.01 -1.26 -4.58 120.40 121.53 2nwi s VAL 27 Ca 0.46 1.73 -0.03 0.00 0.00 0.00 0.00 61.98 64.14 2nwi s VAL 27 Cb -0.30 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 31.95 2nwi s VAL 27 CO 0.39 0.23 -0.05 -0.70 0.00 0.00 0.00 175.10 174.96 2nwi s GLU 28 N 0.26 3.57 -0.22 2.72 2.12 0.95 -4.94 118.70 123.17 2nwi s GLU 28 Ca 0.52 -0.56 -0.12 0.00 0.36 0.00 0.00 54.97 55.16 2nwi s GLU 28 Cb -0.27 -2.89 -0.05 0.00 0.26 0.00 0.00 34.13 31.18 2nwi s GLU 28 CO 0.31 0.16 0.24 0.08 -0.54 0.00 0.00 175.26 175.51 2nwi s VAL 29 N 0.57 5.32 -0.18 3.70 1.01 -1.26 0.25 120.40 129.80 2nwi s VAL 29 Ca -0.04 0.36 -0.05 0.00 0.00 0.00 0.00 61.98 62.26 2nwi s VAL 29 Cb -0.15 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 2nwi s VAL 29 CO 0.03 0.33 -0.01 -0.70 0.00 0.00 0.00 175.10 174.75 2nwi s GLU 30 N 0.99 3.65 -0.15 2.72 2.12 -0.30 -4.99 118.70 122.73 2nwi s GLU 30 Ca 0.12 -0.52 -0.22 0.00 0.36 0.00 0.00 54.97 54.71 2nwi s GLU 30 Cb -0.13 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.21 2nwi s GLU 30 CO 0.05 0.10 0.68 0.99 -0.54 0.00 0.00 175.26 176.54 2nwi s THR 31 N 0.75 5.01 -0.22 -1.70 2.01 -1.26 -1.40 115.64 118.83 2nwi s THR 31 Ca -0.00 1.34 0.12 0.00 0.31 0.00 0.00 61.69 63.46 2nwi s THR 31 Cb -0.14 -4.00 -0.22 0.00 0.01 0.00 0.00 72.50 68.15 2nwi s THR 31 CO 0.02 0.15 -0.03 0.18 -0.69 0.00 0.00 174.62 174.25 2nwi n LEU 32 N 4.62 1.00 -3.74 4.42 4.77 0.76 -4.96 117.00 123.87 2nwi n LEU 32 Ca -0.01 -0.05 -0.14 0.00 -0.03 0.00 0.00 56.01 55.79 2nwi n LEU 32 Cb 0.50 0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.53 2nwi n LEU 32 CO 0.46 0.64 0.06 -1.83 -1.33 0.00 0.00 177.39 175.38 2nwi s GLU 33 N -2.49 0.66 -0.15 3.23 -1.05 -1.11 -4.97 118.70 112.82 2nwi s GLU 33 Ca -0.18 -0.05 -0.04 0.00 -0.15 0.00 0.00 54.97 54.54 2nwi s GLU 33 Cb 0.07 0.30 0.07 0.00 -0.44 0.00 0.00 34.13 34.13 2nwi s GLU 33 CO 0.74 -0.18 0.26 -1.14 0.95 0.00 0.00 175.26 175.90 2nwi s GLN 34 N -1.09 0.17 0.01 -4.83 2.00 -1.26 -1.30 119.66 113.36 2nwi s GLN 34 Ca -0.11 0.64 -0.01 0.00 -2.00 0.00 0.00 55.36 53.87 2nwi s GLN 34 Cb -0.04 -0.27 -0.01 0.00 0.80 0.00 0.00 33.01 33.48 2nwi s GLN 34 CO 0.04 -0.38 0.01 0.15 -0.50 0.00 0.00 175.29 174.62 2nwi s LYS 35 N 2.41 0.27 -0.22 1.67 1.02 -0.62 -5.00 119.74 119.27 2nwi s LYS 35 Ca 0.03 -0.42 -0.20 0.00 0.02 0.00 0.00 55.97 55.40 2nwi s LYS 35 Cb -0.13 0.10 -0.02 0.00 -0.52 0.00 0.00 37.83 37.26 2nwi s LYS 35 CO -0.10 -0.05 0.61 0.42 -0.92 0.00 0.00 175.35 175.31 2nwi s ILE 36 N -1.10 5.02 0.28 2.17 -1.09 -1.26 -0.50 121.20 124.72 2nwi s ILE 36 Ca -0.12 1.11 0.11 0.00 -2.23 0.00 0.00 60.65 59.52 2nwi s ILE 36 Cb -0.07 -3.92 -0.05 0.00 -1.58 0.00 0.00 42.46 36.84 2nwi s ILE 36 CO -0.00 0.09 -0.17 0.27 -1.23 0.00 0.00 174.94 173.89 2nwi s ILE 37 N 2.13 2.33 -0.08 2.92 -4.36 -0.03 -4.94 121.20 119.18 2nwi s ILE 37 Ca 0.27 -2.35 -0.20 0.00 -0.26 0.00 0.00 60.65 58.11 2nwi s ILE 37 Cb -0.16 -2.33 -0.04 0.00 1.25 0.00 0.00 42.46 41.19 2nwi s ILE 37 CO 0.09 -0.39 0.56 -0.13 0.24 0.00 0.00 174.94 175.31 2nwi s ARG 38 N -3.55 4.35 0.07 0.37 1.81 -1.26 -0.78 118.95 119.95 2nwi s ARG 38 Ca 0.29 0.62 -0.31 0.00 -1.72 0.00 0.00 55.73 54.62 2nwi s ARG 38 Cb -0.03 -3.41 -0.09 0.00 -0.45 0.00 0.00 34.95 30.97 2nwi s ARG 38 CO 0.14 0.19 1.73 0.00 -0.68 0.00 0.00 175.30 176.68 2nwi s ALA 39 N 0.45 3.68 1.05 2.13 0.00 -0.12 -4.84 121.76 124.12 2nwi s ALA 39 Ca 0.30 1.25 -0.16 0.00 0.00 0.00 0.00 51.96 53.35 2nwi s ALA 39 Cb -0.16 -3.73 0.23 0.00 0.00 0.00 0.00 23.12 19.45 2nwi s ALA 39 CO 0.14 -1.22 1.20 -0.40 0.00 0.00 0.00 175.76 175.48 2nwi n ASP 40 N 6.00 -0.36 0.14 0.00 5.68 -1.26 -0.16 116.55 126.59 2nwi n ASP 40 Ca 0.17 -1.38 -0.14 0.00 -0.50 0.00 0.00 54.79 52.94 2nwi n ASP 40 Cb 0.40 -0.95 -0.07 0.00 -1.14 0.00 0.00 41.12 39.36 2nwi n ASP 40 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 2nwi h ARG 41 N 0.00 -0.30 -0.57 0.11 2.43 -1.97 0.12 114.38 114.20 2nwi h ARG 41 Ca -0.40 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 58.73 2nwi h ARG 41 Cb 1.12 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.71 2nwi h ARG 41 CO 0.28 -0.20 0.11 1.05 -1.51 0.00 0.00 179.97 179.69 2nwi h GLU 42 N -0.31 0.90 -0.37 0.20 4.11 -1.99 -0.65 114.58 116.46 2nwi h GLU 42 Ca -0.02 -0.21 -0.15 0.00 0.07 0.00 0.00 59.36 59.05 2nwi h GLU 42 Cb 0.26 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2nwi h GLU 42 CO 0.02 0.83 -0.37 1.25 0.07 