#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh2 n LYS 2 N 0.00 0.00 -0.23 0.03 2.85 -1.26 -4.76 118.16 114.79 2wh2 n LYS 2 Ca 0.00 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2wh2 n LYS 2 Cb 0.00 -0.32 -0.00 0.00 -0.65 0.00 0.00 35.03 34.06 2wh2 n LYS 2 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2wh2 n GLU 3 N 1.57 0.00 -2.01 -1.58 0.00 -1.26 -4.47 120.64 112.89 2wh2 n GLU 3 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 57.16 56.78 2wh2 n GLU 3 Cb 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 31.44 31.43 2wh2 n GLU 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 2wh2 s VAL 4 N 0.00 3.35 0.28 3.84 -7.23 -1.26 -3.74 120.40 115.64 2wh2 s VAL 4 Ca 0.00 0.08 -0.05 0.00 -1.81 0.00 0.00 61.98 60.20 2wh2 s VAL 4 Cb 0.00 -3.90 0.06 0.00 0.56 0.00 0.00 36.38 33.11 2wh2 s VAL 4 CO 0.00 -0.87 0.34 0.00 -0.31 0.00 0.00 175.10 174.26 2wh2 n ALA 5 N 13.21 -0.52 -3.98 1.32 0.00 0.45 -4.87 120.51 126.13 2wh2 n ALA 5 Ca 0.25 -0.45 -0.30 0.00 0.00 0.00 0.00 53.44 52.93 2wh2 n ALA 5 Cb 0.51 -0.02 -0.16 0.00 0.00 0.00 0.00 19.45 19.78 2wh2 n ALA 5 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wh2 s VAL 6 N -1.72 1.61 0.84 0.00 1.01 -1.26 -2.98 120.40 117.91 2wh2 s VAL 6 Ca 0.20 -1.08 -0.12 0.00 0.00 0.00 0.00 61.98 60.97 2wh2 s VAL 6 Cb -0.01 -1.75 0.10 0.00 0.00 0.00 0.00 36.38 34.73 2wh2 s VAL 6 CO 0.14 0.08 1.19 0.00 0.00 0.00 0.00 175.10 176.51 2wh2 n TYR 7 N 4.68 1.16 -3.68 5.22 9.36 -1.17 -1.86 117.16 130.86 2wh2 n TYR 7 Ca -0.14 0.41 -0.30 0.00 3.32 0.00 0.00 57.90 61.19 2wh2 n TYR 7 Cb 0.46 -2.08 -0.14 0.00 -0.63 0.00 0.00 39.34 36.95 2wh2 n TYR 7 CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 2wh2 s GLN 8 N -4.27 0.75 0.00 2.98 2.00 -1.22 -4.30 119.66 115.61 2wh2 s GLN 8 Ca 0.72 -1.23 0.00 0.00 -2.00 0.00 0.00 55.36 52.84 2wh2 s GLN 8 Cb -0.27 -1.90 0.00 0.00 0.80 0.00 0.00 33.01 31.64 2wh2 s GLN 8 CO 0.53 -1.05 0.00 -0.89 -0.50 0.00 0.00 175.29 173.38 2wh2 n ILE 9 N 4.54 0.00 0.00 -2.34 5.41 -1.23 -3.45 119.36 122.29 2wh2 n ILE 9 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.76 2wh2 n ILE 9 Cb 0.40 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.33 2wh2 n ILE 9 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2wh2 n PRO 10 N 0.00 0.00 0.00 0.38 -0.04 -1.08 -4.10 135.00 130.16 2wh2 n PRO 10 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2wh2 n PRO 10 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2wh2 n PRO 10 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2wh2 n VAL 11 N 0.00 0.00 0.30 0.52 0.31 -1.26 -4.39 118.33 113.81 2wh2 n VAL 11 Ca 0.00 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.51 2wh2 n VAL 11 Cb 0.00 0.00 0.80 0.00 -0.91 0.00 0.00 33.84 33.73 2wh2 n VAL 11 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2wh2 h LEU 12 N 0.00 0.00 -9.36 7.52 3.38 -2.02 -3.44 115.31 111.39 2wh2 h LEU 12 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 2wh2 h LEU 12 Cb 0.00 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.79 2wh2 h LEU 12 CO 0.00 0.00 0.84 -1.20 0.09 0.00 0.00 178.44 178.17 2wh2 n SER 13 N -3.02 2.87 -3.14 -0.43 7.64 -1.26 -4.98 113.62 111.30 2wh2 n SER 13 Ca -0.00 1.06 -0.18 0.00 1.01 0.00 0.00 58.87 60.75 2wh2 n SER 13 Cb 0.24 -1.34 0.16 0.00 -1.01 0.00 0.00 64.21 62.26 2wh2 n SER 13 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2wh2 n PRO 14 N 4.41 -2.74 -2.69 1.43 -0.02 -1.26 -2.63 135.00 131.51 2wh2 n PRO 14 Ca 0.20 -1.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.26 2wh2 n PRO 14 Cb 0.26 -1.03 -0.03 0.00 -0.02 0.00 0.00 33.50 32.67 2wh2 n PRO 14 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2wh2 s SER 15 N -3.10 6.48 0.00 2.55 1.04 -1.26 -3.49 113.70 115.92 2wh2 s SER 15 Ca 0.42 -1.50 0.00 0.00 0.48 0.00 0.00 55.95 55.35 2wh2 s SER 15 Cb -0.05 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.56 2wh2 s SER 15 CO 0.33 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 173.76 2wh2 n GLY 16 N 6.24 -2.05 3.36 7.32 0.00 -1.26 -4.76 105.19 114.04 2wh2 n GLY 16 Ca 0.25 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 2wh2 n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wh2 s ARG 17 N 0.00 1.04 0.22 1.61 0.52 -1.26 -3.05 118.95 118.02 2wh2 s ARG 17 Ca 0.00 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 54.83 2wh2 s ARG 17 Cb 0.00 0.47 0.00 0.00 0.52 0.00 0.00 34.95 35.94 2wh2 s ARG 17 CO 0.00 -0.39 0.28 -2.13 0.02 0.00 0.00 175.30 173.08 2wh2 n ARG 18 N 0.22 0.41 -3.31 3.54 0.63 -1.16 -4.73 116.66 112.26 2wh2 n ARG 18 Ca -0.18 -1.82 0.03 0.00 -0.92 0.00 0.00 57.85 54.96 2wh2 n ARG 18 Cb 0.61 1.70 0.01 0.00 0.45 0.00 0.00 32.46 35.23 2wh2 n ARG 18 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 2wh2 n GLU 19 N -0.37 0.04 0.00 -0.14 0.00 -1.26 0.17 120.64 119.09 2wh2 n GLU 19 Ca 0.01 -0.40 0.00 0.00 0.00 0.00 0.00 57.16 56.78 2wh2 n GLU 19 Cb 0.37 0.73 0.00 0.00 0.00 0.00 0.00 31.44 32.54 2wh2 n GLU 19 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 2wh2 n LEU 20 N 0.00 0.00 0.00 -1.84 7.94 -1.25 -4.95 117.00 116.90 2wh2 n LEU 20 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 2wh2 n LEU 20 Cb 0.38 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.33 2wh2 n LEU 20 CO 0.09 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.37 2wh2 n ALA 21 N -1.07 0.00 0.10 1.96 0.00 -1.26 -4.96 120.51 115.28 2wh2 n ALA 21 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wh2 n ALA 21 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wh2 n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wh2 n ALA 22 N -3.00 1.32 -1.36 0.00 0.00 -1.26 -2.16 120.51 114.05 2wh2 n ALA 22 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2wh2 n ALA 22 Cb 0.00 -1.00 0.20 0.00 0.00 0.00 0.00 19.45 18.65 2wh2 n ALA 22 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2wh2 n ASP 23 N 0.63 2.96 0.00 0.00 5.75 -1.26 -4.43 116.55 120.20 2wh2 n ASP 23 Ca 0.00 -3.69 0.00 0.00 -0.01 0.00 0.00 54.79 51.09 2wh2 n ASP 23 Cb 0.04 -0.70 0.00 0.00 -1.03 0.00 0.00 41.12 39.43 2wh2 n ASP 23 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2wh2 n LEU 24 N -1.08 0.00 -0.48 -2.12 7.99 -0.92 -2.89 117.00 117.50 2wh2 n LEU 24 Ca 0.41 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.41 2wh2 n LEU 24 Cb 1.23 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 44.54 2wh2 n LEU 24 CO 0.32 0.00 0.08 -2.65 -1.51 0.00 0.00 177.39 173.63 2wh2 n PRO 25 N 0.00 0.31 0.00 3.23 -0.02 -1.26 -4.15 135.00 133.10 2wh2 n PRO 25 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2wh2 n PRO 25 Cb 0.00 -1.15 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 2wh2 n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wh2 n ALA 26 N 0.32 0.00 -3.05 3.55 0.00 -1.26 -4.39 120.51 115.67 2wh2 n ALA 26 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 2wh2 n ALA 26 Cb 0.07 0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2wh2 n ALA 26 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2wh2 s GLU 27 N -2.36 0.23 -0.41 0.00 2.02 -1.26 -5.08 118.70 111.85 2wh2 s GLU 27 Ca 0.00 0.10 -0.24 0.00 0.02 0.00 0.00 54.97 54.85 2wh2 s GLU 