#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wuu s ALA 3 N 0.00 3.52 0.31 0.00 0.00 -1.26 -4.83 121.76 119.50 1wuu s ALA 3 Ca 0.00 -0.83 -0.29 0.00 0.00 0.00 0.00 51.96 50.84 1wuu s ALA 3 Cb 0.00 -1.58 -0.13 0.00 0.00 0.00 0.00 23.12 21.41 1wuu s ALA 3 CO 0.00 0.65 1.32 -0.11 0.00 0.00 0.00 175.76 177.62 1wuu n LEU 4 N 1.55 3.43 -4.67 0.00 7.94 -1.22 -4.94 117.00 119.09 1wuu n LEU 4 Ca -0.15 1.19 -0.37 0.00 -1.11 0.00 0.00 56.01 55.57 1wuu n LEU 4 Cb 0.53 -1.47 -0.09 0.00 0.53 0.00 0.00 43.42 42.92 1wuu n LEU 4 CO 0.34 -0.48 -0.12 0.00 -1.11 0.00 0.00 177.39 176.02 1wuu s ARG 5 N -1.47 4.12 -0.25 1.96 1.70 -1.26 -4.73 118.95 119.02 1wuu s ARG 5 Ca 0.59 -0.16 -0.23 0.00 -0.47 0.00 0.00 55.73 55.46 1wuu s ARG 5 Cb -0.59 -3.52 -0.01 0.00 -0.57 0.00 0.00 34.95 30.27 1wuu s ARG 5 CO 0.59 0.08 0.78 -0.65 -1.08 0.00 0.00 175.30 175.02 1wuu s GLN 6 N 0.98 4.16 0.49 3.89 -0.21 -1.26 -5.01 119.66 122.70 1wuu s GLN 6 Ca 0.10 0.84 -0.20 0.00 0.02 0.00 0.00 55.36 56.12 1wuu s GLN 6 Cb -0.13 -3.65 -0.11 0.00 1.00 0.00 0.00 33.01 30.11 1wuu s GLN 6 CO 0.04 -0.50 0.45 -2.30 -2.12 0.00 0.00 175.29 170.86 1wuu n PRO 7 N 5.94 0.47 -3.66 2.91 -0.02 -1.26 -4.94 135.00 134.45 1wuu n PRO 7 Ca 0.04 0.18 -0.28 0.00 -2.02 0.00 0.00 63.50 61.42 1wuu n PRO 7 Cb 0.48 -1.52 -0.03 0.00 -0.02 0.00 0.00 33.50 32.41 1wuu n PRO 7 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1wuu s GLN 8 N -1.71 3.54 0.16 -0.52 -0.21 -1.26 -4.89 119.66 114.77 1wuu s GLN 8 Ca 0.65 -0.29 -0.26 0.00 0.02 0.00 0.00 55.36 55.47 1wuu s GLN 8 Cb -0.52 -2.82 -0.02 0.00 1.00 0.00 0.00 33.01 30.65 1wuu s GLN 8 CO 0.58 0.39 1.42 0.28 -2.12 0.00 0.00 175.29 175.84 1wuu n VAL 9 N -0.63 -0.60 0.00 1.09 0.31 -1.26 -1.60 118.33 115.63 1wuu n VAL 9 Ca -0.04 2.22 0.00 0.00 -0.01 0.00 0.00 64.34 66.51 1wuu n VAL 9 Cb 0.54 -2.77 0.00 0.00 -0.91 0.00 0.00 33.84 30.69 1wuu n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wuu n ALA 10 N -3.34 0.00 -0.16 3.52 0.00 -1.26 0.14 120.51 119.41 1wuu n ALA 10 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.38 1wuu n ALA 10 Cb 0.26 0.11 -0.04 0.00 0.00 0.00 0.00 19.45 19.78 1wuu n ALA 10 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1wuu h GLU 11 N 0.00 -0.27 -0.27 0.00 5.08 -1.68 -0.98 114.58 116.47 1wuu h GLU 11 Ca 0.00 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 1wuu h GLU 11 Cb 0.00 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 1wuu h GLU 11 CO 0.00 -0.18 -0.01 -0.07 -1.00 0.00 0.00 179.01 177.75 1wuu h LEU 12 N -0.28 -0.13 0.00 1.33 3.38 0.57 -2.08 115.31 118.10 1wuu h LEU 12 Ca 0.16 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1wuu h LEU 12 Cb 0.57 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1wuu h LEU 12 CO -0.62 -0.03 0.00 -0.11 0.09 0.00 0.00 178.44 177.77 1wuu n LEU 13 N -5.17 0.00 -0.33 1.67 7.94 0.38 -0.64 117.00 120.84 1wuu n LEU 13 Ca -0.01 0.75 -0.06 0.00 -1.11 0.00 0.00 56.01 55.59 1wuu n LEU 13 Cb 0.14 -0.25 -0.03 0.00 0.53 0.00 0.00 43.42 43.81 1wuu n LEU 13 CO 0.24 -0.25 0.43 0.00 -1.11 0.00 0.00 177.39 176.70 1wuu n ALA 14 N -1.80 -0.34 -0.28 1.96 0.00 -0.47 0.30 120.51 119.89 1wuu n ALA 14 Ca 0.00 0.75 0.09 0.00 0.00 0.00 0.00 53.44 54.28 1wuu n ALA 14 Cb 0.00 -0.22 0.23 0.00 0.00 0.00 0.00 19.45 19.46 1wuu n ALA 14 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1wuu h GLU 15 N 0.00 0.23 0.46 0.00 5.08 -1.08 0.71 114.58 119.98 1wuu h GLU 15 Ca 0.20 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1wuu h GLU 15 Cb 0.40 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1wuu h GLU 15 CO -0.79 0.15 -0.27 0.00 -1.00 0.00 0.00 179.01 177.10 1wuu h ALA 16 N 1.70 -0.69 -0.14 3.43 0.00 0.71 -2.41 119.26 121.85 1wuu h ALA 16 Ca 0.48 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.27 1wuu h ALA 16 Cb 0.90 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1wuu h ALA 16 CO -0.59 -0.90 -0.08 -2.13 0.00 0.00 0.00 179.25 175.55 1wuu n ARG 17 N -5.41 -0.06 0.00 0.00 0.63 0.25 -2.08 116.66 109.99 1wuu n ARG 17 Ca -0.11 0.99 0.00 0.00 -0.92 0.00 