0.00 0.00 179.01 180.81 2nwi h LEU 43 N 0.86 0.96 -0.70 3.06 5.85 -1.88 -1.65 115.31 121.81 2nwi h LEU 43 Ca 0.18 -0.47 0.09 0.00 0.84 0.00 0.00 57.88 58.52 2nwi h LEU 43 Cb 0.36 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 2nwi h LEU 43 CO 0.01 1.23 0.36 0.00 -0.34 0.00 0.00 178.44 179.69 2nwi h ALA 44 N 0.76 0.96 0.08 1.25 0.00 -0.28 -1.05 119.26 120.98 2nwi h ALA 44 Ca 0.06 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2nwi h ALA 44 Cb 0.96 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2nwi h ALA 44 CO 0.09 -0.03 -0.04 0.93 0.00 0.00 0.00 179.25 180.21 2nwi h GLU 45 N 0.62 -0.10 -0.89 0.00 5.08 -0.86 -0.89 114.58 117.53 2nwi h GLU 45 Ca 0.34 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.78 2nwi h GLU 45 Cb 0.33 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 2nwi h GLU 45 CO -0.25 0.04 0.58 1.25 -1.00 0.00 0.00 179.01 179.63 2nwi h LEU 46 N -0.22 0.86 -1.46 1.33 5.85 -0.90 -2.48 115.31 118.31 2nwi h LEU 46 Ca -0.01 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2nwi h LEU 46 Cb 0.18 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2nwi h LEU 46 CO 0.02 0.54 -0.05 0.18 -0.34 0.00 0.00 178.44 178.79 2nwi n LEU 47 N -4.50 2.31 -3.64 2.25 4.77 -0.43 -4.94 117.00 112.82 2nwi n LEU 47 Ca 0.14 -0.77 -0.23 0.00 -0.03 0.00 0.00 56.01 55.11 2nwi n LEU 47 Cb 0.24 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.36 2nwi n LEU 47 CO 0.32 0.39 -0.06 -0.62 -1.33 0.00 0.00 177.39 176.09 2nwi n GLU 48 N 0.74 -3.35 -3.95 3.23 1.02 -0.45 -4.48 120.64 113.40 2nwi n GLU 48 Ca 0.15 0.60 -0.18 0.00 -0.02 0.00 0.00 57.16 57.71 2nwi n GLU 48 Cb 0.49 -4.94 -0.07 0.00 -0.02 0.00 0.00 31.44 26.91 2nwi n GLU 48 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2nwi n ILE 49 N -4.09 0.00 -3.42 -3.67 -5.35 -0.56 -4.95 119.36 97.33 2nwi n ILE 49 Ca -0.21 -2.08 -0.33 0.00 -0.27 0.00 0.00 62.75 59.87 2nwi n ILE 49 Cb 0.64 0.97 -0.05 0.00 -1.74 0.00 0.00 39.64 39.46 2nwi n ILE 49 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2nwi s ASP 50 N -3.04 6.67 0.27 7.28 1.01 -1.26 -4.45 116.67 123.15 2nwi s ASP 50 Ca 0.30 0.94 -0.30 0.00 0.71 0.00 0.00 52.55 54.20 2nwi s ASP 50 Cb 0.01 -2.23 -0.13 0.00 1.01 0.00 0.00 42.92 41.58 2nwi s ASP 50 CO 0.21 -0.01 1.42 1.21 0.21 0.00 0.00 175.17 178.22 2nwi n GLU 51 N 0.17 2.20 -0.22 8.23 2.13 -1.26 -1.70 120.64 130.19 2nwi n GLU 51 Ca -0.02 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.58 2nwi n GLU 51 Cb 0.52 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.78 2nwi n GLU 51 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2nwi n GLY 52 N 1.87 1.36 3.78 8.31 0.00 0.78 -4.97 105.19 116.32 2nwi n GLY 52 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2nwi n GLY 52 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2nwi s ASP 53 N -3.09 5.76 0.18 1.61 1.01 -0.69 -4.59 116.67 116.87 2nwi s ASP 53 Ca 0.00 2.08 -0.30 0.00 0.71 0.00 0.00 52.55 55.05 2nwi s ASP 53 Cb 0.00 -2.57 -0.08 0.00 1.01 0.00 0.00 42.92 41.28 2nwi s ASP 53 CO 0.00 -1.19 0.94 -1.61 0.21 0.00 0.00 175.17 173.52 2nwi s GLU 54 N -3.43 4.78 -0.02 8.23 2.02 -1.26 -0.94 118.70 128.07 2nwi s GLU 54 Ca 0.70 1.45 0.01 0.00 0.02 0.00 0.00 54.97 57.15 2nwi s GLU 54 Cb -0.21 -3.32 0.01 0.00 0.10 0.00 0.00 34.13 30.71 2nwi s GLU 54 CO 0.28 0.40 -0.03 0.08 0.02 0.00 0.00 175.26 176.01 2nwi s VAL 55 N -0.72 0.37 -0.33 2.63 1.01 0.04 -1.98 120.40 121.42 2nwi s VAL 55 Ca 0.43 -0.10 -0.27 0.00 0.00 0.00 0.00 61.98 62.04 2nwi s VAL 55 Cb -0.25 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 35.77 2nwi s VAL 55 CO 0.31 0.15 0.96 0.21 0.00 0.00 0.00 175.10 176.73 2nwi s ASN 56 N 0.49 6.80 -0.28 3.32 3.84 0.10 -0.85 114.94 128.37 2nwi s ASN 56 Ca -0.06 0.83 -0.09 0.00 0.21 0.00 0.00 52.86 53.76 2nwi s ASN 56 Cb -0.09 -2.49 -0.02 0.00 -0.55 0.00 0.00 41.25 38.10 2nwi s ASN 56 CO -0.00 -0.80 0.12 -0.47 -2.79 0.00 0.00 177.10 173.15 2nwi s TYR 57 N 3.42 3.14 -0.03 0.43 5.04 0.34 -0.87 117.35 128.83 2nwi s TYR 57 Ca 0.40 -0.42 0.04 0.00 -2.44 0.00 0.00 57.07 54.65 2nwi s TYR 57 Cb -0.13 -2.30 -0.00 0.00 0.35 0.00 0.00 41.96 39.88 2nwi s TYR 57 CO 0.15 -0.37 -0.13 0.50 -1.34 0.00 0.00 175.55 174.36 2nwi s ARG 58 N 1.63 1.25 -0.09 4.97 3.52 -0.65 -1.59 118.95 127.99 2nwi s ARG 58 Ca 0.06 -0.45 0.03 0.00 -0.13 0.00 0.00 55.73 55.24 2nwi s ARG 58 Cb -0.16 -1.15 0.00 0.00 -1.56 0.00 0.00 34.95 32.09 2nwi s ARG 58 CO 0.06 0.21 -0.20 