27 Cb 0.00 0.07 0.02 0.00 0.10 0.00 0.00 34.13 34.32 2wh2 s GLU 27 CO 0.00 -0.39 0.82 0.42 0.02 0.00 0.00 175.26 176.14 2wh2 s ILE 28 N 2.61 4.64 -0.77 -1.63 -1.09 -1.26 -5.00 121.20 118.70 2wh2 s ILE 28 Ca 0.22 0.76 -0.12 0.00 -2.23 0.00 0.00 60.65 59.28 2wh2 s ILE 28 Cb -0.01 -4.30 0.20 0.00 -1.58 0.00 0.00 42.46 36.77 2wh2 s ILE 28 CO -0.20 -0.60 0.69 0.21 -1.23 0.00 0.00 174.94 173.81 2wh2 s ASN 29 N 2.01 6.45 0.29 3.58 2.47 -1.26 -4.97 114.94 123.51 2wh2 s ASN 29 Ca 0.33 -2.67 -0.02 0.00 0.42 0.00 0.00 52.86 50.91 2wh2 s ASN 29 Cb -0.12 -2.14 0.62 0.00 -1.45 0.00 0.00 41.25 38.15 2wh2 s ASN 29 CO 0.20 -0.55 1.54 -2.65 -3.72 0.00 0.00 177.10 171.92 2wh2 n PRO 30 N 3.96 -0.08 -0.29 0.43 -0.02 -1.26 -0.66 135.00 137.08 2wh2 n PRO 30 Ca 0.11 1.50 0.06 0.00 -2.02 0.00 0.00 63.50 63.15 2wh2 n PRO 30 Cb 0.45 -2.32 0.20 0.00 -0.02 0.00 0.00 33.50 31.81 2wh2 n PRO 30 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2wh2 h HIS 31 N 0.00 0.75 -0.30 6.00 -0.00 -1.99 0.33 115.15 119.94 2wh2 h HIS 31 Ca 0.54 0.03 -0.09 0.00 -0.00 0.00 0.00 60.37 60.85 2wh2 h HIS 31 Cb 1.00 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 28.18 2wh2 h HIS 31 CO -0.62 0.21 -0.20 1.25 -0.00 0.00 0.00 177.93 178.58 2wh2 h LEU 32 N 0.64 0.56 -0.37 0.26 5.85 -1.32 0.12 115.31 121.04 2wh2 h LEU 32 Ca 0.43 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 2wh2 h LEU 32 Cb 0.57 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2wh2 h LEU 32 CO -0.33 0.76 0.15 -0.07 -0.34 0.00 0.00 178.44 178.61 2wh2 h LEU 33 N 0.50 0.51 0.23 2.25 -0.00 -0.74 -2.69 115.31 115.37 2wh2 h LEU 33 Ca 0.08 -0.16 0.01 0.00 -0.00 0.00 0.00 57.88 57.81 2wh2 h LEU 33 Cb 0.62 -0.13 -0.03 0.00 -0.00 0.00 0.00 40.66 41.12 2wh2 h LEU 33 CO 0.04 0.53 -0.30 -0.25 -0.00 0.00 0.00 178.44 178.46 2wh2 h TRP 34 N 0.46 -0.82 -1.07 1.13 7.01 0.20 -1.99 115.95 120.87 2wh2 h TRP 34 Ca 0.12 0.01 0.29 0.00 2.11 0.00 0.00 58.89 61.42 2wh2 h TRP 34 Cb 0.18 0.33 -0.09 0.00 -2.10 0.00 0.00 29.16 27.47 2wh2 h TRP 34 CO -0.00 -0.42 0.69 0.93 -2.79 0.00 0.00 178.44 176.85 2wh2 h GLU 35 N -0.59 0.33 -0.03 2.65 5.08 -0.66 0.35 114.58 121.70 2wh2 h GLU 35 Ca 0.00 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 2wh2 h GLU 35 Cb 0.57 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.75 2wh2 h GLU 35 CO -0.10 0.22 -0.47 0.28 -1.00 0.00 0.00 179.01 177.93 2wh2 h VAL 36 N 0.34 1.43 -0.01 3.13 2.07 -1.11 -2.04 116.25 120.06 2wh2 h VAL 36 Ca 0.61 -1.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.19 2wh2 h VAL 36 Cb 1.65 2.49 -0.00 0.00 -1.52 0.00 0.00 31.29 33.91 2wh2 h VAL 36 CO -0.29 0.56 0.01 0.58 0.02 0.00 0.00 177.57 178.45 2wh2 h VAL 37 N -0.13 1.13 -0.98 2.57 2.07 -0.47 0.16 116.25 120.60 2wh2 h VAL 37 Ca -0.05 -0.39 0.24 0.00 0.82 0.00 0.00 66.70 67.32 2wh2 h VAL 37 Cb 1.17 1.38 -0.13 0.00 -1.52 0.00 0.00 31.29 32.19 2wh2 h VAL 37 CO 0.10 0.10 0.54 -0.09 0.02 0.00 0.00 177.57 178.24 2wh2 h ARG 38 N -0.14 0.51 -0.00 1.57 2.43 -0.42 0.34 114.38 118.68 2wh2 h ARG 38 Ca 0.00 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 58.98 2wh2 h ARG 38 Cb 0.17 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 2wh2 h ARG 38 CO -0.00 0.34 -0.79 2.35 -1.51 0.00 0.00 179.97 180.36 2wh2 h TRP 39 N 0.53 0.03 0.24 2.20 7.01 -0.78 -1.18 115.95 123.99 2wh2 h TRP 39 Ca 0.63 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.60 2wh2 h TRP 39 Cb 1.19 -0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 2wh2 h TRP 39 CO -0.04 0.80 -0.11 1.96 -2.79 0.00 0.00 178.44 178.25 2wh2 h GLN 40 N 0.01 -0.31 -0.01 2.65 4.20 0.25 -2.23 115.11 119.68 2wh2 h GLN 40 Ca -0.01 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2wh2 h GLN 40 Cb 1.39 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 29.24 2wh2 h GLN 40 CO 0.10 -0.20 0.23 -0.07 -0.67 0.00 0.00 178.83 178.22 2wh2 h LEU 41 N -0.69 0.00 0.32 1.46 3.38 -1.01 -2.25 115.31 116.51 2wh2 h LEU 41 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2wh2 h LEU 41 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2wh2 h LEU 41 CO 0.05 0.00 -0.15 0.00 0.09 0.00 0.00 178.44 178.43 2wh2 h ALA 42 N 1.54 -0.78 -0.76 1.53 0.00 -1.11 -3.34 119.26 116.35 2wh2 h ALA 42 Ca 0.01 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2wh2 h ALA 42 Cb 0.47 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2wh2 h ALA 42 CO -0.00 -0.75 0.36 1.57 0.00 0.00 0.00 179.25 180.43 2wh2 h LYS 43 N -0.59 1.09 0.00 0.00 2.10 -0.88 -2.86 116.57 115.44 2wh2 h LYS 43 Ca -0.04 -0.16 0.00 0.00 -2.00 0.00 0.00 60.65 58.45 2wh2 h LYS 43 Cb 0.33 -0.20 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 2wh2 h LYS 43 CO 0.07 0.85 0.02 2.89 -2.00 0.00 0.00 179.45 181.27 2wh2 n ARG 44 N -4.32 0.01 -2.06 0.07 1.85 -0.89 -4.60 116.66 106.71 2wh2 n ARG 44 Ca 0.07 0.49 -0.36 0.00 -1.00 0.00 0.00 57.85 57.05 2wh2 n ARG 44 Cb 0.14 -1.53 0.02 0.00 -1.05 0.00 0.00 32.46 30.04 2wh2 n ARG 44 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 2wh2 s ARG 45 N -2.99 3.14 -0.21 2.89 3.52 -1.08 -5.04 118.95 119.18 2wh2 s ARG 45 Ca -0.00 1.82 -0.04 0.00 -0.13 0.00 0.00 55.73 57.38 2wh2 s ARG 45 Cb 0.00 -2.02 -0.02 0.00 -1.56 0.00 0.00 34.95 31.35 2wh2 s ARG 45 CO 0.01 -1.07 -0.03 1.03 -0.81 0.00 0.00 175.30 174.43 2wh2 s ARG 46 N -3.21 3.49 -1.04 5.12 0.52 -1.26 -4.83 118.95 117.73 2wh2 s ARG 46 Ca 0.75 -0.58 -0.12 0.00 -0.52 0.00 0.00 55.73 55.26 2wh2 s ARG 46 Cb -0.30 -3.03 0.23 0.00 0.52 0.00 0.00 34.95 32.38 2wh2 s ARG 46 CO 0.33 -0.09 1.07 0.20 0.02 0.00 0.00 175.30 176.84 2wh2 s GLY 47 N 1.22 2.86 0.00 -3.53 0.00 -1.25 -4.68 107.32 101.93 2wh2 s GLY 47 Ca 0.03 -3.55 0.04 0.00 0.00 0.00 0.00 44.72 41.24 2wh2 s GLY 47 CO -0.00 1.48 1.04 -1.30 0.00 0.00 0.00 173.10 174.31 2wh2 n THR 48 N 3.55 0.88 -2.32 0.90 -2.24 -1.26 -3.40 114.28 110.38 2wh2 n THR 48 Ca 0.23 -0.94 -0.42 0.00 -2.27 0.00 0.00 64.05 60.66 2wh2 n THR 48 Cb 0.43 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 2wh2 n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wh2 s ALA 49 N -0.92 2.85 0.03 6.98 0.00 -1.26 -4.83 121.76 124.60 2wh2 s ALA 49 Ca 0.08 -0.42 0.04 0.00 0.00 0.00 0.00 51.96 51.66 2wh2 s ALA 49 Cb 0.04 -4.06 -0.02 0.00 0.00 0.00 0.00 23.12 19.09 2wh2 s ALA 49 CO 0.06 -2.80 -0.12 0.45 0.00 0.00 0.00 175.76 173.35 2wh2 s SER 50 N 4.68 1.43 0.38 0.00 0.15 -1.26 -2.55 113.70 116.53 2wh2 s SER 50 Ca 0.59 -0.39 0.05 0.00 0.70 0.00 0.00 55.95 56.90 2wh2 s SER 50 Cb -0.13 -0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 64.07 2wh2 s SER 50 CO 0.28 0.03 0.17 0.35 1.20 0.00 0.00 173.24 175.27 2wh2 n THR 51 N 2.13 0.00 -4.82 6.45 -2.24 -0.18 -4.94 114.28 110.68 2wh2 n THR 51 Ca -0.17 -2.32 -0.33 0.00 -2.27 0.00 0.00 64.05 58.96 2wh2 n THR 51 Cb 0.55 0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 69.54 2wh2 n THR 51 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wh2 s LYS 52 N -3.47 3.13 0.66 -0.78 1.02 -1.26 -4.91 119.74 114.13 2wh2 s LYS 52 Ca 0.24 -0.69 -0.10 0.00 0.02 0.00 0.00 55.97 55.44 2wh2 s LYS 52 Cb 0.01 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.78 2wh2 s LYS 52 CO 0.17 0.33 1.04 -0.08 -0.92 0.00 0.00 175.35 175.89 