0.00 57.85 57.81 1wuu n ARG 17 Cb 0.31 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 31.74 1wuu n ARG 17 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1wuu n ARG 18 N -3.26 0.00 -0.52 -0.14 3.00 0.18 -0.27 116.66 115.65 1wuu n ARG 18 Ca 0.00 0.20 0.44 0.00 -0.01 0.00 0.00 57.85 58.48 1wuu n ARG 18 Cb 0.04 -0.55 0.77 0.00 0.00 0.00 0.00 32.46 32.72 1wuu n ARG 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1wuu h ALA 19 N -1.67 3.41 0.33 7.54 0.00 -1.36 0.96 119.26 128.47 1wuu h ALA 19 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1wuu h ALA 19 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1wuu h ALA 19 CO 0.00 -1.89 -0.16 0.35 0.00 0.00 0.00 179.25 177.55 1wuu h PHE 20 N 0.02 -0.41 -0.61 0.00 3.57 -0.20 0.61 116.94 119.92 1wuu h PHE 20 Ca 0.77 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 62.38 1wuu h PHE 20 Cb 2.99 0.14 -0.12 0.00 2.79 0.00 0.00 35.95 41.75 1wuu h PHE 20 CO -0.00 -0.16 -0.24 -0.09 -2.23 0.00 0.00 178.31 175.59 1wuu h ARG 21 N -1.06 -0.08 0.00 1.11 9.65 0.38 0.37 114.38 124.75 1wuu h ARG 21 Ca -0.05 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1wuu h ARG 21 Cb 0.43 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.03 1wuu h ARG 21 CO 0.07 -0.05 0.00 0.39 2.80 0.00 0.00 179.97 183.18 1wuu n GLU 22 N -5.44 0.00 0.26 0.20 1.02 0.24 -0.49 120.64 116.42 1wuu n GLU 22 Ca 0.06 0.35 0.18 0.00 -0.02 0.00 0.00 57.16 57.73 1wuu n GLU 22 Cb 0.35 -0.95 0.86 0.00 -0.02 0.00 0.00 31.44 31.67 1wuu n GLU 22 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1wuu h GLU 23 N 0.00 0.00 0.00 3.49 4.57 0.57 -2.92 114.58 120.29 1wuu h GLU 23 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1wuu h GLU 23 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1wuu h GLU 23 CO 0.00 0.00 0.00 1.19 -1.18 0.00 0.00 179.01 179.02 1wuu n PHE 24 N -3.28 0.00 -1.01 0.92 3.72 0.13 -4.98 117.46 112.96 1wuu n PHE 24 Ca 0.01 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1wuu n PHE 24 Cb 0.38 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.92 1wuu n PHE 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wuu n GLY 25 N 0.00 0.29 3.48 1.37 0.00 0.35 -4.98 105.19 105.71 1wuu n GLY 25 Ca 0.00 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1wuu n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wuu s ALA 26 N -1.56 0.18 -0.09 4.61 0.00 -1.11 -4.99 121.76 118.80 1wuu s ALA 26 Ca 0.00 -1.12 -0.25 0.00 0.00 0.00 0.00 51.96 50.58 1wuu s ALA 26 Cb 0.00 1.16 -0.03 0.00 0.00 0.00 0.00 23.12 24.25 1wuu s ALA 26 CO 0.00 -0.78 0.80 -1.21 0.00 0.00 0.00 175.76 174.57 1wuu s GLU 27 N -4.02 4.42 0.43 0.00 8.01 -1.26 -2.71 118.70 123.56 1wuu s GLU 27 Ca 0.27 1.03 -0.25 0.00 0.01 0.00 0.00 54.97 56.03 1wuu s GLU 27 Cb 0.01 -3.49 -0.09 0.00 -4.31 0.00 0.00 34.13 26.25 1wuu s GLU 27 CO 0.10 -0.08 1.33 -0.35 0.01 0.00 0.00 175.26 176.27 1wuu n PRO 28 N 4.26 2.05 -0.03 0.39 -0.05 -1.26 -4.97 135.00 135.39 1wuu n PRO 28 Ca 0.02 0.73 -0.22 0.00 -0.05 0.00 0.00 63.50 63.98 1wuu n PRO 28 Cb 0.50 -2.47 -0.13 0.00 -0.05 0.00 0.00 33.50 31.35 1wuu n PRO 28 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 175.50 173.54 1wuu n GLU 29 N -0.03 0.70 -4.49 0.54 2.13 -0.28 -4.97 120.64 114.24 1wuu n GLU 29 Ca 0.06 0.34 -0.27 0.00 0.66 0.00 0.00 57.16 57.95 1wuu n GLU 29 Cb 0.40 -1.70 -0.13 0.00 0.27 0.00 0.00 31.44 30.27 1wuu n GLU 29 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1wuu s LEU 30 N -7.24 2.26 -0.09 4.31 1.43 0.39 -4.88 118.68 114.86 1wuu s LEU 30 Ca -0.25 -0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 52.10 1wuu s LEU 30 Cb 0.07 -1.08 0.02 0.00 0.03 0.00 0.00 46.19 45.23 1wuu s LEU 30 CO 0.71 0.15 0.26 0.00 0.23 0.00 0.00 176.35 177.70 1wuu s ALA 31 N -1.00 -0.64 -0.09 4.21 0.00 -1.25 0.14 121.76 123.14 1wuu s ALA 31 Ca 0.10 0.69 -0.28 0.00 0.00 0.00 0.00 51.96 52.47 1wuu s ALA 31 Cb -0.10 -0.39 0.06 0.00 0.00 0.00 0.00 23.12 22.70 1wuu s ALA 31 CO 0.04 -0.13 0.64 0.14 0.00 0.00 0.00 175.76 176.45 1wuu s VAL 32 N 0.04 0.01 0.09 0.00 -7.23 0.12 -0.54 120.40 112.89 1wuu s VAL 32 Ca -0.01 -0.05 0.07 0.00 -1.81 0.00 0.00 61.98 60.18 1wuu s VAL 32 Cb -0.02 -0.95 -0.03 0.00 0.56 0.00 0.00 36.38 35.94 1wuu s VAL 32 CO 0.01 -0.03 -0.18 -0.94 -0.31 0.00 0.00 175.10 173.64 1wuu s SER 33 N -0.90 2.20 -0.06 4.85 1.04 -1.09 0.03 113.70 119.77 1wuu s SER 33 Ca -0.09 -0.65 -0.01 0.00 0.48 0.00 0.00 55.95 55.67 1wuu s SER 33 Cb -0.01 -0.11 0.03 0.00 0.10 0.00 0.00 66.02 66.03 1wuu s SER 33 CO 0.08 0.01 0.01 0.00 0.98 0.00 0.00 173.24 174.32 1wuu s ALA 34 N -1.19 0.60 0.89 5.32 0.00 0.12 -2.16 121.76 125.34 1wuu s ALA 34 Ca 0.03 -0.