0.08 -0.81 0.00 0.00 175.30 174.63 2nwi s VAL 59 N -0.00 1.78 0.08 7.11 1.01 -0.42 -0.91 120.40 129.05 2nwi s VAL 59 Ca -0.01 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.13 2nwi s VAL 59 Cb -0.08 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2nwi s VAL 59 CO 0.01 0.50 -0.06 0.68 0.00 0.00 0.00 175.10 176.23 2nwi s VAL 60 N 0.47 0.55 -0.10 2.92 -7.23 0.14 -0.17 120.40 117.00 2nwi s VAL 60 Ca -0.17 -1.81 -0.04 0.00 -1.81 0.00 0.00 61.98 58.15 2nwi s VAL 60 Cb -0.17 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 2nwi s VAL 60 CO 0.07 -0.86 0.06 -0.31 -0.31 0.00 0.00 175.10 173.75 2nwi s TYR 61 N -3.46 3.34 -0.31 2.82 4.12 -0.50 -0.90 117.35 122.45 2nwi s TYR 61 Ca 0.08 0.33 -0.11 0.00 0.02 0.00 0.00 57.07 57.39 2nwi s TYR 61 Cb 0.04 -1.85 -0.02 0.00 -1.52 0.00 0.00 41.96 38.62 2nwi s TYR 61 CO -0.05 0.58 0.18 -0.51 0.02 0.00 0.00 175.55 175.76 2nwi s LEU 62 N -0.96 4.20 0.14 -1.29 1.43 -0.20 -1.15 118.68 120.84 2nwi s LEU 62 Ca 0.14 -0.41 0.05 0.00 -1.03 0.00 0.00 54.13 52.88 2nwi s LEU 62 Cb -0.12 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 2nwi s LEU 62 CO 0.03 -0.18 0.09 -0.13 0.23 0.00 0.00 176.35 176.40 2nwi s ARG 63 N 1.67 2.81 -0.17 1.70 0.52 0.14 -1.09 118.95 124.52 2nwi s ARG 63 Ca 0.05 -0.84 -0.15 0.00 -0.52 0.00 0.00 55.73 54.27 2nwi s ARG 63 Cb -0.17 -2.63 0.04 0.00 0.52 0.00 0.00 34.95 32.72 2nwi s ARG 63 CO 0.08 0.51 0.45 0.00 0.02 0.00 0.00 175.30 176.36 2nwi s ALA 64 N -1.61 -1.12 0.00 2.13 0.00 -0.59 -0.04 121.76 120.53 2nwi s ALA 64 Ca 0.30 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.54 2nwi s ALA 64 Cb -0.11 -0.75 0.00 0.00 0.00 0.00 0.00 23.12 22.26 2nwi s ALA 64 CO 0.22 -0.22 0.00 -1.71 0.00 0.00 0.00 175.76 174.05 2nwi n ASN 65 N 2.88 0.00 -0.38 0.00 5.15 -1.26 -2.06 115.26 119.59 2nwi n ASN 65 Ca -0.14 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.84 2nwi n ASN 65 Cb 0.57 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.82 2nwi n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2nwi n GLY 66 N 0.00 0.82 3.61 8.20 0.00 -1.26 -5.10 105.19 111.46 2nwi n GLY 66 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2nwi n GLY 66 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2nwi s GLU 67 N 0.00 2.23 -0.27 1.61 -1.05 -0.88 -5.06 118.70 115.29 2nwi s GLU 67 Ca 0.00 -0.98 -0.29 0.00 -0.15 0.00 0.00 54.97 53.55 2nwi s GLU 67 Cb 0.00 -2.36 -0.01 0.00 -0.44 0.00 0.00 34.13 31.32 2nwi s GLU 67 CO 0.00 0.52 1.36 0.42 0.95 0.00 0.00 175.26 178.51 2nwi s ILE 68 N -1.24 4.06 -0.19 1.83 1.01 -1.26 -1.55 121.20 123.86 2nwi s ILE 68 Ca 0.23 1.21 0.20 0.00 0.00 0.00 0.00 60.65 62.29 2nwi s ILE 68 Cb -0.11 -4.05 -0.30 0.00 0.01 0.00 0.00 42.46 38.01 2nwi s ILE 68 CO 0.15 -0.40 0.52 -1.22 0.00 0.00 0.00 174.94 173.98 2nwi n TYR 69 N 7.68 0.00 -3.73 3.97 4.02 -0.25 -4.84 117.16 124.00 2nwi n TYR 69 Ca 0.15 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.91 2nwi n TYR 69 Cb 0.46 -0.38 -0.08 0.00 -0.02 0.00 0.00 39.34 39.31 2nwi n TYR 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2nwi s ALA 70 N -3.32 -0.91 -0.10 -0.72 0.00 -1.15 -4.14 121.76 111.44 2nwi s ALA 70 Ca -0.05 0.48 0.01 0.00 0.00 0.00 0.00 51.96 52.41 2nwi s ALA 70 Cb 0.13 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 2nwi s ALA 70 CO 0.84 -0.27 -0.14 0.21 0.00 0.00 0.00 175.76 176.40 2nwi s LYS 71 N -1.23 3.01 -0.02 0.00 2.20 -0.70 -1.03 119.74 121.97 2nwi s LYS 71 Ca -0.13 -0.69 0.01 0.00 -0.36 0.00 0.00 55.97 54.80 2nwi s LYS 71 Cb -0.04 -2.52 0.01 0.00 -1.51 0.00 0.00 37.83 33.76 2nwi s LYS 71 CO 0.05 0.39 -0.03 0.00 -0.36 0.00 0.00 175.35 175.39 2nwi s ALA 72 N -0.11 0.40 -0.14 3.13 0.00 -0.08 -0.30 121.76 124.66 2nwi s ALA 72 Ca -0.02 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 51.91 2nwi s ALA 72 Cb -0.14 -0.21 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2nwi s ALA 72 CO 0.04 0.03 -0.22 0.42 0.00 0.00 0.00 175.76 176.02 2nwi s ILE 73 N 0.39 2.06 0.10 0.00 1.01 0.71 -0.68 121.20 124.79 2nwi s ILE 73 Ca -0.04 -0.98 0.08 0.00 0.00 0.00 0.00 60.65 59.71 2nwi s ILE 73 Cb -0.07 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 2nwi s ILE 73 CO -0.01 0.55 -0.22 -0.94 0.00 0.00 0.00 174.94 174.33 2nwi s SER 74 N 0.77 2.63 -0.14 3.58 1.04 -0.09 -0.16 113.70 121.34 2nwi s SER 74 Ca -0.08 -0.68 0.01 0.00 0.48 0.00 0.00 55.95 55.68 2nwi s SER 74 Cb -0.16 -0.16 0.02 0.00 0.10 0.00 0.00 66.02 65.83 