2wh2 s THR 53 N 0.05 3.71 -1.66 2.17 -1.32 -1.26 -0.59 115.64 116.74 2wh2 s THR 53 Ca -0.05 0.42 0.00 0.00 -1.21 0.00 0.00 61.69 60.85 2wh2 s THR 53 Cb -0.14 -3.53 0.00 0.00 -1.51 0.00 0.00 72.50 67.31 2wh2 s THR 53 CO 0.04 -0.67 0.57 -2.11 -2.21 0.00 0.00 174.62 170.25 2wh2 n ARG 54 N -2.87 0.00 -0.08 7.08 1.85 -1.26 -1.40 116.66 119.98 2wh2 n ARG 54 Ca 0.06 0.10 -0.21 0.00 -1.00 0.00 0.00 57.85 56.80 2wh2 n ARG 54 Cb 0.57 -1.51 -0.12 0.00 -1.05 0.00 0.00 32.46 30.35 2wh2 n ARG 54 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2wh2 h GLY 55 N 0.00 0.07 1.17 2.89 0.00 -1.88 -3.37 103.07 101.95 2wh2 h GLY 55 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2wh2 h GLY 55 CO 0.00 0.16 -0.16 1.18 0.00 0.00 0.00 176.54 177.72 2wh2 n GLU 56 N -4.27 0.41 -1.96 4.80 4.71 -0.50 -4.82 120.64 119.01 2wh2 n GLU 56 Ca -0.30 -0.14 -0.40 0.00 -0.01 0.00 0.00 57.16 56.32 2wh2 n GLU 56 Cb 0.74 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.67 2wh2 n GLU 56 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2wh2 s VAL 57 N -2.69 2.41 -1.26 2.62 0.11 -0.58 -4.89 120.40 116.13 2wh2 s VAL 57 Ca 0.22 0.38 -0.05 0.00 -2.93 0.00 0.00 61.98 59.60 2wh2 s VAL 57 Cb 0.19 -3.22 0.12 0.00 -1.53 0.00 0.00 36.38 31.94 2wh2 s VAL 57 CO 0.53 0.06 2.40 0.00 -3.33 0.00 0.00 175.10 174.76 2wh2 n ALA 58 N 0.09 6.78 -2.68 1.54 0.00 -1.26 -4.95 120.51 120.03 2wh2 n ALA 58 Ca 0.04 -4.02 -0.32 0.00 0.00 0.00 0.00 53.44 49.14 2wh2 n ALA 58 Cb 0.43 -2.72 -0.05 0.00 0.00 0.00 0.00 19.45 17.10 2wh2 n ALA 58 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2wh2 s TYR 59 N -1.25 1.72 0.87 0.00 1.51 -1.26 -5.14 117.35 113.79 2wh2 s TYR 59 Ca 0.54 -0.96 -0.14 0.00 -1.01 0.00 0.00 57.07 55.50 2wh2 s TYR 59 Cb 0.20 -1.67 0.20 0.00 -0.11 0.00 0.00 41.96 40.58 2wh2 s TYR 59 CO -0.10 0.02 1.18 0.45 -1.11 0.00 0.00 175.55 175.98 2wh2 n SER 60 N -1.43 0.12 -0.05 2.29 2.88 -1.26 -5.00 113.62 111.17 2wh2 n SER 60 Ca -0.16 -1.44 0.07 0.00 -1.33 0.00 0.00 58.87 56.01 2wh2 n SER 60 Cb 0.66 -0.90 -0.07 0.00 -0.75 0.00 0.00 64.21 63.15 2wh2 n SER 60 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wh2 n GLY 61 N -2.73 -0.36 3.49 0.46 0.00 -1.26 -4.68 105.19 100.12 2wh2 n GLY 61 Ca 0.15 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 2wh2 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wh2 n ARG 62 N -1.18 0.76 -2.81 1.61 1.74 -1.26 -4.49 116.66 111.03 2wh2 n ARG 62 Ca 0.03 0.27 -0.43 0.00 -0.77 0.00 0.00 57.85 56.96 2wh2 n ARG 62 Cb 0.25 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 30.04 2wh2 n ARG 62 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2wh2 s LYS 63 N -1.63 3.25 0.32 5.56 2.20 -1.26 -3.60 119.74 124.58 2wh2 s LYS 63 Ca 0.63 -0.43 0.12 0.00 -0.36 0.00 0.00 55.97 55.92 2wh2 s LYS 63 Cb -0.63 -4.12 1.02 0.00 -1.51 0.00 0.00 37.83 32.59 2wh2 s LYS 63 CO 0.58 -1.66 1.46 1.51 -0.36 0.00 0.00 175.35 176.87 2wh2 n ILE 64 N 6.14 -0.39 -3.43 5.43 3.06 -0.34 -4.66 119.36 125.16 2wh2 n ILE 64 Ca 0.00 1.95 0.00 0.00 -2.50 0.00 0.00 62.75 62.20 2wh2 n ILE 64 Cb 0.47 -3.03 0.00 0.00 0.54 0.00 0.00 39.64 37.62 2wh2 n ILE 64 CO 0.00 0.00 0.00 0.79 -2.50 0.00 0.00 176.55 174.84 2wh2 n TRP 65 N -5.21 0.00 1.20 9.51 8.01 -1.26 -5.06 117.44 124.63 2wh2 n TRP 65 Ca 0.29 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.61 2wh2 n TRP 65 Cb 0.99 0.00 0.27 0.00 -2.01 0.00 0.00 31.31 30.56 2wh2 n TRP 65 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.69 174.38 2wh2 n PRO 66 N 0.00 1.97 -0.84 -0.99 -0.02 -1.26 -4.93 135.00 128.93 2wh2 n PRO 66 Ca 0.00 -1.47 0.00 0.00 -2.02 0.00 0.00 63.50 60.01 2wh2 n PRO 66 Cb 0.00 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2wh2 n PRO 66 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2wh2 n GLN 67 N 0.77 0.00 -3.64 -0.52 -0.06 -1.26 -4.95 117.38 107.71 2wh2 n GLN 67 Ca 0.16 0.00 -0.08 0.00 -2.00 0.00 0.00 57.00 55.08 2wh2 n GLN 67 Cb 0.49 -2.79 -0.07 0.00 -4.06 0.00 0.00 30.24 23.81 2wh2 n GLN 67 CO 0.00 0.00 0.00 0.21 -0.20 0.00 0.00 177.06 177.07 2wh2 s LYS 68 N -0.17 0.52 -0.76 3.69 2.20 -1.26 -4.90 119.74 119.06 2wh2 s LYS 68 Ca 0.00 0.69 -0.01 0.00 -0.36 0.00 0.00 55.97 56.29 2wh2 s LYS 68 Cb 0.00 0.22 -0.01 0.00 -1.51 0.00 0.00 37.83 36.53 2wh2 s LYS 68 CO 0.00 -0.07 0.64 0.72 -0.36 0.00 0.00 175.35 176.28 2wh2 n HIS 69 N 2.71 -1.47 0.00 4.03 8.25 -1.26 -4.93 115.22 122.55 2wh2 n HIS 69 Ca -0.14 0.60 0.00 0.00 -0.26 0.00 0.00 57.72 57.92 2wh2 n HIS 69 Cb 0.56 -3.92 0.00 0.00 1.12 0.00 0.00 29.99 27.76 2wh2 n HIS 69 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2wh2 n THR 70 N -2.95 0.00 0.00 1.59 -2.24 -1.26 -5.00 114.28 104.41 2wh2 n THR 70 Ca -0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2wh2 n THR 70 Cb 0.60 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 2wh2 n THR 70 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wh2 n GLY 71 N 1.73 1.71 3.86 3.38 0.00 -1.26 -5.03 105.19 109.58 2wh2 n GLY 71 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2wh2 n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wh2 s ARG 72 N -0.75 3.84 0.56 1.61 0.52 -1.26 -5.04 118.95 118.43 2wh2 s ARG 72 Ca 0.00 0.81 -0.18 0.00 -0.52 0.00 0.00 55.73 55.85 2wh2 s ARG 72 Cb 0.00 -2.17 -0.05 0.00 0.52 0.00 0.00 34.95 33.24 2wh2 s ARG 72 CO 0.00 -0.29 1.07 0.00 0.02 0.00 0.00 175.30 176.10 2wh2 s ALA 73 N -2.70 2.76 0.22 2.13 0.00 -1.26 -4.95 121.76 117.96 2wh2 s ALA 73 Ca 0.57 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.76 2wh2 s ALA 73 Cb -0.10 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.66 2wh2 s ALA 73 CO 0.36 -0.68 1.31 -0.98 0.00 0.00 0.00 175.76 175.78 2wh2 s ARG 74 N -3.69 4.39 0.05 0.00 1.70 -1.26 -4.97 118.95 115.17 2wh2 s ARG 74 Ca 0.66 2.08 -0.03 0.00 -0.47 0.00 0.00 55.73 57.98 2wh2 s ARG 74 Cb -0.18 -3.17 -0.02 0.00 -0.57 0.00 0.00 34.95 31.01 2wh2 s ARG 74 CO 0.30 -0.24 0.03 -1.01 -1.08 0.00 0.00 175.30 173.30 2wh2 s HIS 75 N -0.10 0.35 0.00 5.89 3.76 -1.26 -5.10 115.29 118.83 2wh2 s HIS 75 Ca 0.55 -0.78 0.00 0.00 -0.15 0.00 0.00 55.06 54.69 2wh2 s HIS 75 Cb -0.37 -0.26 0.00 0.00 1.11 0.00 0.00 32.58 33.06 2wh2 s HIS 75 CO 0.40 -0.36 0.00 0.41 -0.85 0.00 0.00 174.74 174.34 2wh2 n GLY 76 N 0.52 0.55 3.97 -2.22 0.00 -1.26 -4.47 105.19 102.27 2wh2 n GLY 76 Ca -0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 2wh2 n GLY 76 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2wh2 s ASP 77 N -0.63 5.84 0.00 1.61 -4.77 -1.24 -1.20 116.67 116.29 2wh2 s ASP 77 Ca 0.00 0.09 0.32 0.00 -3.30 0.00 0.00 52.55 49.65 2wh2 s ASP 77 Cb 0.00 -1.37 1.80 0.00 -1.09 0.00 0.00 42.92 42.26 2wh2 s ASP 77 CO 0.00 -0.63 2.18 2.30 0.70 0.00 0.00 175.17 179.72 2wh2 n ILE 78 N -1.94 0.00 1.60 2.11 -5.35 -1.26 -2.81 119.36 111.71 2wh2 n ILE 78 Ca 0.01 -0.01 0.15 0.00 -0.27 0.00 0.00 62.75 62.64 2wh2 n ILE 78 Cb 0.58 -0.48 0.79 0.00 -1.74 0.00 0.00 39.64 38.79 2wh2 n ILE 78 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wh2 n GLY 79 N 1.07 -1.12 3.77 3.28 0.00 -1.26 -3.50 105.19 107.43 2wh2 n GLY 79 Ca 0.22 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 2wh2 n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wh2 