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.82 1wuu s ALA 34 Cb -0.10 -0.72 0.13 0.00 0.00 0.00 0.00 23.12 22.43 1wuu s ALA 34 CO 0.03 -0.46 1.09 -1.25 0.00 0.00 0.00 175.76 175.17 1wuu s PRO 35 N 2.01 1.27 0.00 0.00 0.04 -1.26 0.80 135.00 137.86 1wuu s PRO 35 Ca 0.05 0.75 0.00 0.00 0.04 0.00 0.00 61.00 61.84 1wuu s PRO 35 Cb -0.12 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1wuu s PRO 35 CO -0.05 -2.21 0.00 0.41 0.04 0.00 0.00 177.00 175.19 1wuu n GLY 36 N -1.29 1.17 3.58 0.56 0.00 0.34 -4.15 105.19 105.41 1wuu n GLY 36 Ca 0.07 -1.97 -0.15 0.00 0.00 0.00 0.00 46.02 43.97 1wuu n GLY 36 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1wuu s ARG 37 N 0.26 0.90 -0.12 1.61 1.04 0.31 -1.77 118.95 121.18 1wuu s ARG 37 Ca 0.00 0.62 -0.01 0.00 -1.04 0.00 0.00 55.73 55.30 1wuu s ARG 37 Cb 0.00 0.43 -0.02 0.00 -2.04 0.00 0.00 34.95 33.32 1wuu s ARG 37 CO 0.00 -0.20 -0.08 0.54 -0.04 0.00 0.00 175.30 175.52 1wuu s VAL 38 N -0.36 3.50 -0.34 4.99 0.11 -1.26 -4.04 120.40 122.99 1wuu s VAL 38 Ca -0.04 -0.52 -0.13 0.00 -2.93 0.00 0.00 61.98 58.36 1wuu s VAL 38 Cb -0.03 -2.48 -0.02 0.00 -1.53 0.00 0.00 36.38 32.33 1wuu s VAL 38 CO 0.04 0.53 0.27 0.21 -3.33 0.00 0.00 175.10 172.83 1wuu s ASN 39 N 0.05 6.09 0.39 3.54 3.04 -1.26 -4.44 114.94 122.35 1wuu s ASN 39 Ca -0.02 -0.37 0.10 0.00 0.04 0.00 0.00 52.86 52.61 1wuu s ASN 39 Cb -0.14 -2.15 0.78 0.00 -1.54 0.00 0.00 41.25 38.20 1wuu s ASN 39 CO 0.03 -0.26 1.90 -0.07 -3.04 0.00 0.00 177.10 175.67 1wuu h LEU 40 N 8.56 0.19 -7.15 3.21 3.38 -0.30 -3.45 115.31 119.75 1wuu h LEU 40 Ca -0.31 -0.04 0.36 0.00 0.09 0.00 0.00 57.88 57.98 1wuu h LEU 40 Cb 1.15 -0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.73 1wuu h LEU 40 CO 0.65 0.38 0.90 -0.51 0.09 0.00 0.00 178.44 179.95 1wuu s ILE 41 N -4.65 0.00 0.00 1.22 2.07 -1.20 -4.99 121.20 113.65 1wuu s ILE 41 Ca -0.05 -0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.06 1wuu s ILE 41 Cb 0.15 -2.03 0.00 0.00 0.13 0.00 0.00 42.46 40.71 1wuu s ILE 41 CO 0.73 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 174.37 1wuu n GLY 42 N -0.51 0.77 3.74 1.50 0.00 -1.26 -0.51 105.19 108.92 1wuu n GLY 42 Ca -0.09 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 1wuu n GLY 42 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wuu s GLU 43 N -2.26 4.35 -1.38 1.61 2.56 -1.26 -3.87 118.70 118.45 1wuu s GLU 43 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 54.97 55.68 1wuu s GLU 43 Cb 0.00 -3.39 0.00 0.00 2.00 0.00 0.00 34.13 32.74 1wuu s GLU 43 CO 0.00 0.24 0.00 0.72 -0.56 0.00 0.00 175.26 175.66 1wuu n HIS 44 N 3.22 -0.30 0.57 5.30 8.25 -1.26 -4.87 115.22 126.12 1wuu n HIS 44 Ca -0.05 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.48 1wuu n HIS 44 Cb 0.51 -2.76 -0.09 0.00 1.12 0.00 0.00 29.99 28.78 1wuu n HIS 44 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1wuu n THR 45 N -3.23 0.00 -0.03 1.59 -2.24 -1.25 -4.67 114.28 104.46 1wuu n THR 45 Ca -0.15 -0.19 -0.11 0.00 -2.27 0.00 0.00 64.05 61.33 1wuu n THR 45 Cb 0.54 0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 69.58 1wuu n THR 45 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1wuu h ASP 46 N 0.00 0.19 -0.43 3.42 3.04 -1.89 0.14 116.42 120.89 1wuu h ASP 46 Ca 0.00 -0.07 -0.26 0.00 -3.24 0.00 0.00 57.03 53.47 1wuu h ASP 46 Cb 0.40 -0.05 -0.13 0.00 -1.04 0.00 0.00 39.33 38.51 1wuu h ASP 46 CO 0.00 0.20 0.33 0.00 -2.04 0.00 0.00 179.24 177.73 1wuu n TYR 47 