2nwi s SER 74 CO -0.01 0.09 -0.14 -0.36 0.98 0.00 0.00 173.24 173.80 2nwi s PHE 75 N -1.11 2.07 -0.22 5.02 0.40 -0.14 -1.64 117.98 122.36 2nwi s PHE 75 Ca 0.07 -1.11 0.01 0.00 -0.60 0.00 0.00 56.93 55.30 2nwi s PHE 75 Cb -0.10 -1.53 0.05 0.00 0.51 0.00 0.00 43.02 41.96 2nwi s PHE 75 CO 0.04 -0.61 -0.08 0.99 0.70 0.00 0.00 175.22 176.26 2nwi s THR 76 N 1.38 1.65 0.13 0.64 2.01 -0.04 -1.44 115.64 119.97 2nwi s THR 76 Ca 0.02 -1.18 -0.31 0.00 0.31 0.00 0.00 61.69 60.53 2nwi s THR 76 Cb -0.13 -1.82 -0.09 0.00 0.01 0.00 0.00 72.50 70.46 2nwi s THR 76 CO -0.08 0.02 1.61 -2.84 -0.69 0.00 0.00 174.62 172.64 2nwi s PRO 77 N 1.36 4.20 0.19 4.92 0.02 -1.25 0.01 135.00 144.45 2nwi s PRO 77 Ca -0.04 2.36 -0.08 0.00 0.02 0.00 0.00 61.00 63.26 2nwi s PRO 77 Cb -0.18 -3.33 0.10 0.00 0.02 0.00 0.00 34.50 31.11 2nwi s PRO 77 CO -0.07 -0.66 1.62 -0.07 -0.33 0.00 0.00 177.00 177.48 2nwi h LEU 78 N 7.51 0.96 -1.60 -5.54 3.38 -1.77 -2.69 115.31 115.56 2nwi h LEU 78 Ca -0.43 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.23 2nwi h LEU 78 Cb 1.20 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2nwi h LEU 78 CO 0.92 1.09 0.47 0.50 0.09 0.00 0.00 178.44 181.51 2nwi h LYS 79 N 0.85 0.00 -0.01 1.13 3.64 -1.91 -1.99 116.57 118.27 2nwi h LYS 79 Ca 0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2nwi h LYS 79 Cb 0.68 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2nwi h LYS 79 CO 0.05 0.00 -0.52 -2.13 -2.27 0.00 0.00 179.45 174.58 2nwi n ARG 80 N -2.82 1.13 -3.21 1.90 0.63 -1.01 -4.95 116.66 108.32 2nwi n ARG 80 Ca -0.01 -0.92 -0.39 0.00 -0.92 0.00 0.00 57.85 55.61 2nwi n ARG 80 Cb 0.51 -1.48 -0.06 0.00 0.45 0.00 0.00 32.46 31.89 2nwi n ARG 80 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2nwi s LEU 81 N -2.51 4.48 0.38 6.15 1.02 -0.75 -5.06 118.68 122.39 2nwi s LEU 81 Ca 0.17 1.26 -0.24 0.00 0.02 0.00 0.00 54.13 55.34 2nwi s LEU 81 Cb 0.18 -2.95 -0.10 0.00 0.02 0.00 0.00 46.19 43.34 2nwi s LEU 81 CO 0.59 0.19 1.00 -1.61 0.02 0.00 0.00 176.35 176.54 2nwi s GLU 82 N -0.69 4.31 0.37 1.70 2.02 -1.26 -4.82 118.70 120.33 2nwi s GLU 82 Ca 0.31 1.39 0.11 0.00 0.02 0.00 0.00 54.97 56.79 2nwi s GLU 82 Cb -0.19 -2.56 0.89 0.00 0.10 0.00 0.00 34.13 32.36 2nwi s GLU 82 CO 0.19 0.01 1.85 -0.91 0.02 0.00 0.00 175.26 176.42 2nwi h ASN 83 N 2.62 0.60 0.32 -0.19 2.35 -1.98 0.21 115.58 119.51 2nwi h ASN 83 Ca -0.48 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.31 2nwi h ASN 83 Cb 1.20 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.51 2nwi h ASN 83 CO 0.63 0.27 -0.15 0.77 -1.65 0.00 0.00 177.43 177.29 2nwi h SER 84 N 0.61 -0.37 -0.68 5.81 4.64 -2.00 -2.92 113.55 118.64 2nwi h SER 84 Ca 0.48 -0.13 0.06 0.00 -0.47 0.00 0.00 61.79 61.73 2nwi h SER 84 Cb 0.90 0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 63.04 2nwi h SER 84 CO -0.23 -0.07 0.45 0.15 -0.87 0.00 0.00 176.83 176.26 2nwi h PHE 85 N -0.68 0.72 -0.36 4.77 3.57 -1.36 -2.05 116.94 121.56 2nwi h PHE 85 Ca -0.04 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 2nwi h PHE 85 Cb 0.47 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 2nwi h PHE 85 CO 0.00 0.39 0.09 -0.09 -2.23 0.00 0.00 178.31 176.48 2nwi h ARG 86 N 0.72 0.57 0.00 1.11 2.43 -0.71 -2.24 114.38 116.26 2nwi h ARG 86 Ca 0.29 -0.13 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 2nwi h ARG 86 Cb 0.23 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 2nwi h ARG 86 CO -0.09 0.61 -0.27 0.93 -1.51 0.00 0.00 179.97 179.63 2nwi h GLU 87 N 0.43 0.00 0.00 0.20 5.08 -1.18 -2.37 114.58 116.73 2nwi h GLU 87 Ca 0.11 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.32 2nwi h GLU 87 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2nwi h GLU 87 CO 0.00 0.27 -0.74 -0.44 -1.00 0.00 0.00 179.01 177.10 2nwi h ASP 88 N 0.00 0.00 -3.33 1.42 3.32 -1.24 -3.52 116.42 113.08 2nwi h ASP 88 Ca -0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2nwi h ASP 88 Cb 0.54 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 2nwi h ASP 88 CO 0.04 0.74 -0.18 -0.22 -1.72 0.00 0.00 179.24 177.90 2nwi s LEU 89 N -7.22 4.18 0.56 1.55 2.96 -0.86 -5.10 118.68 114.75 2nwi s LEU 89 Ca -0.00 0.80 0.33 0.00 -0.22 0.00 0.00 54.13 55.03 2nwi s LEU 89 Cb 0.11 -3.56 1.48 0.00 0.50 0.00 0.00 46.19 44.73 2nwi s LEU 89 CO 0.78 -0.05 1.82 1.23 -1.32 0.00 0.00 176.35 178.81 2nwi h GLY 97 N 2.52 0.00 1.34 7.98 0.00 -2.07 -3.51 103.07 109.33 2nwi h GLY 97 Ca -0.47 