s ALA 80 N -2.37 3.44 -1.01 4.61 0.00 -1.13 -1.43 121.76 123.87 2wh2 s ALA 80 Ca 0.35 1.37 0.02 0.00 0.00 0.00 0.00 51.96 53.70 2wh2 s ALA 80 Cb 0.21 -3.53 0.09 0.00 0.00 0.00 0.00 23.12 19.89 2wh2 s ALA 80 CO 0.43 -0.86 1.06 -0.35 0.00 0.00 0.00 175.76 176.05 2wh2 n PRO 81 N 0.45 0.00 -1.02 0.00 -0.04 -1.26 -1.68 135.00 131.46 2wh2 n PRO 81 Ca 0.02 0.46 -0.08 0.00 -0.04 0.00 0.00 63.50 63.85 2wh2 n PRO 81 Cb 0.41 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.65 2wh2 n PRO 81 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2wh2 n ILE 82 N -1.49 2.93 -0.24 0.52 -5.35 -1.26 -4.55 119.36 109.92 2wh2 n ILE 82 Ca 0.01 -1.78 0.03 0.00 -0.27 0.00 0.00 62.75 60.73 2wh2 n ILE 82 Cb 0.03 -0.37 0.06 0.00 -1.74 0.00 0.00 39.64 37.61 2wh2 n ILE 82 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2wh2 n PHE 83 N -0.41 0.11 0.00 4.28 0.99 -0.67 -5.05 117.46 116.72 2wh2 n PHE 83 Ca 0.43 -0.60 0.00 0.00 -0.00 0.00 0.00 57.45 57.28 2wh2 n PHE 83 Cb 1.39 -0.07 0.00 0.00 -1.00 0.00 0.00 39.48 39.80 2wh2 n PHE 83 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2wh2 n VAL 84 N -0.49 0.00 0.26 -4.37 0.31 -1.26 -3.52 118.33 109.26 2wh2 n VAL 84 Ca 0.05 0.00 0.16 0.00 -0.01 0.00 0.00 64.34 64.54 2wh2 n VAL 84 Cb 0.37 0.00 0.86 0.00 -0.91 0.00 0.00 33.84 34.16 2wh2 n VAL 84 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2wh2 h GLY 85 N 0.00 0.00 -1.10 2.92 0.00 -1.91 -3.43 103.07 99.54 2wh2 h GLY 85 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 2wh2 h GLY 85 CO 0.00 0.00 -0.37 0.61 0.00 0.00 0.00 176.54 176.78 2wh2 n GLY 86 N -1.19 -2.88 3.84 4.60 0.00 -1.23 -4.95 105.19 103.38 2wh2 n GLY 86 Ca -0.02 -1.11 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 2wh2 n GLY 86 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wh2 s GLY 87 N -2.32 1.69 0.41 -0.02 0.00 -0.51 -4.89 107.32 101.68 2wh2 s GLY 87 Ca 0.52 0.03 -0.19 0.00 0.00 0.00 0.00 44.72 45.08 2wh2 s GLY 87 CO 0.49 0.32 0.90 0.54 0.00 0.00 0.00 173.10 175.35 2wh2 s VAL 88 N -3.07 4.47 0.00 1.40 0.11 0.24 -4.11 120.40 119.45 2wh2 s VAL 88 Ca 0.57 1.33 0.00 0.00 -2.93 0.00 0.00 61.98 60.95 2wh2 s VAL 88 Cb -0.13 -3.61 0.00 0.00 -1.53 0.00 0.00 36.38 31.11 2wh2 s VAL 88 CO 0.53 -0.32 0.00 0.52 -3.33 0.00 0.00 175.10 172.51 2wh2 n VAL 89 N -0.66 0.00 -0.93 2.04 0.31 -1.26 -4.18 118.33 113.66 2wh2 n VAL 89 Ca 0.06 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.20 2wh2 n VAL 89 Cb 0.54 -0.02 0.05 0.00 -0.91 0.00 0.00 33.84 33.50 2wh2 n VAL 89 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2wh2 n PHE 90 N 0.00 1.77 -1.48 3.52 3.72 -1.26 -4.91 117.46 118.82 2wh2 n PHE 90 Ca 0.00 -2.09 -0.36 0.00 -0.05 0.00 0.00 57.45 54.96 2wh2 n PHE 90 Cb 0.00 -1.01 0.09 0.00 -0.94 0.00 0.00 39.48 37.62 2wh2 n PHE 90 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2wh2 s GLY 91 N -0.11 2.59 0.50 1.37 0.00 -1.26 -4.94 107.32 105.48 2wh2 s GLY 91 Ca 0.35 1.08 -0.22 0.00 0.00 0.00 0.00 44.72 45.93 2wh2 s GLY 91 CO -0.00 1.51 1.20 -1.55 0.00 0.00 0.00 173.10 174.26 2wh2 n PRO 92 N -2.48 1.55 -4.25 2.90 -0.04 -1.26 -4.79 135.00 126.64 2wh2 n PRO 92 Ca 0.15 0.57 -0.16 0.00 -0.04 0.00 0.00 63.50 64.02 2wh2 n PRO 92 Cb 0.49 -2.36 -0.11 0.00 -0.04 0.00 0.00 33.50 31.48 2wh2 n PRO 92 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2wh2 s LYS 93 N -2.54 1.04 0.11 0.54 -0.14 -1.06 -1.01 119.74 116.69 2wh2 s LYS 93 Ca 0.68 -1.34 -0.34 0.00 -1.36 0.00 0.00 55.97 53.61 2wh2 s LYS 93 Cb -0.46 -0.77 -0.14 0.00 -1.68 0.00 0.00 37.83 34.78 2wh2 s LYS 93 CO 0.52 0.12 1.61 -0.35 -0.76 0.00 0.00 175.35 176.50 2wh2 n PRO 94 N 0.18 2.06 -3.91 -1.68 -0.04 -1.13 -4.69 135.00 125.79 2wh2 n PRO 94 Ca -0.13 0.75 -0.09 0.00 -0.04 0.00 0.00 63.50 63.99 2wh2 n PRO 94 Cb 0.59 -2.52 -0.08 0.00 -0.04 0.00 0.00 33.50 31.45 2wh2 n PRO 94 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2wh2 s ARG 95 N 1.42 0.85 -0.13 0.54 1.70 -1.22 -5.03 118.95 117.08 2wh2 s ARG 95 Ca 0.82 -1.03 -0.07 0.00 -0.47 0.00 0.00 55.73 54.98 2wh2 s ARG 95 Cb -0.71 0.32 -0.04 0.00 -0.57 0.00 0.00 34.95 33.96 2wh2 s ARG 95 CO 0.41 -0.26 0.11 0.34 -1.08 0.00 0.00 175.30 174.82 2wh2 s ASP 96 N -2.89 6.11 0.00 -2.89 2.15 -1.26 -3.89 116.67 114.00 2wh2 s ASP 96 Ca 0.07 0.35 0.14 0.00 0.43 0.00 0.00 52.55 53.54 2wh2 s ASP 96 Cb 0.05 -1.97 -0.05 0.00 -0.30 0.00 0.00 42.92 40.65 2wh2 s ASP 96 CO -0.09 0.35 0.72 -1.22 -0.17 0.00 0.00 175.17 174.76 2wh2 n TYR 97 N 2.36 0.00 -2.11 -5.34 4.01 -1.26 -5.01 117.16 109.80 2wh2 n TYR 97 Ca -0.19 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.21 2wh2 n TYR 97 Cb 0.54 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.58 2wh2 n TYR 97 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2wh2 s SER 98 N -1.91 5.67 0.21 7.72 1.04 -1.26 -4.37 113.70 120.80 2wh2 s SER 98 Ca 0.10 1.99 -0.12 0.00 0.48 0.00 0.00 55.95 58.40 2wh2 s SER 98 Cb 0.11 -2.56 -0.00 0.00 0.10 0.00 0.00 66.02 63.67 2wh2 s SER 98 CO 0.42 -1.25 0.41 -0.72 0.98 0.00 0.00 173.24 173.09 2wh2 s TYR 99 N -2.14 0.36 -0.80 5.02 1.13 -1.26 -4.98 117.35 114.68 2wh2 s TYR 99 Ca 0.68 -0.71 -0.15 0.00 -1.41 0.00 0.00 57.07 55.48 2wh2 s TYR 99 Cb -0.20 0.10 0.20 0.00 -1.10 0.00 0.00 41.96 40.96 2wh2 s TYR 99 CO 0.32 -0.88 0.78 0.99 -2.51 0.00 0.00 175.55 174.25 2wh2 s THR 100 N -3.99 5.44 0.29 -3.49 2.01 -1.26 -4.98 115.64 109.66 2wh2 s THR 100 Ca 0.20 -2.21 -0.29 0.00 0.31 0.00 0.00 61.69 59.70 2wh2 s THR 100 Cb 0.01 -4.49 -0.10 0.00 0.01 0.00 0.00 72.50 67.93 2wh2 s THR 100 CO 0.05 -1.07 1.34 -0.22 -0.69 0.00 0.00 174.62 174.03 2wh2 s LEU 101 N 0.70 4.42 0.39 4.42 2.96 -1.26 -4.90 118.68 125.40 2wh2 s LEU 101 Ca 0.18 2.63 -0.25 0.00 -0.22 0.00 0.00 54.13 56.47 2wh2 s LEU 101 Cb -0.12 -3.64 -0.12 0.00 0.50 0.00 0.00 46.19 42.81 2wh2 s LEU 101 CO -0.07 -0.57 0.89 -2.65 -1.32 0.00 0.00 176.35 172.62 2wh2 n PRO 102 N 1.51 1.12 0.20 0.98 -0.02 -1.26 -4.81 135.00 132.72 2wh2 n PRO 102 Ca 0.03 0.40 -0.15 0.00 -2.02 0.00 0.00 63.50 61.76 2wh2 n PRO 102 Cb 0.42 -1.84 -0.08 0.00 -0.02 0.00 0.00 33.50 31.97 2wh2 n PRO 102 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2wh2 h LYS 103 N 1.43 -0.43 -0.92 -0.52 1.57 -1.99 -1.61 116.57 114.09 2wh2 h LYS 103 Ca -0.42 0.03 0.21 0.00 -1.87 0.00 0.00 60.65 58.60 2wh2 h LYS 103 Cb 1.36 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.69 2wh2 h LYS 103 CO 0.56 -0.25 0.61 0.87 -0.57 0.00 0.00 179.45 180.68 2wh2 h LYS 104 N -0.51 0.40 -0.29 3.15 1.57 -1.99 0.34 116.57 119.24 2wh2 h LYS 104 Ca -0.05 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 2wh2 h LYS 104 Cb 0.38 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2wh2 h LYS 104 CO 0.07 0.26 -0.01 0.28 -0.57 0.00 0.00 179.45 179.49 2wh2 h VAL 105 N 0.41 1.26 -0.49 0.50 2.07 -1.82 0.16 116.25 118.35 2wh2 h VAL 105 Ca 0.49 -0.95 0.06 0.00 0.82 0.00 0.00 66.70 67.11 2wh2 h VAL 105 Cb 1.21 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 32.26 2wh2 h VAL 105 CO -0.19 0.31 0.33 0.03 0.02 0.00 0.00 177.57 178.06 2wh2 h ARG 106 N 0.30 0.42 0.01 1.57 3.08 0.57 0.60 114.38 120.93 2wh2 h ARG 106 Ca 0.08 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 