N -4.94 1.36 -1.13 4.15 0.18 -1.26 -2.78 117.16 112.73 1wuu n TYR 47 Ca -0.04 -1.50 0.00 0.00 1.88 0.00 0.00 57.90 58.24 1wuu n TYR 47 Cb 0.06 -0.74 0.00 0.00 -0.38 0.00 0.00 39.34 38.28 1wuu n TYR 47 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 1wuu n ASN 48 N 0.14 0.00 -3.57 9.48 3.02 -1.11 -4.93 115.26 118.29 1wuu n ASN 48 Ca 0.26 -1.00 -0.21 0.00 -0.03 0.00 0.00 54.58 53.60 1wuu n ASN 48 Cb 0.78 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 40.02 1wuu n ASN 48 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wuu n GLN 49 N 0.00 -6.67 0.00 3.52 6.02 -1.12 -1.79 117.38 117.34 1wuu n GLN 49 Ca 0.00 0.78 0.00 0.00 -0.01 0.00 0.00 57.00 57.77 1wuu n GLN 49 Cb 0.39 -5.73 0.00 0.00 1.02 0.00 0.00 30.24 25.92 1wuu n GLN 49 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1wuu n GLY 50 N -1.53 1.33 3.09 1.08 0.00 0.47 -3.86 105.19 105.77 1wuu n GLY 50 Ca -0.17 -1.61 -0.23 0.00 0.00 0.00 0.00 46.02 44.02 1wuu n GLY 50 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wuu s LEU 51 N 0.00 1.95 0.23 0.99 1.43 -1.26 -1.05 118.68 120.97 1wuu s LEU 51 Ca 0.00 -0.26 0.06 0.00 -1.03 0.00 0.00 54.13 52.89 1wuu s LEU 51 Cb 0.00 -0.75 -0.05 0.00 0.03 0.00 0.00 46.19 45.42 1wuu s LEU 51 CO 0.00 0.15 -0.06 0.68 0.23 0.00 0.00 176.35 177.34 1wuu s VAL 52 N -0.15 1.41 -0.51 -1.59 -7.23 -0.99 -4.44 120.40 106.90 1wuu s VAL 52 Ca 0.02 -2.10 0.05 0.00 -1.81 0.00 0.00 61.98 58.13 1wuu s VAL 52 Cb -0.07 -2.25 0.18 0.00 0.56 0.00 0.00 36.38 34.79 1wuu s VAL 52 CO 0.00 -0.43 0.43 -0.11 -0.31 0.00 0.00 175.10 174.68 1wuu n LEU 53 N -0.44 0.89 0.00 1.32 7.94 0.33 -2.20 117.00 124.84 1wuu n LEU 53 Ca -0.06 -4.72 0.00 0.00 -1.11 0.00 0.00 56.01 50.11 1wuu n LEU 53 Cb 0.63 0.09 0.00 0.00 0.53 0.00 0.00 43.42 44.66 1wuu n LEU 53 CO 0.37 1.86 0.00 -0.81 -1.11 0.00 0.00 177.39 177.70 1wuu n PRO 54 N 2.32 2.64 -4.27 1.96 -0.04 -1.14 0.51 135.00 136.97 1wuu n PRO 54 Ca 0.26 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.46 1wuu n PRO 54 Cb 0.44 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.82 1wuu n PRO 54 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wuu s ALA 56 N -2.00 3.06 0.33 0.55 0.00 -1.26 0.16 121.76 122.61 1wuu s ALA 56 Ca 0.00 -1.49 0.07 0.00 0.00 0.00 0.00 51.96 50.53 1wuu s ALA 56 Cb 0.00 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 1wuu s ALA 56 CO 0.00 0.42 0.39 -0.51 0.00 0.00 0.00 175.76 176.05 1wuu s LEU 57 N -3.08 3.80 0.00 0.00 1.43 -0.73 -1.91 118.68 118.19 1wuu s LEU 57 Ca 0.27 -0.33 0.23 0.00 -1.03 0.00 0.00 54.13 53.27 1wuu s LEU 57 Cb -0.08 -2.50 0.96 0.00 0.03 0.00 0.00 46.19 44.60 1wuu s LEU 57 CO 0.17 -0.39 1.67 -0.62 0.23 0.00 0.00 176.35 177.41 1wuu n GLU 58 N -1.51 1.54 -3.50 1.70 1.02 -1.26 -4.29 120.64 114.34 1wuu n GLU 58 Ca -0.01 -0.80 -0.37 0.00 -0.02 0.00 0.00 57.16 55.95 1wuu n GLU 58 Cb 0.59 -1.40 -0.06 0.00 -0.02 0.00 0.00 31.44 30.54 1wuu n GLU 58 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1wuu s LEU 59 N -1.70 4.37 -0.02 -4.62 1.43 -1.26 -4.84 118.68 112.04 1wuu s LEU 59 Ca 0.34 0.78 0.04 0.00 -1.03 0.00 0.00 54.13 54.27 1wuu s LEU 59 Cb 0.18 -2.51 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 1wuu s LEU 59 CO 0.28 0.21 -0.15 -0.89 0.23 0.00 0.00 176.35 176.03 1wuu s THR 61 N -0.34 1.20 -0.01 5.49 2.01 0.24 0.13 115.64 124.35 1wuu s THR 61 Ca 0.22 -0.63 0.06 0.00 0.31 0.00 0.00 61.69 61.64 1wuu s THR 61 Cb -0.15 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 1wuu s THR 61 CO 0.10 0.34 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.49 1wuu s VAL 62 N -0.21 2.71 -0.16 3.82 1.01 0.36 0.14 120.40 128.06 1wuu s VAL 62 Ca 0.03 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 60.99 1wuu s VAL 62 Cb -0.07 -2.06 0.06 0.00 0.00 0.00 0.00 36.38 34.30 1wuu s VAL 62 CO 0.00 0.50 0.06 -0.22 0.00 0.00 0.00 175.10 175.44 1wuu s LEU 63 N -0.94 0.71 -0.18 3.92 0.20 0.11 -0.03 118.68 122.45 1wuu s LEU 63 Ca 0.12 -0.61 -0.01 0.00 0.69 0.00 0.00 54.13 54.33 1wuu s LEU 63 Cb -0.10 -0.40 0.01 0.00 -0.43 0.00 0.00 46.19 45.26 