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 2nwi h GLY 97 CO 0.70 0.00 -0.03 0.50 0.00 0.00 0.00 176.54 177.71 2nwi h LYS 98 N 0.00 0.80 0.00 4.80 1.57 -2.05 -1.39 116.57 120.29 2nwi h LYS 98 Ca 0.44 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2nwi h LYS 98 Cb 1.90 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 34.13 2nwi h LYS 98 CO -0.00 0.82 -0.00 0.82 -0.57 0.00 0.00 179.45 180.51 2nwi h ILE 99 N 0.74 0.06 0.06 1.86 2.04 -1.99 -2.87 117.51 117.41 2nwi h ILE 99 Ca 0.14 -0.09 -0.33 0.00 1.00 0.00 0.00 64.86 65.58 2nwi h ILE 99 Cb 0.49 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2nwi h ILE 99 CO 0.03 0.00 -1.84 0.23 0.00 0.00 0.00 178.15 176.57 2nwi n MET 100 N -3.16 0.66 0.04 2.37 2.81 -0.56 -2.33 117.12 116.95 2nwi n MET 100 Ca -0.02 0.37 -0.01 0.00 -1.81 0.00 0.00 57.70 56.22 2nwi n MET 100 Cb 0.11 -1.68 0.28 0.00 -0.71 0.00 0.00 33.22 31.21 2nwi n MET 100 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2nwi h ARG 101 N -0.43 0.43 -0.35 0.03 3.08 -1.53 0.63 114.38 116.24 2nwi h ARG 101 Ca -0.44 -0.12 -0.11 0.00 0.07 0.00 0.00 59.98 59.38 2nwi h ARG 101 Cb 1.72 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.71 2nwi h ARG 101 CO -0.09 0.57 -0.22 0.87 -1.07 0.00 0.00 179.97 180.03 2nwi h LYS 102 N 0.39 0.68 -0.45 0.04 1.57 -1.61 -3.00 116.57 114.19 2nwi h LYS 102 Ca 0.07 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2nwi h LYS 102 Cb 0.49 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2nwi h LYS 102 CO 0.03 0.84 0.00 0.72 -0.57 0.00 0.00 179.45 180.47 2nwi n HIS 103 N -4.12 0.59 -3.84 -1.35 8.25 -0.98 -4.96 115.22 108.80 2nwi n HIS 103 Ca 0.00 -0.29 -0.26 0.00 -0.26 0.00 0.00 57.72 56.91 2nwi n HIS 103 Cb 0.41 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.54 2nwi n HIS 103 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2nwi n ASN 104 N 1.23 -2.39 -4.69 0.41 3.02 -0.85 -4.90 115.26 107.09 2nwi n ASN 104 Ca 0.19 -0.84 -0.42 0.00 -0.03 0.00 0.00 54.58 53.48 2nwi n ASN 104 Cb 0.53 -3.79 -0.03 0.00 -0.61 0.00 0.00 39.78 35.88 2nwi n ASN 104 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2nwi s ILE 105 N -3.57 4.18 -0.07 2.41 1.01 0.16 -5.01 121.20 120.31 2nwi s ILE 105 Ca 0.27 1.51 -0.19 0.00 0.00 0.00 0.00 60.65 62.24 2nwi s ILE 105 Cb -0.13 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.32 2nwi s ILE 105 CO 0.83 0.01 0.52 -1.61 0.00 0.00 0.00 174.94 174.70 2nwi s GLU 106 N 2.17 4.30 0.31 2.79 2.02 -1.26 -4.88 118.70 124.14 2nwi s GLU 106 Ca 0.57 0.57 -0.17 0.00 0.02 0.00 0.00 54.97 55.96 2nwi s GLU 106 Cb -0.26 -3.39 0.03 0.00 0.10 0.00 0.00 34.13 30.61 2nwi s GLU 106 CO 0.23 0.27 0.69 0.00 0.02 0.00 0.00 175.26 176.47 2nwi s ALA 107 N 0.21 -0.84 0.22 5.21 0.00 -1.26 -4.66 121.76 120.63 2nwi s ALA 107 Ca 0.28 -0.58 0.05 0.00 0.00 0.00 0.00 51.96 51.71 2nwi s ALA 107 Cb -0.16 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 23.75 2nwi s ALA 107 CO 0.13 -0.98 -0.05 -0.98 0.00 0.00 0.00 175.76 173.88 2nwi s ARG 108 N -3.43 1.31 -0.11 0.00 1.70 -0.47 -4.96 118.95 112.98 2nwi s ARG 108 Ca 0.15 -1.64 -0.00 0.00 -0.47 0.00 0.00 55.73 53.77 2nwi s ARG 108 Cb -0.05 -0.76 -0.02 0.00 -0.57 0.00 0.00 34.95 33.55 2nwi s ARG 108 CO 0.09 -0.01 -0.10 0.50 -1.08 0.00 0.00 175.30 174.70 2nwi s ARG 109 N -3.79 3.20 -0.33 3.89 3.52 -1.26 -0.11 118.95 124.08 2nwi s ARG 109 Ca 0.25 -0.63 0.03 0.00 -0.13 0.00 0.00 55.73 55.25 2nwi s ARG 109 Cb 0.04 -2.65 0.10 0.00 -1.56 0.00 0.00 34.95 30.88 2nwi s ARG 109 CO 0.07 0.36 0.05 -2.00 -0.81 0.00 0.00 175.30 172.97 2nwi s GLU 110 N -0.01 1.36 -0.34 5.12 2.12 -0.07 -4.99 118.70 121.89 2nwi s GLU 110 Ca -0.02 -1.68 -0.29 0.00 0.36 0.00 0.00 54.97 53.34 2nwi s GLU 110 Cb -0.14 -2.94 0.00 0.00 0.26 0.00 0.00 34.13 31.31 2nwi s GLU 110 CO 0.04 -0.93 1.43 0.42 -0.54 0.00 0.00 175.26 175.68 2nwi s ILE 111 N 1.06 3.93 0.05 -3.70 -1.09 -1.26 -1.45 121.20 118.74 2nwi s ILE 111 Ca 0.10 1.00 -0.15 0.00 -2.23 0.00 0.00 60.65 59.36 2nwi s ILE 111 Cb -0.19 -4.09 -0.31 0.00 -1.58 0.00 0.00 42.46 36.29 2nwi s ILE 111 CO -0.11 -0.58 1.07 0.03 -1.23 0.00 0.00 174.94 174.12 2nwi h ARG 112 N 10.36 0.60 -2.36 2.79 3.08 -0.88 -3.49 114.38 124.49 2nwi h ARG 112 Ca -0.28 -0.87 0.12 0.00 0.07 0.00 0.00 59.98 59.02 2nwi h ARG 112 Cb 1.11 0.30 -0.13 0.00 0.08 0.00 0.00 29.97 31.33 2nwi h ARG 112 CO 1.05 1.40 0.47 1.67 -1.07 0.00 0.00 179.97 183.50 2nwi s TRP 113 N -2.85 -0.30 -0.02 3.04 1.48 -1.13 -5.00 118.94 114.16 2nwi s TRP 113 Ca -0.09 0.11 -0.14 0.00 -1.06 0.00 0.00 56.10 54.92 2nwi s TRP 113 Cb 0.05 0.57 0.02 0.00 -1.16 0.00 0.00 33.47 32.95 2nwi s TRP 113 CO 0.94 -0.65 0.30 -1.54 -4.06 0.00 0.00 176.95 171.94 2nwi s SER 114 N -2.63 -0.19 0.05 -2.66 1.04 -1.26 -1.51 113.70 106.55 2nwi s SER 114 Ca 0.07 0.12 -0.27 0.00 0.48 0.00 0.00 55.95 56.35 2nwi s SER 114 Cb -0.01 0.34 0.07 0.00 0.10 0.00 0.00 66.02 66.52 2nwi s SER 114 CO -0.06 -0.41 0.63 0.00 0.98 0.00 0.00 173.24 174.38 2nwi s ARG 115 N -1.19 1.16 -0.11 4.02 1.70 0.52 -4.98 118.95 120.07 2nwi s ARG 115 Ca -0.12 -0.11 -0.10 0.00 -0.47 0.00 0.00 55.73 54.93 2nwi s ARG 115 Cb -0.05 0.54 -0.05 0.00 -0.57 0.00 0.00 34.95 34.83 2nwi s ARG 115 CO 0.04 -0.44 0.21 0.08 -1.08 0.00 0.00 175.30 174.11 2nwi s VAL 116 N -2.46 5.37 0.19 4.99 1.01 -1.26 -0.90 120.40 127.34 2nwi s VAL 116 Ca -0.05 0.37 -0.22 0.00 0.00 0.00 0.00 61.98 62.08 2nwi s VAL 116 Cb -0.01 -3.50 0.05 0.00 0.00 0.00 0.00 36.38 32.93 2nwi s VAL 116 CO -0.01 0.55 0.62 -1.83 0.00 0.00 0.00 175.10 174.43 2nwi s GLU 117 N -0.63 1.41 -0.25 2.72 -1.05 -0.41 -4.98 118.70 115.50 2nwi s GLU 117 Ca 0.16 -0.63 -0.21 0.00 -0.15 0.00 0.00 54.97 54.14 2nwi s GLU 117 Cb -0.13 0.59 -0.02 0.00 -0.44 0.00 0.00 34.13 34.13 2nwi s GLU 117 CO 0.05 -0.62 0.65 -2.00 0.95 0.00 0.00 175.26 174.29 2nwi s GLU 118 N -3.80 4.12 0.00 -4.83 2.12 -1.26 -0.96 118.70 114.09 2nwi s GLU 118 Ca 0.04 0.59 0.00 0.00 0.36 0.00 0.00 54.97 55.96 2nwi s GLU 118 Cb -0.02 -3.65 0.00 0.00 0.26 0.00 0.00 34.13 30.72 2nwi s GLU 118 CO -0.07 -0.42 0.00 0.00 -0.54 0.00 0.00 175.26 174.23 2nwi n ALA 119 N 5.73 -0.75 -1.46 6.30 0.00 -1.26 -5.04 120.51 124.03 2nwi n ALA 119 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 2nwi n ALA 119 Cb 0.49 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2nwi n ALA 119 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2nwi n ASP 120 N -1.20 -0.67 0.13 0.00 5.75 -1.26 -4.62 116.55 114.68 2nwi n ASP 120 Ca 0.00 0.96 0.14 0.00 -0.01 0.00 0.00 54.79 55.88 2nwi n ASP 120 Cb 0.45 -1.12 0.66 0.00 -1.03 0.00 0.00 41.12 40.09 2nwi n ASP 120 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2nwi h LEU 121 N 0.96 0.00 0.55 -2.12 5.85 -1.98 0.22 115.31 118.80 2nwi h LEU 121 Ca -0.39 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 2nwi h LEU 121 Cb 1.40 -0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.43 2nwi h LEU 121 CO 0.53 0.00 -0.27 0.00 -0.34 0.00 0.00 178.44 178.37 2nwi h ALA 122 N 1.86 -0.74 -0.71 1.25 0.00 -2.00 -1.64 119.26 117.28 2nwi h ALA 122 Ca 0.13 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.89 2nwi h ALA 122 Cb 0.51 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 2nwi h ALA 122 CO -0.00 -0.87 0.44 1.25 0.00 0.00 0.00 179.25 180.07 2nwi h LEU 123 N -0.83 0.71 -0.53 0.00 5.85 -1.62 -0.04 115.31 118.85 2nwi h LEU 123 Ca -0.08 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.72 2nwi h LEU 123 Cb 0.61 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.43 2nwi h LEU 123 CO 0.12 0.49 0.22 0.00 -0.34 0.00 0.00 178.44 178.93 2nwi h ALA 124 N 1.32 0.67 -0.17 1.25 0.00 -0.91 -0.17 119.26 121.25 2nwi h ALA 124 Ca 0.29 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.14 2nwi h ALA 124 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2nwi h ALA 124 CO -0.12 -0.16 -0.35 0.87 0.00 0.00 0.00 179.25 179.49 2nwi h LYS 125 N 0.42 0.53 -0.18 0.00 1.57 -0.90 -2.40 116.57 115.61 2nwi h LYS 125 Ca 0.25 -0.35 0.05 0.00 -1.87 0.00 0.00 60.65 58.74 2nwi h LYS 125 Cb 0.24 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.53 2nwi h LYS 125 CO -0.23 0.96 -0.36 1.49 -0.57 0.00 0.00 179.45 180.74 2nwi h GLU 126 N 0.17 -0.39 0.00 3.15 4.81 -0.70 -2.32 114.58 119.30 2nwi h GLU 126 Ca 0.00 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2nwi h GLU 126 Cb 0.94 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 2nwi h GLU 126 CO 0.08 -0.26 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.00 2nwi h LEU 127 N -0.40 0.00 -1.36 1.64 3.38 -1.08 -3.47 115.31 114.01 2nwi h LEU 127 Ca 0.10 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 2nwi h LEU 127 Cb 0.57 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.38 2nwi h LEU 127 CO -0.40 0.03 -0.28 0.61 0.09 0.00 0.00 178.44 178.48 2nwi n GLY 128 N -0.29 0.26 3.62 0.83 0.00 -0.88 -4.87 105.19 103.86 2nwi n GLY 128 Ca -0.01 