2wh2 h ARG 106 Cb 0.45 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2wh2 h ARG 106 CO 0.02 0.28 -0.00 0.87 -1.07 0.00 0.00 179.97 180.06 2wh2 h LYS 107 N 0.43 -0.01 0.00 0.04 1.57 -0.71 -2.86 116.57 115.02 2wh2 h LYS 107 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2wh2 h LYS 107 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2wh2 h LYS 107 CO -0.05 -0.01 0.35 0.87 -0.57 0.00 0.00 179.45 180.04 2wh2 h LYS 108 N -0.93 0.00 -0.01 3.15 1.57 -0.67 0.63 116.57 120.31 2wh2 h LYS 108 Ca -0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 2wh2 h LYS 108 Cb 0.01 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.33 2wh2 h LYS 108 CO 0.00 0.00 -0.60 0.78 -0.57 0.00 0.00 179.45 179.06 2wh2 h GLY 109 N 0.00 0.48 0.61 3.86 0.00 -0.92 -2.25 103.07 104.86 2wh2 h GLY 109 Ca 0.00 -0.82 -0.03 0.00 0.00 0.00 0.00 47.33 46.48 2wh2 h GLY 109 CO 0.00 0.72 -0.29 -2.00 0.00 0.00 0.00 176.54 174.97 2wh2 h LEU 110 N -0.06 -0.70 -0.95 3.11 6.46 0.45 0.21 115.31 123.84 2wh2 h LEU 110 Ca -0.07 0.02 0.16 0.00 -0.12 0.00 0.00 57.88 57.87 2wh2 h LEU 110 Cb 1.30 0.18 -0.16 0.00 -0.73 0.00 0.00 40.66 41.25 2wh2 h LEU 110 CO 0.12 -0.48 -0.32 0.00 -0.62 0.00 0.00 178.44 177.13 2wh2 n ALA 111 N -2.43 -0.00 -0.36 1.25 0.00 -0.52 0.20 120.51 118.64 2wh2 n ALA 111 Ca -0.10 0.98 -0.00 0.00 0.00 0.00 0.00 53.44 54.31 2wh2 n ALA 111 Cb 0.32 -0.49 0.13 0.00 0.00 0.00 0.00 19.45 19.42 2wh2 n ALA 111 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2wh2 h MET 112 N 0.00 1.20 0.57 0.00 2.86 -1.13 0.25 114.93 118.67 2wh2 h MET 112 Ca 0.37 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.92 2wh2 h MET 112 Cb 0.61 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 2wh2 h MET 112 CO -0.95 0.80 -0.39 0.00 1.06 0.00 0.00 176.91 177.43 2wh2 h ALA 113 N 1.40 -1.16 -1.00 6.32 0.00 0.56 -1.84 119.26 123.53 2wh2 h ALA 113 Ca 0.39 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.25 2wh2 h ALA 113 Cb -0.01 0.53 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 2wh2 h ALA 113 CO -0.12 -1.14 0.63 0.28 0.00 0.00 0.00 179.25 178.89 2wh2 h VAL 114 N -0.91 0.87 0.12 0.00 2.07 -0.88 -2.46 116.25 115.07 2wh2 h VAL 114 Ca -0.08 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2wh2 h VAL 114 Cb 0.74 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2wh2 h VAL 114 CO 0.05 0.17 -0.24 0.00 0.02 0.00 0.00 177.57 177.57 2wh2 h ALA 115 N 1.56 -0.82 -0.48 1.67 0.00 -0.23 0.04 119.26 121.00 2wh2 h ALA 115 Ca 0.52 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.50 2wh2 h ALA 115 Cb 0.59 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2wh2 h ALA 115 CO -0.29 -0.87 0.62 0.22 0.00 0.00 0.00 179.25 178.93 2wh2 h ASP 116 N -0.39 0.00 0.00 0.00 3.58 -0.88 0.98 116.42 119.71 2wh2 h ASP 116 Ca -0.01 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 2wh2 h ASP 116 Cb 0.37 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.42 2wh2 h ASP 116 CO -0.10 0.00 -0.00 -0.09 -2.88 0.00 0.00 179.24 176.17 2wh2 h ARG 117 N 0.00 -0.00 -0.31 0.28 9.65 -0.85 -3.08 114.38 120.06 2wh2 h ARG 117 Ca 0.23 0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 59.01 2wh2 h ARG 117 Cb 1.46 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 30.03 2wh2 h ARG 117 CO -0.00 0.79 -0.22 0.00 2.80 0.00 0.00 179.97 183.33 2wh2 h ALA 118 N 0.17 1.03 -0.86 2.80 0.00 0.14 -1.96 119.26 120.58 2wh2 h ALA 118 Ca -0.00 -0.35 0.17 0.00 0.00 0.00 0.00 54.91 54.73 2wh2 h ALA 118 Cb 0.79 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.34 2wh2 h ALA 118 CO 0.00 0.58 0.42 -0.09 0.00 0.00 0.00 179.25 180.16 2wh2 h ARG 119 N 0.53 0.53 -0.00 0.00 2.43 0.71 0.20 114.38 118.78 2wh2 h ARG 119 Ca 0.08 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2wh2 h ARG 119 Cb 0.67 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2wh2 h ARG 119 CO 0.05 0.35 -0.33 0.39 -1.51 0.00 0.00 179.97 178.93 2wh2 n GLU 120 N -4.93 0.44 0.00 0.20 1.02 -1.01 -4.92 120.64 111.44 2wh2 n GLU 120 Ca 0.18 -0.24 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 2wh2 n GLU 120 Cb 0.50 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 2wh2 n GLU 120 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wh2 n GLY 121 N 1.41 2.97 0.00 0.62 0.00 0.70 -4.89 105.19 105.99 2wh2 n GLY 121 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2wh2 n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wh2 n LYS 122 N -0.56 0.00 -3.15 1.61 4.76 -0.82 -4.61 118.16 115.40 2wh2 n LYS 122 Ca 0.00 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.08 2wh2 n LYS 122 Cb 0.00 -1.38 -0.06 0.00 -1.84 0.00 0.00 35.03 31.75 2wh2 n LYS 122 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2wh2 s LEU 123 N -1.26 4.31 -0.26 -0.35 2.96 -1.20 -1.81 118.68 121.07 2wh2 s LEU 123 Ca 0.00 1.35 -0.01 0.00 -0.22 0.00 0.00 54.13 55.24 2wh2 s LEU 123 Cb 0.00 -3.59 0.15 0.00 0.50 0.00 0.00 46.19 43.25 2wh2 s LEU 123 CO 0.00 0.02 0.44 -0.22 -1.32 0.00 0.00 176.35 175.27 2wh2 s LEU 124 N -2.09 -0.88 0.37 -0.68 2.96 -0.04 -4.55 118.68 113.76 2wh2 s LEU 124 Ca 0.43 0.32 -0.15 0.00 -0.22 0.00 0.00 54.13 54.52 2wh2 s LEU 124 Cb -0.16 1.41 -0.09 0.00 0.50 0.00 0.00 46.19 47.86 2wh2 s LEU 124 CO 0.20 -0.30 0.79 -0.76 -1.32 0.00 0.00 176.35 174.97 2wh2 s LEU 125 N 2.63 3.97 0.28 -0.68 2.01 -0.78 -0.44 118.68 125.66 2wh2 s LEU 125 Ca 0.14 1.32 0.02 0.00 0.01 0.00 0.00 54.13 55.62 2wh2 s LEU 125 Cb -0.15 -4.16 -0.03 0.00 0.01 0.00 0.00 46.19 41.87 2wh2 s LEU 125 CO -0.19 -0.29 0.25 0.68 1.01 0.00 0.00 176.35 177.81 2wh2 s VAL 126 N -2.14 0.00 0.31 -1.59 -7.23 -0.34 -3.43 120.40 105.98 2wh2 s VAL 126 Ca 0.55 -1.92 0.00 0.00 -1.81 0.00 0.00 61.98 58.80 2wh2 s VAL 126 Cb -0.10 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.34 2wh2 s VAL 126 CO 0.21 0.00 0.00 1.21 -0.31 0.00 0.00 175.10 176.21 2wh2 n GLU 127 N -0.46 0.00 -0.99 4.82 4.07 -1.23 -2.13 120.64 124.72 2wh2 n GLU 127 Ca 0.04 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.70 2wh2 n GLU 127 Cb 0.64 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.94 2wh2 n GLU 127 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2wh2 n ALA 128 N -3.30 2.68 -1.48 4.31 0.00 -1.22 -4.79 120.51 116.71 2wh2 n ALA 128 Ca 0.00 -3.16 -0.42 0.00 0.00 0.00 0.00 53.44 49.87 2wh2 n ALA 128 Cb 0.00 -3.67 -0.02 0.00 0.00 0.00 0.00 19.45 15.76 2wh2 n ALA 128 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2wh2 n PHE 129 N 7.90 2.84 0.00 0.00 3.72 -1.26 -4.78 117.46 125.87 2wh2 n PHE 129 Ca 0.49 -2.55 0.00 0.00 -0.05 0.00 0.00 57.45 55.34 2wh2 n PHE 129 Cb 0.41 -2.24 0.00 0.00 -0.94 0.00 0.00 39.48 36.71 2wh2 n PHE 129 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wh2 n ALA 130 N 6.37 0.00 -1.47 4.37 0.00 -1.26 -3.75 120.51 124.76 2wh2 n ALA 130 Ca 0.52 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.84 2wh2 n ALA 130 Cb 0.38 0.21 -0.10 0.00 0.00 0.00 0.00 19.45 19.94 2wh2 n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wh2 n GLY 131 N -0.90 -0.30 0.00 0.00 0.00 -1.26 -4.86 105.19 97.87 2wh2 n GLY 131 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2wh2 n GLY 131 