1wuu s LEU 63 CO 0.02 -0.31 -0.14 0.68 -0.29 0.00 0.00 176.35 176.30 1wuu s VAL 64 N 2.01 2.58 0.00 1.68 -7.23 -1.04 0.16 120.40 118.56 1wuu s VAL 64 Ca 0.01 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.41 1wuu s VAL 64 Cb -0.16 -2.11 0.00 0.00 0.56 0.00 0.00 36.38 34.67 1wuu s VAL 64 CO -0.08 0.50 0.00 0.61 -0.31 0.00 0.00 175.10 175.82 1wuu n GLY 65 N 4.53 2.92 3.42 2.32 0.00 0.38 -1.00 105.19 117.76 1wuu n GLY 65 Ca -0.20 -1.18 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 1wuu n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wuu s SER 66 N -0.42 -0.53 0.87 1.61 0.01 0.14 0.15 113.70 115.54 1wuu s SER 66 Ca 0.00 0.13 -0.12 0.00 1.31 0.00 0.00 55.95 57.28 1wuu s SER 66 Cb 0.00 0.55 0.11 0.00 0.21 0.00 0.00 66.02 66.90 1wuu s SER 66 CO 0.00 -0.84 1.10 -2.84 0.41 0.00 0.00 173.24 171.07 1wuu s PRO 67 N -3.03 1.48 -0.25 12.44 0.02 -1.26 -0.61 135.00 143.79 1wuu s PRO 67 Ca -0.02 0.62 -0.04 0.00 0.02 0.00 0.00 61.00 61.58 1wuu s PRO 67 Cb -0.00 -1.85 0.08 0.00 0.02 0.00 0.00 34.50 32.75 1wuu s PRO 67 CO -0.06 -2.03 0.10 1.03 -0.33 0.00 0.00 177.00 175.70 1wuu s ARG 68 N -5.09 0.30 0.55 5.54 0.52 -0.84 -4.67 118.95 115.27 1wuu s ARG 68 Ca 0.63 -0.48 0.23 0.00 -0.52 0.00 0.00 55.73 55.59 1wuu s ARG 68 Cb -0.16 -1.60 1.49 0.00 0.52 0.00 0.00 34.95 35.20 1wuu s ARG 68 CO 0.55 -0.87 2.14 0.87 0.02 0.00 0.00 175.30 178.01 1wuu h LYS 69 N 8.34 0.00 -1.28 3.54 6.56 -1.96 -0.07 116.57 131.69 1wuu h LYS 69 Ca -0.17 0.00 0.41 0.00 -1.06 0.00 0.00 60.65 59.82 1wuu h LYS 69 Cb 1.06 0.00 -0.12 0.00 -0.57 0.00 0.00 32.23 32.61 1wuu h LYS 69 CO 0.39 0.00 0.83 -0.44 -2.06 0.00 0.00 179.45 178.17 1wuu h ASP 70 N 0.00 0.26 0.00 0.86 3.32 -1.97 -3.46 116.42 115.44 1wuu h ASP 70 Ca 0.06 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1wuu h ASP 70 Cb 0.27 0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1wuu h ASP 70 CO -0.00 -0.13 0.00 0.61 -1.72 0.00 0.00 179.24 178.00 1wuu n GLY 71 N -1.53 0.76 2.72 2.75 0.00 -0.06 -5.05 105.19 104.78 1wuu n GLY 71 Ca 0.35 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.13 1wuu n GLY 71 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wuu n LEU 72 N 0.00 0.00 -3.94 0.99 4.77 -1.26 -4.27 117.00 113.29 1wuu n LEU 72 Ca 0.00 -2.41 -0.30 0.00 -0.03 0.00 0.00 56.01 53.28 1wuu n LEU 72 Cb 0.00 0.35 -0.16 0.00 -2.33 0.00 0.00 43.42 41.28 1wuu n LEU 72 CO 0.00 -0.35 -0.43 -0.69 -1.33 0.00 0.00 177.39 174.59 1wuu s VAL 73 N -2.44 1.41 -0.09 4.08 1.01 -0.90 0.12 120.40 123.58 1wuu s VAL 73 Ca 0.03 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1wuu s VAL 73 Cb 0.00 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.81 1wuu s VAL 73 CO 0.02 0.06 -0.12 -0.94 0.00 0.00 0.00 175.10 174.13 1wuu s SER 74 N 1.48 2.09 0.42 3.32 1.04 0.85 -1.73 113.70 121.17 1wuu s SER 74 Ca -0.02 -0.34 0.03 0.00 0.48 0.00 0.00 55.95 56.11 1wuu s SER 74 Cb -0.17 -0.91 -0.01 0.00 0.10 0.00 0.00 66.02 65.04 1wuu s SER 74 CO -0.07 -0.02 0.12 0.18 0.98 0.00 0.00 173.24 174.42 1wuu n LEU 75 N 4.29 0.00 -3.64 2.42 4.77 -1.22 -2.44 117.00 121.18 1wuu n LEU 75 Ca -0.19 -3.07 -0.03 0.00 -0.03 0.00 0.00 56.01 52.69 1wuu n LEU 75 Cb 0.51 0.90 -0.07 0.00 -2.33 0.00 0.00 43.42 42.44 1wuu n LEU 75 CO 0.22 -0.47 0.72 -0.22 -1.33 0.00 0.00 177.39 176.32 1wuu s LEU 76 N 0.00 -0.46 0.04 2.23 2.96 -1.10 -2.74 118.68 119.62 1wuu s LEU 76 Ca 0.17 0.75 0.01 0.00 -0.22 0.00 0.00 54.13 54.84 1wuu s LEU 76 Cb 0.01 1.70 -0.04 0.00 0.50 0.00 0.00 46.19 48.36 1wuu s LEU 76 CO 0.12 -0.12 0.11 -0.89 -1.32 0.00 0.00 176.35 174.25 1wuu s THR 77 N 1.11 4.84 -0.29 3.68 2.01 -0.30 -1.57 115.64 125.13 1wuu s THR 77 Ca -0.07 -0.53 0.23 0.00 0.31 0.00 0.00 61.69 61.63 1wuu s THR 77 Cb -0.04 -3.29 0.04 0.00 0.01 0.00 0.00 72.50 69.22 1wuu s THR 77 CO -0.13 0.22 1.12 0.74 -0.69 0.00 0.00 174.62 175.88 1wuu h THR 78 N 2.70 0.00 -3.20 -0.82 2.02 -1.56 -3.47 112.91 108.58 1wuu h THR 78 Ca -0.47 -0.96 -0.54 0.00 0.77 0.00 0.00 66.41 65.21 1wuu h THR 78 Cb 1.17 1.52 -0.00 0.00 -1.74 0.00 0.00 68.15 69.10 1wuu h THR 78 CO 