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 2nwi n GLY 128 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2nwi s ILE 129 N -3.13 3.59 -0.17 -0.61 -4.36 -1.03 -5.05 121.20 110.43 2nwi s ILE 129 Ca 0.13 -1.26 -0.15 0.00 -0.26 0.00 0.00 60.65 59.11 2nwi s ILE 129 Cb -0.06 -2.72 -0.10 0.00 1.25 0.00 0.00 42.46 40.83 2nwi s ILE 129 CO 0.29 0.06 -0.00 0.00 0.24 0.00 0.00 174.94 175.52 2nwi n ALA 130 N 0.47 0.61 -2.28 2.27 0.00 -1.26 -4.76 120.51 115.56 2nwi n ALA 130 Ca -0.12 -0.46 -0.43 0.00 0.00 0.00 0.00 53.44 52.43 2nwi n ALA 130 Cb 0.53 -0.25 -0.02 0.00 0.00 0.00 0.00 19.45 19.71 2nwi n ALA 130 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2nwi s ASP 131 N -6.26 6.37 0.00 0.00 2.15 -1.26 -4.91 116.67 112.76 2nwi s ASP 131 Ca -0.21 1.15 0.15 0.00 0.43 0.00 0.00 52.55 54.07 2nwi s ASP 131 Cb 0.04 -2.54 0.92 0.00 -0.30 0.00 0.00 42.92 41.05 2nwi s ASP 131 CO 0.39 -1.34 1.55 0.54 -0.17 0.00 0.00 175.17 176.14 2nwi n ARG 132 N 7.84 0.93 -2.38 4.34 1.74 -1.26 -4.67 116.66 123.21 2nwi n ARG 132 Ca 0.17 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.83 2nwi n ARG 132 Cb 0.47 -1.26 -0.03 0.00 -1.02 0.00 0.00 32.46 30.62 2nwi n ARG 132 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2nwi s ARG 133 N -2.00 4.39 0.08 5.56 0.52 -1.26 -4.42 118.95 121.82 2nwi s ARG 133 Ca 0.23 1.81 0.07 0.00 -0.52 0.00 0.00 55.73 57.33 2nwi s ARG 133 Cb 0.11 -3.39 -0.03 0.00 0.52 0.00 0.00 34.95 32.16 2nwi s ARG 133 CO 0.18 -0.34 -0.20 0.14 0.02 0.00 0.00 175.30 175.10 2nwi s VAL 134 N 1.36 1.62 -0.18 3.52 -7.23 -0.13 -1.60 120.40 117.77 2nwi s VAL 134 Ca 0.59 -1.37 -0.16 0.00 -1.81 0.00 0.00 61.98 59.24 2nwi s VAL 134 Cb -0.30 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.15 2nwi s VAL 134 CO 0.28 0.03 0.38 -0.63 -0.31 0.00 0.00 175.10 174.85 2nwi s ILE 135 N -1.02 5.23 0.10 -0.62 1.01 0.01 -1.29 121.20 124.62 2nwi s ILE 135 Ca 0.06 0.70 0.10 0.00 0.00 0.00 0.00 60.65 61.51 2nwi s ILE 135 Cb -0.09 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 2nwi s ILE 135 CO 0.03 0.30 -0.25 -0.94 0.00 0.00 0.00 174.94 174.08 2nwi s SER 136 N 0.82 3.39 0.13 3.58 1.04 -0.08 -0.12 113.70 122.46 2nwi s SER 136 Ca 0.19 -0.67 -0.05 0.00 0.48 0.00 0.00 55.95 55.91 2nwi s SER 136 Cb -0.14 -0.31 -0.02 0.00 0.10 0.00 0.00 66.02 65.65 2nwi s SER 136 CO 0.07 0.20 0.15 0.00 0.98 0.00 0.00 173.24 174.64 2nwi s ARG 137 N -1.83 0.97 -0.02 4.02 1.70 -0.85 -0.35 118.95 122.58 2nwi s ARG 137 Ca 0.14 -1.27 0.01 0.00 -0.47 0.00 0.00 55.73 54.14 2nwi s ARG 137 Cb -0.10 0.30 0.02 0.00 -0.57 0.00 0.00 34.95 34.60 2nwi s ARG 137 CO 0.06 -0.31 -0.01 1.21 -1.08 0.00 0.00 175.30 175.17 2nwi s ASN 138 N -2.99 0.36 0.02 -2.89 3.84 -0.57 -1.15 114.94 111.56 2nwi s ASN 138 Ca 0.18 -0.03 -0.09 0.00 0.21 0.00 0.00 52.86 53.13 2nwi s ASN 138 Cb 0.06 -0.15 0.00 0.00 -0.55 0.00 0.00 41.25 40.61 2nwi s ASN 138 CO -0.01 -0.05 0.17 -0.72 -2.79 0.00 0.00 177.10 173.69 2nwi s TYR 139 N 0.64 0.04 0.03 0.43 1.13 -0.26 -0.10 117.35 119.25 2nwi s TYR 139 Ca -0.06 -0.17 -0.08 0.00 -1.41 0.00 0.00 57.07 55.35 2nwi s TYR 139 Cb -0.09 -0.03 -0.05 0.00 -1.10 0.00 0.00 41.96 40.68 2nwi s TYR 139 CO -0.01 -0.35 0.31 -0.80 -2.51 0.00 0.00 175.55 172.19 2nwi s ASN 140 N -1.69 6.55 -0.25 -0.18 0.01 -0.53 -0.50 114.94 118.36 2nwi s ASN 140 Ca -0.10 0.65 -0.09 0.00 -0.71 0.00 0.00 52.86 52.61 2nwi s ASN 140 Cb -0.05 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.45 2nwi s ASN 140 CO -0.00 0.24 0.11 -0.63 -1.51 0.00 0.00 177.10 175.30 2nwi s ILE 141 N -1.31 4.72 -0.20 0.60 1.01 0.63 -0.89 121.20 125.76 2nwi s ILE 141 Ca 0.29 -0.04 -0.05 0.00 0.00 0.00 0.00 60.65 60.85 2nwi s ILE 141 Cb -0.14 -3.21 -0.02 0.00 0.01 0.00 0.00 42.46 39.10 2nwi s ILE 141 CO 0.16 0.32 0.00 -0.63 0.00 0.00 0.00 174.94 174.80 2nwi s ILE 142 N 1.50 3.95 -0.03 2.92 -1.09 0.85 0.56 121.20 129.87 2nwi s ILE 142 Ca 0.06 -0.31 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 2nwi s ILE 142 Cb -0.15 -2.79 0.02 0.00 -1.58 0.00 0.00 42.46 37.96 2nwi s ILE 142 CO 0.06 0.43 -0.03 -2.28 -1.23 0.00 0.00 174.94 171.89 2nwi s HIS 143 N 1.00 0.48 -1.63 3.97 5.65 0.26 -1.37 115.29 123.64 2nwi s HIS 143 Ca 0.02 -0.09 -0.16 0.00 0.25 0.00 0.00 55.06 55.08 2nwi s HIS 143 Cb -0.14 -0.44 0.13 0.00 -1.18 0.00 0.00 32.58 30.94 2nwi s HIS 143 CO 0.02 -0.11 0.85 0.54 -0.65 0.00 0.00 174.74 175.39 2nwi n ARG 144 N 3.72 -4.08 -0.90 2.88 1.74 -1.26 -1.70 