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2wh2 n VAL 132 N 7.88 0.00 0.00 1.61 3.14 -1.25 -4.41 118.33 125.30 2wh2 n VAL 132 Ca 0.40 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.78 2wh2 n VAL 132 Cb 0.42 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.20 2wh2 n VAL 132 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2wh2 n ASN 133 N 0.00 0.00 -3.88 6.55 4.13 -1.26 -4.33 115.26 116.47 2wh2 n ASN 133 Ca 0.00 0.00 -0.25 0.00 1.68 0.00 0.00 54.58 56.01 2wh2 n ASN 133 Cb 0.00 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.15 2wh2 n ASN 133 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wh2 n GLY 134 N 0.00 0.15 2.88 7.41 0.00 -1.25 -4.73 105.19 109.65 2wh2 n GLY 134 Ca 0.00 -0.44 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 2wh2 n GLY 134 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wh2 s LYS 135 N 6.40 1.16 0.02 1.61 2.47 -1.26 -4.48 119.74 125.65 2wh2 s LYS 135 Ca 0.53 -1.57 -0.03 0.00 -1.56 0.00 0.00 55.97 53.34 2wh2 s LYS 135 Cb 0.06 -2.64 -0.01 0.00 -1.46 0.00 0.00 37.83 33.78 2wh2 s LYS 135 CO 0.22 -0.98 0.24 -2.37 0.16 0.00 0.00 175.35 172.62 2wh2 n THR 136 N 4.43 -0.06 -0.07 3.43 5.66 -1.26 0.18 114.28 126.58 2wh2 n THR 136 Ca 0.02 0.37 0.26 0.00 -3.05 0.00 0.00 64.05 61.64 2wh2 n THR 136 Cb 0.41 -0.47 0.67 0.00 -1.55 0.00 0.00 70.33 69.39 2wh2 n THR 136 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2wh2 h LYS 137 N 0.00 0.00 0.51 1.09 1.57 -1.96 -0.40 116.57 117.38 2wh2 h LYS 137 Ca 0.02 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 2wh2 h LYS 137 Cb 0.04 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.35 2wh2 h LYS 137 CO -0.09 0.00 -0.25 0.93 -0.57 0.00 0.00 179.45 179.47 2wh2 h GLU 138 N 0.00 -0.66 -0.69 3.15 5.08 0.15 -2.37 114.58 119.25 2wh2 h GLU 138 Ca 0.35 0.05 0.14 0.00 -1.00 0.00 0.00 59.36 58.89 2wh2 h GLU 138 Cb 1.83 0.15 -0.10 0.00 0.50 0.00 0.00 28.75 31.13 2wh2 h GLU 138 CO -0.00 -0.44 0.17 0.35 -1.00 0.00 0.00 179.01 178.08 2wh2 h PHE 139 N -1.17 0.26 -0.26 4.33 3.57 -1.15 0.26 116.94 122.78 2wh2 h PHE 139 Ca -0.07 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.54 2wh2 h PHE 139 Cb 0.53 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 2wh2 h PHE 139 CO 0.00 -0.05 0.24 1.25 -2.23 0.00 0.00 178.31 177.52 2wh2 h LEU 140 N 0.28 0.00 0.00 0.59 5.85 -1.15 0.86 115.31 121.73 2wh2 h LEU 140 Ca 0.38 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 59.06 2wh2 h LEU 140 Cb 0.60 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2wh2 h LEU 140 CO -0.46 0.00 -0.27 0.00 -0.34 0.00 0.00 178.44 177.37 2wh2 h ALA 141 N 1.77 0.04 -0.47 1.25 0.00 0.02 -3.16 119.26 118.72 2wh2 h ALA 141 Ca 0.12 -0.44 0.14 0.00 0.00 0.00 0.00 54.91 54.73 2wh2 h ALA 141 Cb 0.59 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2wh2 h ALA 141 CO -0.00 0.18 0.34 2.35 0.00 0.00 0.00 179.25 182.12 2wh2 h TRP 142 N -1.00 0.00 0.74 0.00 7.01 -0.68 -1.49 115.95 120.53 2wh2 h TRP 142 Ca -0.06 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 60.91 2wh2 h TRP 142 Cb 0.64 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 27.70 2wh2 h TRP 142 CO 0.08 0.00 -0.36 0.00 -2.79 0.00 0.00 178.44 175.38 2wh2 h ALA 143 N 1.76 -1.12 -0.73 2.65 0.00 0.63 -3.03 119.26 119.42 2wh2 h ALA 143 Ca 0.22 -0.22 0.17 0.00 0.00 0.00 0.00 54.91 55.08 2wh2 h ALA 143 Cb 0.90 0.39 -0.12 0.00 0.00 0.00 0.00 17.79 18.96 2wh2 h ALA 143 CO -0.00 -1.05 0.06 -0.22 0.00 0.00 0.00 179.25 178.04 2wh2 h LYS 144 N -1.12 0.15 -0.03 0.00 3.64 -1.24 0.54 116.57 118.50 2wh2 h LYS 144 Ca -0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2wh2 h LYS 144 Cb 0.77 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 2wh2 h LYS 144 CO 0.17 0.10 0.00 0.39 -2.27 0.00 0.00 179.45 177.84 2wh2 n GLU 145 N -5.28 0.13 -0.54 1.90 -0.58 -0.64 -1.55 120.64 114.08 2wh2 n GLU 145 Ca 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 2wh2 n GLU 145 Cb 0.46 -1.02 -0.00 0.00 -0.57 0.00 0.00 31.44 30.32 2wh2 n GLU 145 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wh2 n ALA 146 N -0.25 2.04 0.00 0.62 0.00 0.19 -4.99 120.51 118.11 2wh2 n ALA 146 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.74 2wh2 n ALA 146 Cb 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2wh2 n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wh2 n GLY 147 N 0.01 2.91 3.57 0.00 0.00 -0.60 -4.94 105.19 106.14 2wh2 n GLY 147 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2wh2 n GLY 147 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wh2 s LEU 148 N 0.00 3.43 0.00 0.99 1.43 -0.99 -4.67 118.68 118.88 2wh2 s LEU 148 Ca 0.00 -1.46 0.20 0.00 -1.03 0.00 0.00 54.13 51.84 2wh2 s LEU 148 Cb 0.00 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 43.61 2wh2 s LEU 148 CO 0.00 -1.92 0.96 -0.90 0.23 0.00 0.00 176.35 174.72 2wh2 n ASP 149 N 10.65 1.73 0.00 2.29 5.75 -1.26 -2.94 116.55 132.76 2wh2 n ASP 149 Ca 0.39 -1.36 0.00 0.00 -0.01 0.00 0.00 54.79 53.81 2wh2 n ASP 149 Cb 0.49 0.55 0.00 0.00 -1.03 0.00 0.00 41.12 41.13 2wh2 n ASP 149 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wh2 n GLY 150 N 1.33 0.78 0.09 6.12 0.00 -1.26 -4.95 105.19 107.30 2wh2 n GLY 150 Ca 0.07 -0.37 -0.04 0.00 0.00 0.00 0.00 46.02 45.68 2wh2 n GLY 150 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2wh2 h SER 151 N 0.00 0.00 -4.07 1.61 0.87 -1.93 -3.45 113.55 106.59 2wh2 h SER 151 Ca 0.00 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.06 2wh2 h SER 151 Cb 0.00 0.00 -0.30 0.00 -0.44 0.00 0.00 62.40 61.66 2wh2 h SER 151 CO 0.00 0.83 -0.82 -1.61 -0.53 0.00 0.00 176.83 174.71 2wh2 s GLU 152 N -2.78 1.31 0.55 2.24 2.02 -1.26 -5.13 118.70 115.66 2wh2 s GLU 152 Ca 0.01 -0.51 -0.21 0.00 0.02 0.00 0.00 54.97 54.28 2wh2 s GLU 152 Cb 0.09 -1.22 -0.05 0.00 0.10 0.00 0.00 34.13 33.06 2wh2 s GLU 152 CO 0.80 0.26 1.33 -1.54 0.02 0.00 0.00 175.26 176.13 2wh2 s SER 153 N -0.15 5.26 -0.03 -0.19 1.04 -1.26 -4.81 113.70 113.56 2wh2 s SER 153 Ca 0.02 2.69 0.02 0.00 0.48 0.00 0.00 55.95 59.16 2wh2 s SER 153 Cb -0.08 -2.63 0.01 0.00 0.10 0.00 0.00 66.02 63.42 2wh2 s SER 153 CO 0.00 -1.57 -0.08 -0.69 0.98 0.00 0.00 173.24 171.88 2wh2 s VAL 154 N -1.35 0.75 -0.36 5.02 1.01 0.85 -0.88 120.40 125.45 2wh2 s VAL 154 Ca 0.72 -0.31 -0.16 0.00 0.00 0.00 0.00 61.98 62.23 2wh2 s VAL 154 Cb -0.39 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 2wh2 s VAL 154 CO 0.45 0.25 0.38 -0.22 0.00 0.00 0.00 175.10 175.96 2wh2 s LEU 155 N 0.40 4.55 -0.49 3.92 2.96 -0.16 -0.39 118.68 129.47 2wh2 s LEU 155 Ca -0.06 -0.35 -0.17 0.00 -0.22 0.00 0.00 54.13 53.33 2wh2 s LEU 155 Cb -0.11 -2.35 0.07 0.00 0.50 0.00 0.00 46.19 44.31 2wh2 s LEU 155 CO 0.01 -0.40 0.49 -0.22 -1.32 0.00 0.00 176.35 174.91 2wh2 s LEU 156 N 2.04 5.42 -0.44 -0.68 2.96 0.15 -2.07 118.68 126.07 2wh2 s LEU 156 Ca 0.12 -1.22 -0.11 0.00 -0.22 0.00 0.00 54.13 52.70 2wh2 s LEU 156 Cb -0.17 -2.28 0.07 0.00 0.50 0.00 0.00 46.19 44.32 2wh2 s LEU 156 CO 0.12 -0.76 0.30 -0.69 -1.32 0.00 0.00 176.35 174.00 2wh2 s VAL 157 N 2.01 4.58 0.01 1.68 1.01 -0.17 -1.96 120.40 127.57 2wh2 s VAL 157 Ca 0.08 -1.27 -0.05 0.00 0.00 0.00 0.00 61.98 60.75 2wh2 s VAL 157 Cb -0.23 