0.67 0.00 0.56 -0.44 0.37 0.00 0.00 175.52 176.68 1wuu s SER 79 N -5.37 7.11 0.29 4.18 0.01 -1.26 -4.91 113.70 113.74 1wuu s SER 79 Ca 0.01 1.94 0.15 0.00 1.31 0.00 0.00 55.95 59.36 1wuu s SER 79 Cb 0.09 -2.57 0.30 0.00 0.21 0.00 0.00 66.02 64.05 1wuu s SER 79 CO 0.77 -0.47 1.55 -0.33 0.41 0.00 0.00 173.24 175.18 1wuu h GLU 80 N 6.92 0.00 0.00 12.44 5.08 -2.00 -2.80 114.58 134.23 1wuu h GLU 80 Ca -0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1wuu h GLU 80 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1wuu h GLU 80 CO 0.82 0.54 0.00 0.41 -1.00 0.00 0.00 179.01 179.77 1wuu n GLY 81 N 0.76 -0.69 3.95 -3.84 0.00 -1.26 -4.80 105.19 99.31 1wuu n GLY 81 Ca 0.00 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1wuu n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wuu s ALA 82 N -2.00 3.25 0.27 4.61 0.00 -1.06 -4.96 121.76 121.88 1wuu s ALA 82 Ca 0.15 -1.22 -0.29 0.00 0.00 0.00 0.00 51.96 50.59 1wuu s ALA 82 Cb 0.07 -2.41 -0.10 0.00 0.00 0.00 0.00 23.12 20.68 1wuu s ALA 82 CO 0.12 -1.44 1.26 0.34 0.00 0.00 0.00 175.76 176.04 1wuu s ASP 83 N -4.62 6.92 -0.19 0.00 2.15 -1.26 -5.02 116.67 114.65 1wuu s ASP 83 Ca 0.63 2.50 -0.18 0.00 0.43 0.00 0.00 52.55 55.93 1wuu s ASP 83 Cb -0.08 -2.63 -0.03 0.00 -0.30 0.00 0.00 42.92 39.87 1wuu s ASP 83 CO 0.45 -0.45 0.51 -0.70 -0.17 0.00 0.00 175.17 174.82 1wuu s GLU 84 N -1.13 4.20 0.47 4.34 2.12 -1.26 -3.53 118.70 123.90 1wuu s GLU 84 Ca 0.51 0.41 -0.12 0.00 0.36 0.00 0.00 54.97 56.13 1wuu s GLU 84 Cb -0.37 -3.55 -0.06 0.00 0.26 0.00 0.00 34.13 30.41 1wuu s GLU 84 CO 0.45 -0.13 0.87 -1.25 -0.54 0.00 0.00 175.26 174.66 1wuu s PRO 85 N 1.57 3.77 0.00 4.30 0.04 -1.26 -4.70 135.00 138.72 1wuu s PRO 85 Ca 0.24 0.61 0.29 0.00 0.04 0.00 0.00 61.00 62.17 1wuu s PRO 85 Cb -0.15 -2.28 1.20 0.00 0.04 0.00 0.00 34.50 33.31 1wuu s PRO 85 CO 0.10 -0.19 1.85 1.04 0.04 0.00 0.00 177.00 179.84 1wuu n GLN 86 N -1.69 0.45 -5.06 4.56 6.02 -1.23 -4.73 117.38 115.71 1wuu n GLN 86 Ca 0.04 -0.13 -0.30 0.00 -0.01 0.00 0.00 57.00 56.60 1wuu n GLN 86 Cb 0.54 -1.50 -0.17 0.00 1.02 0.00 0.00 30.24 30.14 1wuu n GLN 86 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1wuu s ARG 87 N -2.64 2.51 -0.33 -1.09 0.52 -1.26 -1.15 118.95 115.52 1wuu s ARG 87 Ca 0.24 -0.76 0.01 0.00 -0.52 0.00 0.00 55.73 54.70 1wuu s ARG 87 Cb 0.20 -2.00 0.14 0.00 0.52 0.00 0.00 34.95 33.81 1wuu s ARG 87 CO 0.51 0.20 0.33 -1.17 0.02 0.00 0.00 175.30 175.19 1wuu s LEU 88 N 0.25 -0.10 0.39 2.53 0.20 -1.11 -4.98 118.68 115.86 1wuu s LEU 88 Ca -0.13 -1.19 -0.10 0.00 0.69 0.00 0.00 54.13 53.41 1wuu s LEU 88 Cb -0.16 0.49 -0.06 0.00 -0.43 0.00 0.00 46.19 46.03 1wuu s LEU 88 CO 0.06 -0.33 0.74 -1.10 -0.29 0.00 0.00 176.35 175.43 1wuu s GLN 89 N 1.89 3.75 -0.12 1.98 1.11 -1.26 -3.43 119.66 123.59 1wuu s GLN 89 Ca 0.13 0.40 -0.33 0.00 0.01 0.00 0.00 55.36 55.57 1wuu s GLN 89 Cb -0.15 -2.42 0.13 0.00 -1.01 0.00 0.00 33.01 29.56 1wuu s GLN 89 CO -0.18 -0.01 1.27 -0.59 0.01 0.00 0.00 175.29 175.78 1wuu s PHE 90 N -2.34 -0.08 -0.15 0.91 -0.12 -0.70 -5.00 117.98 110.50 1wuu s PHE 90 Ca 0.50 0.01 -0.21 0.00 -0.05 0.00 0.00 56.93 57.18 1wuu s PHE 90 Cb -0.10 0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 1wuu s PHE 90 CO 0.31 -0.21 0.61 -2.14 -0.05 0.00 0.00 175.22 173.74 1wuu s PRO 91 N -2.37 4.30 0.32 1.99 0.02 -1.26 -2.13 135.00 135.86 1wuu s PRO 91 Ca 0.12 0.64 -0.23 0.00 0.02 0.00 0.00 61.00 61.55 1wuu s PRO 91 Cb 0.02 -3.51 -0.15 0.00 0.02 0.00 0.00 34.50 30.87 1wuu s PRO 91 CO -0.04 -0.08 0.23 -0.11 -0.33 0.00 0.00 177.00 176.67 1wuu n LEU 92 N 4.43 -2.20 -4.77 -5.54 7.94 -1.26 -4.93 117.00 110.67 1wuu n LEU 92 Ca -0.03 0.88 -0.30 0.00 -1.11 0.00 0.00 56.01 55.45 1wuu n LEU 92 Cb 0.51 -0.86 0.10 0.00 0.53 0.00 0.00 43.42 43.69 1wuu n LEU 92 CO 0.44 -3.60 0.69 -2.16 -1.11 0.00 0.00 177.39 171.66 1wuu s PRO 93 N -0.95 2.04 0.04 1.96 0.04 -1.26 -4.96 135.00 131.90 1wuu s PRO 93 Ca 0.58 0.93 -0.00 0.00 0.04 0.00 0.00 61.00 62.55 1wuu s PRO 93 Cb -0.71 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 31.95 