116.66 117.06 2nwi n ARG 144 Ca -0.22 0.46 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 2nwi n ARG 144 Cb 0.53 -5.23 0.00 0.00 -1.02 0.00 0.00 32.46 26.74 2nwi n ARG 144 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nwi n GLY 145 N -1.53 0.70 3.35 -0.13 0.00 -1.26 -5.00 105.19 101.32 2nwi n GLY 145 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 2nwi n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nwi s LYS 146 N -0.28 1.32 -0.00 1.61 -0.14 -0.69 -5.10 119.74 116.46 2nwi s LYS 146 Ca 0.00 -1.51 -0.33 0.00 -1.36 0.00 0.00 55.97 52.78 2nwi s LYS 146 Cb 0.00 -1.27 -0.11 0.00 -1.68 0.00 0.00 37.83 34.77 2nwi s LYS 146 CO 0.00 0.24 1.88 0.28 -0.76 0.00 0.00 175.35 176.99 2nwi n VAL 147 N -0.05 0.57 -0.10 3.17 0.31 -1.26 -0.57 118.33 120.40 2nwi n VAL 147 Ca -0.10 -0.10 -0.24 0.00 -0.01 0.00 0.00 64.34 63.89 2nwi n VAL 147 Cb 0.59 -2.02 -0.12 0.00 -0.91 0.00 0.00 33.84 31.38 2nwi n VAL 147 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2nwi n LEU 148 N 6.55 2.08 -3.82 7.52 7.94 0.19 -4.85 117.00 132.62 2nwi n LEU 148 Ca 0.21 0.33 -0.13 0.00 -1.11 0.00 0.00 56.01 55.31 2nwi n LEU 148 Cb 0.34 -0.95 -0.14 0.00 0.53 0.00 0.00 43.42 43.20 2nwi n LEU 148 CO 0.70 0.49 -0.29 -0.63 -1.11 0.00 0.00 177.39 176.55 2nwi s ILE 149 N -2.44 -0.02 -0.21 1.96 1.01 -1.12 -3.90 121.20 116.48 2nwi s ILE 149 Ca -0.31 0.07 -0.08 0.00 0.00 0.00 0.00 60.65 60.32 2nwi s ILE 149 Cb 0.09 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.39 2nwi s ILE 149 CO 0.59 0.03 0.10 0.21 0.00 0.00 0.00 174.94 175.87 2nwi s ASN 150 N 0.40 5.72 -0.10 3.58 3.84 -0.52 -0.27 114.94 127.59 2nwi s ASN 150 Ca -0.03 0.05 0.03 0.00 0.21 0.00 0.00 52.86 53.12 2nwi s ASN 150 Cb -0.04 -2.01 0.00 0.00 -0.55 0.00 0.00 41.25 38.65 2nwi s ASN 150 CO -0.01 0.11 -0.21 -0.63 -2.79 0.00 0.00 177.10 173.56 2nwi s ILE 151 N 0.79 1.87 -0.18 -5.21 1.01 0.34 -0.97 121.20 118.86 2nwi s ILE 151 Ca 0.05 -0.90 -0.03 0.00 0.00 0.00 0.00 60.65 59.76 2nwi s ILE 151 Cb -0.13 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.69 2nwi s ILE 151 CO 0.02 0.52 -0.05 -0.89 0.00 0.00 0.00 174.94 174.54 2nwi s THR 152 N 0.47 3.63 0.05 2.92 2.01 0.78 -1.10 115.64 124.39 2nwi s THR 152 Ca -0.17 -0.44 0.09 0.00 0.31 0.00 0.00 61.69 61.49 2nwi s THR 152 Cb -0.17 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.70 2nwi s THR 152 CO 0.07 0.47 -0.25 -1.61 -0.69 0.00 0.00 174.62 172.60 2nwi s GLU 153 N 0.78 1.67 -0.12 4.92 2.02 -0.30 -0.21 118.70 127.45 2nwi s GLU 153 Ca -0.02 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 53.90 2nwi s GLU 153 Cb -0.15 -1.84 0.02 0.00 0.10 0.00 0.00 34.13 32.26 2nwi s GLU 153 CO 0.02 0.47 -0.12 -0.06 0.02 0.00 0.00 175.26 175.60 2nwi s PHE 154 N -0.82 1.80 -0.27 1.61 0.08 0.58 -2.00 117.98 118.97 2nwi s PHE 154 Ca 0.11 -0.92 -0.03 0.00 0.12 0.00 0.00 56.93 56.21 2nwi s PHE 154 Cb -0.10 -1.38 0.02 0.00 -0.57 0.00 0.00 43.02 41.00 2nwi s PHE 154 CO 0.02 -0.54 -0.02 -0.06 -0.10 0.00 0.00 175.22 174.52 2nwi s PHE 155 N 1.42 3.11 -0.19 0.36 0.08 0.83 -1.73 117.98 121.87 2nwi s PHE 155 Ca 0.01 -1.44 -0.29 0.00 0.12 0.00 0.00 56.93 55.33 2nwi s PHE 155 Cb -0.13 -2.12 -0.04 0.00 -0.57 0.00 0.00 43.02 40.16 2nwi s PHE 155 CO -0.07 -0.70 1.84 -1.25 -0.10 0.00 0.00 175.22 174.94 2nwi s PRO 156 N 1.36 3.65 0.28 0.24 0.04 -1.26 -0.81 135.00 138.50 2nwi s PRO 156 Ca 0.00 1.89 -0.01 0.00 0.04 0.00 0.00 61.00 62.92 2nwi s PRO 156 Cb -0.17 -4.15 0.45 0.00 0.04 0.00 0.00 34.50 30.67 2nwi s PRO 156 CO -0.02 -1.48 1.89 0.52 0.04 0.00 0.00 177.00 177.94 2nwi h MET 157 N 11.94 1.09 0.00 4.56 2.86 -1.61 -2.25 114.93 131.52 2nwi h MET 157 Ca -0.38 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.19 2nwi h MET 157 Cb 1.19 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 32.60 2nwi h MET 157 CO 0.98 0.72 0.00 1.05 1.06 0.00 0.00 176.91 180.73 2nwi h GLU 158 N 1.13 0.00 0.00 1.72 4.11 -1.83 -1.88 114.58 117.83 2nwi h GLU 158 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.86 2nwi h GLU 158 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2nwi h GLU 158 CO -0.17 0.00 0.00 0.54 0.07 0.00 0.00 179.01 179.45 2nwi n ARG 159 N -2.78 0.14 0.00 1.06 1.74 -0.85 -5.14 116.66 110.84 2nwi n ARG 159 Ca -0.00 0.12 0.02 0.00 -0.77 0.00 0.00 57.85 57.22 2nwi n ARG 159 Cb 0.18 -1.67 0.01 0.00 -1.02 0.00 0.00 32.46 29.97 2nwi n ARG 159 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30