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 2wh2 s VAL 157 CO 0.08 -0.52 0.08 0.28 0.00 0.00 0.00 175.10 175.02 2wh2 s THR 158 N 1.50 0.09 -0.57 3.92 -1.32 -1.08 -1.17 115.64 117.01 2wh2 s THR 158 Ca 0.03 -0.78 0.24 0.00 -1.21 0.00 0.00 61.69 59.98 2wh2 s THR 158 Cb -0.23 -0.38 0.23 0.00 -1.51 0.00 0.00 72.50 70.60 2wh2 s THR 158 CO 0.04 -0.43 1.56 1.23 -2.21 0.00 0.00 174.62 174.81 2wh2 h GLY 159 N 4.39 0.00 -7.12 6.08 0.00 -1.94 -3.38 103.07 101.10 2wh2 h GLY 159 Ca -0.31 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.47 2wh2 h GLY 159 CO 0.41 0.00 1.14 0.21 0.00 0.00 0.00 176.54 178.29 2wh2 s ASN 160 N -5.07 6.03 0.00 0.19 3.04 -1.26 -4.85 114.94 113.02 2wh2 s ASN 160 Ca 0.07 0.33 0.03 0.00 0.04 0.00 0.00 52.86 53.33 2wh2 s ASN 160 Cb 0.10 -2.54 0.17 0.00 -1.54 0.00 0.00 41.25 37.44 2wh2 s ASN 160 CO 0.66 -1.78 0.66 -0.62 -3.04 0.00 0.00 177.10 172.98 2wh2 n GLU 161 N 8.72 0.09 -0.11 0.43 1.02 -1.26 -1.50 120.64 128.02 2wh2 n GLU 161 Ca 0.14 0.01 -0.17 0.00 -0.02 0.00 0.00 57.16 57.11 2wh2 n GLU 161 Cb 0.49 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.31 2wh2 n GLU 161 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2wh2 n LEU 162 N -1.01 2.74 -0.04 -4.62 4.32 -1.26 -2.30 117.00 114.83 2wh2 n LEU 162 Ca 0.02 -0.04 -0.01 0.00 -0.02 0.00 0.00 56.01 55.96 2wh2 n LEU 162 Cb 0.01 -0.76 0.26 0.00 -1.62 0.00 0.00 43.42 41.31 2wh2 n LEU 162 CO 0.02 0.80 0.93 0.58 -1.22 0.00 0.00 177.39 178.50 2wh2 h VAL 163 N -0.16 1.21 0.00 4.08 2.07 -1.65 -0.67 116.25 121.13 2wh2 h VAL 163 Ca -0.51 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.18 2wh2 h VAL 163 Cb 1.72 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.38 2wh2 h VAL 163 CO -0.13 0.29 0.00 -1.14 0.02 0.00 0.00 177.57 176.61 2wh2 n ARG 164 N -4.27 0.00 -0.20 1.57 3.00 -0.56 -2.07 116.66 114.12 2wh2 n ARG 164 Ca 0.02 0.34 0.20 0.00 -0.00 0.00 0.00 57.85 58.41 2wh2 n ARG 164 Cb 0.25 -1.32 0.36 0.00 0.00 0.00 0.00 32.46 31.75 2wh2 n ARG 164 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 2wh2 n ARG 165 N -1.52 -0.04 -0.01 -0.14 0.63 -0.97 -0.90 116.66 113.71 2wh2 n ARG 165 Ca 0.00 0.83 -0.05 0.00 -0.92 0.00 0.00 57.85 57.71 2wh2 n ARG 165 Cb 0.00 -1.50 -0.04 0.00 0.45 0.00 0.00 32.46 31.37 2wh2 n ARG 165 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wh2 h ALA 166 N 1.19 -0.10 0.00 5.13 0.00 -1.01 -3.36 119.26 121.12 2wh2 h ALA 166 Ca 0.52 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.25 2wh2 h ALA 166 Cb 1.39 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 2wh2 h ALA 166 CO -0.45 -0.11 -0.18 0.00 0.00 0.00 0.00 179.25 178.52 2wh2 h ALA 167 N -0.73 1.12 -0.79 0.00 0.00 -0.75 -3.36 119.26 114.74 2wh2 h ALA 167 Ca -0.01 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.81 2wh2 h ALA 167 Cb 0.32 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.98 2wh2 h ALA 167 CO 0.02 0.22 -0.46 -2.13 0.00 0.00 0.00 179.25 176.90 2wh2 n ARG 168 N -3.47 -0.34 0.00 0.00 0.63 -0.08 0.20 116.66 113.61 2wh2 n ARG 168 Ca -0.01 1.20 0.02 0.00 -0.92 0.00 0.00 57.85 58.14 2wh2 n ARG 168 Cb 0.35 -1.76 0.11 0.00 0.45 0.00 0.00 32.46 31.61 2wh2 n ARG 168 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2wh2 n ASN 169 N -5.00 0.00 -4.71 6.15 4.05 -1.26 -4.74 115.26 109.75 2wh2 n ASN 169 Ca 0.02 -0.98 -0.41 0.00 0.45 0.00 0.00 54.58 53.66 2wh2 n ASN 169 Cb 0.21 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 41.18 2wh2 n ASN 169 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 2wh2 s LEU 170 N -1.21 4.36 0.08 1.20 2.96 0.13 -4.96 118.68 121.24 2wh2 s LEU 170 Ca 0.06 1.51 -0.31 0.00 -0.22 0.00 0.00 54.13 55.17 2wh2 s LEU 170 Cb 0.03 -3.41 -0.16 0.00 0.50 0.00 0.00 46.19 43.15 2wh2 s LEU 170 CO 0.04 -0.21 1.64 -0.65 -1.32 0.00 0.00 176.35 175.86 2wh2 h PRO 171 N 6.75 -0.68 -0.53 0.98 0.11 -1.86 -2.49 132.00 134.28 2wh2 h PRO 171 Ca -0.41 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2wh2 h PRO 171 Cb 1.21 0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.48 2wh2 h PRO 171 CO 0.75 -0.45 0.00 -2.67 -0.21 0.00 0.00 178.00 175.42 2wh2 n TRP 172 N -5.41 0.00 -4.09 0.65 4.27 -1.26 -4.72 117.44 106.88 2wh2 n TRP 172 Ca -0.11 0.00 -0.15 0.00 -3.89 0.00 0.00 57.50 53.35 2wh2 n TRP 172 Cb 0.31 -0.05 -0.14 0.00 -1.36 0.00 0.00 31.31 30.07 2wh2 n TRP 172 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 2wh2 s VAL 173 N -1.01 0.33 -0.27 -1.67 1.01 -0.94 -0.10 120.40 117.74 2wh2 s VAL 173 Ca 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.75 2wh2 s VAL 173 Cb 0.00 -0.29 0.08 0.00 0.00 0.00 0.00 36.38 36.16 2wh2 s VAL 173 CO 0.00 0.05 -0.00 -0.69 0.00 0.00 0.00 175.10 174.46 2wh2 s VAL 174 N -0.20 1.55 0.56 2.92 1.01 0.48 -4.70 120.40 122.02 2wh2 s VAL 174 Ca 0.00 -1.49 -0.16 0.00 0.00 0.00 0.00 61.98 60.33 2wh2 s VAL 174 Cb -0.02 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 2wh2 s VAL 174 CO -0.00 -0.32 1.03 0.28 0.00 0.00 0.00 175.10 176.09 2wh2 s THR 175 N 1.34 4.09 -0.29 3.92 -1.32 -1.26 -0.68 115.64 121.43 2wh2 s THR 175 Ca 0.01 1.01 -0.17 0.00 -1.21 0.00 0.00 61.69 61.33 2wh2 s THR 175 Cb -0.19 -3.52 0.15 0.00 -1.51 0.00 0.00 72.50 67.44 2wh2 s THR 175 CO -0.10 -0.56 1.01 -0.22 -2.21 0.00 0.00 174.62 172.54 2wh2 s LEU 176 N -4.29 -0.45 0.63 9.08 2.96 -0.83 -4.88 118.68 120.91 2wh2 s LEU 176 Ca 0.62 0.74 -0.16 0.00 -0.22 0.00 0.00 54.13 55.11 2wh2 s LEU 176 Cb -0.14 1.68 -0.01 0.00 0.50 0.00 0.00 46.19 48.22 2wh2 s LEU 176 CO 0.34 -0.12 1.12 0.00 -1.32 0.00 0.00 176.35 176.37 2wh2 s ALA 177 N 1.21 2.51 0.15 5.97 0.00 -1.26 -2.64 121.76 127.70 2wh2 s ALA 177 Ca -0.08 0.64 -0.25 0.00 0.00 0.00 0.00 51.96 52.27 2wh2 s ALA 177 Cb -0.04 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.76 2wh2 s ALA 177 CO -0.14 -1.17 1.60 -1.00 0.00 0.00 0.00 175.76 175.05 2wh2 h PRO 178 N 0.32 -0.33 -1.86 0.00 0.13 -1.90 -2.35 132.00 126.02 2wh2 h PRO 178 Ca -0.48 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2wh2 h PRO 178 Cb 1.25 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2wh2 h PRO 178 CO 0.55 -0.22 0.00 0.39 -0.23 0.00 0.00 178.00 178.49 2wh2 n GLU 179 N -5.42 0.78 -0.14 0.86 4.71 -1.26 -2.09 120.64 118.10 2wh2 n GLU 179 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.14 2wh2 n GLU 179 Cb 0.34 -1.11 0.00 0.00 -1.01 0.00 0.00 31.44 29.66 2wh2 n GLU 179 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2wh2 n GLY 180 N 1.43 -1.40 3.69 0.62 0.00 -0.88 -5.08 105.19 103.57 2wh2 n GLY 180 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2wh2 n GLY 180 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wh2 s LEU 181 N 0.00 4.36 0.06 0.99 2.96 -0.89 -4.91 118.68 121.25 2wh2 s LEU 181 Ca 0.00 2.49 -0.00 0.00 -0.22 0.00 0.00 54.13 56.40 2wh2 s LEU 181 Cb 0.00 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 2wh2 s LEU 181 CO 0.00 -0.87 -0.04 0.54 -1.32 0.00 0.00 176.35 174.67 2wh2 s ASN 182 N 2.16 0.60 0.21 3.68 2.20 -1.26 -5.08 114.94 117.45 2wh2 s ASN 182 Ca 0.73 -0.93 0.01 0.00 -0.94 0.00 0.00 52.86 51.73 2wh2 s ASN 182 Cb -0.40 0.16 0.15 0.00 -2.00 0.00 0.00 41.25 39.17 2wh2 s ASN 182 CO 0.32 -0.53 1.50 -0.37 -2.94 0.00 0.00 177.10 