1wuu s PRO 93 CO 0.58 -1.73 0.07 2.41 0.04 0.00 0.00 177.00 178.36 1wuu n THR 94 N -3.55 0.00 0.24 1.26 -1.04 0.94 -4.94 114.28 107.18 1wuu n THR 94 Ca 0.08 -0.21 -0.14 0.00 -2.04 0.00 0.00 64.05 61.74 1wuu n THR 94 Cb 0.54 0.13 -0.07 0.00 -1.82 0.00 0.00 70.33 69.12 1wuu n THR 94 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wuu h ALA 95 N 1.57 -1.07 -0.32 2.41 0.00 -2.04 -3.15 119.26 116.65 1wuu h ALA 95 Ca -0.03 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 1wuu h ALA 95 Cb 0.15 0.58 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1wuu h ALA 95 CO 0.05 -1.09 -0.47 -0.56 0.00 0.00 0.00 179.25 177.18 1wuu h GLN 96 N -0.77 0.88 -5.53 0.00 -0.00 -2.02 -3.42 115.11 104.25 1wuu h GLN 96 Ca -0.05 -0.51 -0.61 0.00 -0.00 0.00 0.00 58.65 57.48 1wuu h GLN 96 Cb 0.66 0.04 -0.11 0.00 -0.00 0.00 0.00 27.48 28.07 1wuu h GLN 96 CO -0.02 1.15 0.12 0.50 -0.00 0.00 0.00 178.83 180.58 1wuu s ARG 97 N -4.24 4.13 -0.16 0.06 3.52 -1.19 -5.03 118.95 116.04 1wuu s ARG 97 Ca -0.10 0.53 0.00 0.00 -0.13 0.00 0.00 55.73 56.03 1wuu s ARG 97 Cb 0.11 -3.63 0.03 0.00 -1.56 0.00 0.00 34.95 29.90 1wuu s ARG 97 CO 0.88 -0.35 -0.13 -1.12 -0.81 0.00 0.00 175.30 173.78 1wuu s SER 98 N 1.39 2.91 0.26 -2.12 0.01 -1.26 0.32 113.70 115.20 1wuu s SER 98 Ca 0.26 -0.62 -0.19 0.00 1.31 0.00 0.00 55.95 56.71 1wuu s SER 98 Cb -0.16 -1.19 -0.13 0.00 0.21 0.00 0.00 66.02 64.76 1wuu s SER 98 CO 0.09 -0.09 0.21 0.18 0.41 0.00 0.00 173.24 174.04 1wuu n LEU 99 N 4.75 -1.78 -3.82 2.44 4.77 -1.26 -4.96 117.00 117.14 1wuu n LEU 99 Ca -0.16 0.75 -0.30 0.00 -0.03 0.00 0.00 56.01 56.27 1wuu n LEU 99 Cb 0.49 -0.73 -0.15 0.00 -2.33 0.00 0.00 43.42 40.70 1wuu n LEU 99 CO 0.21 -2.97 -0.36 -1.61 -1.33 0.00 0.00 177.39 171.33 1wuu s GLU 100 N -0.80 1.03 -0.31 3.23 8.01 -1.26 -5.09 118.70 123.52 1wuu s GLU 100 Ca 0.49 -1.02 -0.28 0.00 0.01 0.00 0.00 54.97 54.17 1wuu s GLU 100 Cb -0.60 -2.32 -0.06 0.00 -4.31 0.00 0.00 34.13 26.84 1wuu s GLU 100 CO 0.48 -0.81 2.28 -0.35 0.01 0.00 0.00 175.26 176.87 1wuu n PRO 101 N 4.77 1.64 0.00 0.39 -0.04 -1.26 -4.77 135.00 135.73 1wuu n PRO 101 Ca -0.05 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 1wuu n PRO 101 Cb 0.43 -3.25 0.00 0.00 -0.04 0.00 0.00 33.50 30.64 1wuu n PRO 101 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wuu n GLY 102 N 5.89 0.47 3.31 0.55 0.00 -1.26 -5.07 105.19 109.08 1wuu n GLY 102 Ca 0.33 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 1wuu n GLY 102 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wuu s THR 103 N 0.00 0.02 0.82 2.61 2.01 -1.26 -4.11 115.64 115.73 1wuu s THR 103 Ca 0.00 -0.19 -0.11 0.00 0.31 0.00 0.00 61.69 61.71 1wuu s THR 103 Cb 0.00 -0.65 0.09 0.00 0.01 0.00 0.00 72.50 71.95 1wuu s THR 103 CO 0.00 -0.10 1.12 -2.16 -0.69 0.00 0.00 174.62 172.79 1wuu s PRO 104 N -0.54 1.82 0.45 4.92 0.04 -1.26 -4.97 135.00 135.46 1wuu s PRO 104 Ca -0.07 1.35 0.17 0.00 0.04 0.00 0.00 61.00 62.49 1wuu s PRO 104 Cb -0.04 -1.83 1.03 0.00 0.04 0.00 0.00 34.50 33.70 1wuu s PRO 104 CO 0.03 -2.00 1.97 0.00 0.04 0.00 0.00 177.00 177.04 1wuu h ARG 105 N -1.30 0.00 0.00 4.56 3.08 -1.92 -2.39 114.38 116.40 1wuu h ARG 105 Ca -0.44 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.59 1wuu h ARG 105 Cb 1.25 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.30 1wuu h ARG 105 CO 0.48 0.21 -0.12 0.11 -1.07 0.00 0.00 179.97 179.58 1wuu h TRP 106 N 0.00 0.00 -0.01 3.04 5.08 -1.93 -1.85 115.95 120.29 1wuu h TRP 106 Ca -0.00 0.00 -0.14 0.00 1.08 0.00 0.00 58.89 59.82 1wuu h TRP 106 Cb 0.40 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.54 1wuu h TRP 106 CO 0.00 0.12 -0.67 0.00 -1.28 0.00 0.00 178.44 176.61 1wuu h ALA 107 N 1.88 0.87 -0.80 0.11 0.00 -1.80 -3.23 119.26 116.28 1wuu h ALA 107 Ca -0.00 -0.60 0.19 0.00 0.00 0.00 0.00 54.91 54.50 1wuu h ALA 107 Cb 0.31 -0.10 -0.12 0.00 0.00 0.00 0.00 17.79 17.88 1wuu h ALA 107 CO 0.02 0.81 0.21 -0.91 0.00 0.00 0.00 179.25 179.38 1wuu h ASN 108 N 0.04 0.03 0.09 0.00 4.21 -1.40 -0.70 115.58 117.84 1wuu h ASN 108 Ca -0.01 0.17 0.02 