175.08 2wh2 h VAL 183 N 3.32 1.38 -0.88 3.54 -1.51 -1.94 -2.00 116.25 118.16 2wh2 h VAL 183 Ca -0.34 -2.04 0.04 0.00 -1.23 0.00 0.00 66.70 63.13 2wh2 h VAL 183 Cb 1.15 2.03 -0.05 0.00 -2.13 0.00 0.00 31.29 32.29 2wh2 h VAL 183 CO 0.62 0.61 0.58 0.22 -1.23 0.00 0.00 177.57 178.37 2wh2 h TYR 184 N 0.24 1.05 0.20 5.19 3.20 -1.95 -0.60 116.97 124.30 2wh2 h TYR 184 Ca -0.01 0.03 -0.33 0.00 3.14 0.00 0.00 58.73 61.55 2wh2 h TYR 184 Cb 1.19 -0.35 0.02 0.00 1.54 0.00 0.00 36.73 39.13 2wh2 h TYR 184 CO 0.03 0.59 -1.53 -0.44 -1.64 0.00 0.00 178.16 175.18 2wh2 h ASP 185 N 1.07 0.67 -0.86 -2.11 3.32 -1.96 0.40 116.42 116.95 2wh2 h ASP 185 Ca 0.36 -0.80 0.13 0.00 0.02 0.00 0.00 57.03 56.74 2wh2 h ASP 185 Cb 0.07 -0.22 -0.09 0.00 0.22 0.00 0.00 39.33 39.31 2wh2 h ASP 185 CO -0.11 1.65 0.47 0.40 -1.72 0.00 0.00 179.24 179.92 2wh2 h ILE 186 N 0.12 0.78 0.23 0.35 1.08 -0.95 -2.45 117.51 116.68 2wh2 h ILE 186 Ca -0.26 -0.24 -0.34 0.00 -0.39 0.00 0.00 64.86 63.63 2wh2 h ILE 186 Cb 2.11 0.03 0.03 0.00 -3.07 0.00 0.00 36.82 35.91 2wh2 h ILE 186 CO 0.23 0.13 -1.55 0.58 -0.69 0.00 0.00 178.15 176.85 2wh2 h VAL 187 N 0.69 1.20 -0.48 1.67 2.07 -1.15 -3.30 116.25 116.95 2wh2 h VAL 187 Ca 0.46 -2.67 0.14 0.00 0.82 0.00 0.00 66.70 65.44 2wh2 h VAL 187 Cb 0.59 2.97 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 2wh2 h VAL 187 CO -0.33 0.83 0.44 -0.09 0.02 0.00 0.00 177.57 178.43 2wh2 h ARG 188 N 0.13 0.00 -6.44 1.57 2.43 0.22 -3.41 114.38 108.88 2wh2 h ARG 188 Ca -0.28 0.00 -0.69 0.00 -0.81 0.00 0.00 59.98 58.20 2wh2 h ARG 188 Cb 2.15 0.00 -0.25 0.00 -0.42 0.00 0.00 29.97 31.45 2wh2 h ARG 188 CO 0.25 0.00 -0.81 0.95 -1.51 0.00 0.00 179.97 178.85 2wh2 s THR 189 N -4.76 2.76 0.35 0.20 -4.23 -0.96 -5.05 115.64 103.96 2wh2 s THR 189 Ca -0.05 -0.90 0.35 0.00 -1.18 0.00 0.00 61.69 59.91 2wh2 s THR 189 Cb 0.17 -2.07 0.38 0.00 1.34 0.00 0.00 72.50 72.32 2wh2 s THR 189 CO 0.62 0.54 2.12 -0.33 -0.54 0.00 0.00 174.62 177.03 2wh2 h GLU 190 N 5.23 0.00 -3.36 3.99 5.08 -1.76 -3.44 114.58 120.31 2wh2 h GLU 190 Ca -0.46 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 57.65 2wh2 h GLU 190 Cb 1.14 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 30.08 2wh2 h GLU 190 CO 0.49 0.04 -0.63 0.50 -1.00 0.00 0.00 179.01 178.41 2wh2 s ARG 191 N -3.94 0.07 -0.18 2.33 3.52 -0.06 -4.91 118.95 115.77 2wh2 s ARG 191 Ca -0.02 0.28 -0.06 0.00 -0.13 0.00 0.00 55.73 55.80 2wh2 s ARG 191 Cb 0.11 -0.15 -0.04 0.00 -1.56 0.00 0.00 34.95 33.32 2wh2 s ARG 191 CO 0.51 -0.14 0.04 -1.17 -0.81 0.00 0.00 175.30 173.74 2wh2 s LEU 192 N 0.92 3.62 -0.07 -0.88 0.20 -0.75 -0.99 118.68 120.73 2wh2 s LEU 192 Ca -0.07 -0.01 -0.00 0.00 0.69 0.00 0.00 54.13 54.73 2wh2 s LEU 192 Cb -0.10 -1.91 0.03 0.00 -0.43 0.00 0.00 46.19 43.78 2wh2 s LEU 192 CO -0.04 0.15 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.45 2wh2 s VAL 193 N 0.53 0.56 -0.03 1.68 1.01 -0.88 -0.86 120.40 122.41 2wh2 s VAL 193 Ca 0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.87 2wh2 s VAL 193 Cb -0.13 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.61 2wh2 s VAL 193 CO 0.01 0.27 0.21 0.00 0.00 0.00 0.00 175.10 175.59 2wh2 s MET 194 N 1.62 0.44 0.51 2.72 0.23 0.41 -1.00 119.30 124.23 2wh2 s MET 194 Ca 0.00 -0.09 -0.21 0.00 -1.03 0.00 0.00 55.69 54.36 2wh2 s MET 194 Cb -0.13 0.19 -0.08 0.00 -1.53 0.00 0.00 34.83 33.28 2wh2 s MET 194 CO -0.04 -0.10 0.85 -3.47 -2.03 0.00 0.00 175.02 170.22 2wh2 n ASP 195 N 1.97 0.40 -0.05 -1.18 -0.08 -0.32 -1.20 116.55 116.09 2wh2 n ASP 195 Ca -0.19 0.88 -0.10 0.00 -1.51 0.00 0.00 54.79 53.88 2wh2 n ASP 195 Cb 0.57 -1.30 0.05 0.00 2.34 0.00 0.00 41.12 42.78 2wh2 n ASP 195 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2wh2 h LEU 196 N 0.84 0.75 -2.51 -2.67 3.38 -1.78 -0.63 115.31 112.69 2wh2 h LEU 196 Ca -0.46 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.17 2wh2 h LEU 196 Cb 1.37 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 2wh2 h LEU 196 CO 0.52 1.07 -0.01 -2.24 0.09 0.00 0.00 178.44 177.87 2wh2 h ASP 197 N 0.58 0.00 0.00 -0.43 2.03 -1.91 -1.81 116.42 114.88 2wh2 h ASP 197 Ca 0.05 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.27 2wh2 h ASP 197 Cb 0.95 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.44 2wh2 h ASP 197 CO 0.09 0.01 -0.52 0.00 -1.03 0.00 0.00 179.24 177.79 2wh2 h ALA 198 N 1.99 0.09 0.00 4.15 0.00 -1.73 -3.17 119.26 120.59 2wh2 h ALA 198 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2wh2 h ALA 198 Cb 0.16 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2wh2 h ALA 198 CO 0.00 0.33 0.06 1.87 0.00 0.00 0.00 179.25 181.51 2wh2 n TRP 199 N -4.58 0.00 0.00 0.00 -0.00 -0.30 0.02 117.44 112.57 2wh2 n TRP 199 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.35 2wh2 n TRP 199 Cb 0.42 -0.22 0.00 0.00 -0.00 0.00 0.00 31.31 31.51 2wh2 n TRP 199 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 2wh2 n GLU 200 N -1.18 0.00 -0.21 5.87 4.07 -0.72 -3.26 120.64 125.21 2wh2 n GLU 200 Ca 0.00 0.34 0.31 0.00 -0.06 0.00 0.00 57.16 57.75 2wh2 n GLU 200 Cb 0.06 -0.83 0.71 0.00 -0.06 0.00 0.00 31.44 31.32 2wh2 n GLU 200 CO 0.00 0.00 0.00 -0.24 -0.06 0.00 0.00 177.13 176.83 2wh2 h VAL 201 N 0.00 0.34 -0.62 6.31 3.04 -0.99 0.56 116.25 124.90 2wh2 h VAL 201 Ca 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.61 2wh2 h VAL 201 Cb 0.00 0.41 -0.02 0.00 -2.01 0.00 0.00 31.29 29.67 2wh2 h VAL 201 CO 0.00 0.00 0.09 0.15 -1.01 0.00 0.00 177.57 176.80 2wh2 h PHE 202 N 0.00 1.10 0.80 3.17 3.57 -0.54 -1.29 116.94 123.74 2wh2 h PHE 202 Ca 0.47 -0.16 -0.04 0.00 3.53 0.00 0.00 57.97 61.77 2wh2 h PHE 202 Cb 2.07 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 40.52 2wh2 h PHE 202 CO 0.00 0.95 -0.38 1.96 -2.23 0.00 0.00 178.31 178.60 2wh2 h GLN 203 N 0.94 -1.03 -0.13 1.11 1.08 0.14 -2.75 115.11 114.46 2wh2 h GLN 203 Ca 0.19 0.07 0.04 0.00 -1.45 0.00 0.00 58.65 57.49 2wh2 h GLN 203 Cb 0.45 0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 28.11 2wh2 h GLN 203 CO 0.01 -0.69 0.43 -0.91 -0.95 0.00 0.00 178.83 176.72 2wh2 h ASN 204 N -1.23 0.00 1.49 1.46 2.35 -1.42 0.38 115.58 118.61 2wh2 h ASN 204 Ca -0.11 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.57 2wh2 h ASN 204 Cb 0.82 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 2wh2 h ASN 204 CO 0.18 0.00 -0.33 -0.09 -1.65 0.00 0.00 177.43 175.54 2wh2 h ARG 205 N 0.00 0.00 0.00 0.81 2.43 -0.93 -3.28 114.38 113.40 2wh2 h ARG 205 Ca 0.06 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2wh2 h ARG 205 Cb 0.92 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 2wh2 h ARG 205 CO -0.00 0.33 -0.19 0.44 -1.51 0.00 0.00 179.97 179.04 2wh2 n ILE 206 N -3.23 1.39 -2.54 1.20 -5.35 0.11 -4.93 119.36 106.02 2wh2 n ILE 206 Ca 0.02 -1.74 -0.43 0.00 -0.27 0.00 0.00 62.75 60.33 2wh2 n ILE 206 Cb 0.62 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.50 2wh2 n ILE 206 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wh2 n GLY 207 N -1.01 4.49 0.00 3.28 0.00 -0.01 -5.05 105.19 106.89 2wh2 n GLY 207 Ca 0.12 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 44.00 2wh2 n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93