0.00 1.21 0.00 0.00 56.30 57.69 1wuu h ASN 108 Cb 1.18 0.22 -0.04 0.00 -1.12 0.00 0.00 38.32 38.56 1wuu h ASN 108 CO 0.09 -0.07 -0.26 1.88 -1.29 0.00 0.00 177.43 177.78 1wuu h TYR 109 N 0.26 -0.70 -0.02 1.19 -1.99 -1.67 -2.59 116.97 111.45 1wuu h TYR 109 Ca 0.47 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 61.22 1wuu h TYR 109 Cb 0.87 0.30 -0.00 0.00 2.00 0.00 0.00 36.73 39.90 1wuu h TYR 109 CO -0.26 -0.36 0.01 0.28 -0.00 0.00 0.00 178.16 177.83 1wuu h VAL 110 N -0.45 1.05 -0.72 -2.88 2.07 -1.40 -2.81 116.25 111.11 1wuu h VAL 110 Ca 0.04 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.50 1wuu h VAL 110 Cb 0.49 1.11 -0.11 0.00 -1.52 0.00 0.00 31.29 31.26 1wuu h VAL 110 CO -0.17 0.04 -0.49 0.11 0.02 0.00 0.00 177.57 177.08 1wuu h LYS 111 N -0.03 -0.16 -0.46 1.57 1.57 -1.07 -0.28 116.57 117.71 1wuu h LYS 111 Ca 0.01 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 1wuu h LYS 111 Cb 0.06 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.32 1wuu h LYS 111 CO -0.00 -0.11 -0.56 0.78 -0.57 0.00 0.00 179.45 178.99 1wuu h GLY 112 N -0.17 -1.01 0.54 3.86 0.00 -1.28 1.18 103.07 106.20 1wuu h GLY 112 Ca 0.18 0.73 0.18 0.00 0.00 0.00 0.00 47.33 48.42 1wuu h GLY 112 CO -0.78 -0.11 0.56 -2.08 0.00 0.00 0.00 176.54 174.13 1wuu h VAL 113 N -0.36 0.41 0.00 4.60 2.07 -1.10 0.06 116.25 121.94 1wuu h VAL 113 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1wuu h VAL 113 Cb 0.57 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1wuu h VAL 113 CO -0.62 0.00 0.00 -0.38 0.02 0.00 0.00 177.57 176.59 1wuu n ILE 114 N -3.87 0.00 -0.35 4.57 5.41 0.36 -1.42 119.36 124.07 1wuu n ILE 114 Ca 0.12 0.41 0.26 0.00 1.00 0.00 0.00 62.75 64.54 1wuu n ILE 114 Cb 0.79 -1.05 0.40 0.00 -0.71 0.00 0.00 39.64 39.07 1wuu n ILE 114 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1wuu n GLN 115 N -1.40 0.00 -0.01 0.38 -0.06 0.13 0.88 117.38 117.30 1wuu n GLN 115 Ca 0.00 0.54 0.05 0.00 -2.00 0.00 0.00 57.00 55.59 1wuu n GLN 115 Cb 0.00 -1.26 -0.09 0.00 -4.06 0.00 0.00 30.24 24.82 1wuu n GLN 115 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1wuu n TYR 116 N -2.92 0.00 -0.83 3.69 4.02 -0.03 -5.00 117.16 116.09 1wuu n TYR 116 Ca 0.22 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.78 1wuu n TYR 116 Cb 1.01 -0.31 -0.05 0.00 -0.02 0.00 0.00 39.34 39.98 1wuu n TYR 116 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1wuu n TYR 117 N -1.97 0.50 -0.16 -0.72 9.36 0.25 -4.70 117.16 119.72 1wuu n TYR 117 Ca -0.04 0.58 -0.11 0.00 3.32 0.00 0.00 57.90 61.64 1wuu n TYR 117 Cb 0.37 -1.13 0.00 0.00 -0.63 0.00 0.00 39.34 37.96 1wuu n TYR 117 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1wuu h PRO 118 N 1.88 1.01 -7.31 2.98 0.13 -1.89 -3.46 132.00 125.33 1wuu h PRO 118 Ca -0.26 -0.42 -0.46 0.00 -0.87 0.00 0.00 66.00 63.99 1wuu h PRO 118 Cb 0.75 -0.04 0.08 0.00 0.13 0.00 0.00 31.00 31.92 1wuu h PRO 118 CO 0.39 1.10 0.24 0.00 -0.23 0.00 0.00 178.00 179.50 1wuu s ALA 119 N -4.70 3.13 -0.02 -0.56 0.00 -1.26 -5.12 121.76 113.24 1wuu s ALA 119 Ca -0.11 -0.89 -0.29 0.00 0.00 0.00 0.00 51.96 50.67 1wuu s ALA 119 Cb 0.12 -2.62 0.10 0.00 0.00 0.00 0.00 23.12 20.72 1wuu s ALA 119 CO 0.87 -1.30 0.89 0.00 0.00 0.00 0.00 175.76 176.22 1wuu s ALA 120 N -3.26 -1.83 0.25 0.00 0.00 -1.26 -4.64 121.76 111.03 1wuu s ALA 120 Ca 0.60 1.06 -0.08 0.00 0.00 0.00 0.00 51.96 53.53 1wuu s ALA 120 Cb -0.11 0.32 -0.07 0.00 0.00 0.00 0.00 23.12 23.27 1wuu s ALA 120 CO 0.45 -0.65 0.56 -2.14 0.00 0.00 0.00 175.76 173.98 1wuu s PRO 121 N -2.93 3.75 -0.26 0.00 0.02 -1.26 -5.05 135.00 129.28 1wuu s PRO 121 Ca 0.04 0.21 -0.08 0.00 0.02 0.00 0.00 61.00 61.19 1wuu s PRO 121 Cb -0.01 -2.64 -0.03 0.00 0.02 0.00 0.00 34.50 31.84 1wuu s PRO 121 CO -0.08 0.28 0.10 -1.17 -0.33 0.00 0.00 177.00 175.80 1wuu s LEU 122 N -3.05 3.62 0.00 -5.54 2.96 -1.26 -4.69 118.68 110.71 1wuu s LEU 122 Ca 0.47 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 54.17 1wuu s LEU 122 Cb -0.11 -1.97 0.00 0.00 0.50 0.00 0.00 46.19 44.61 1wuu s LEU 122 CO 0.24 -0.05 0.00 -2.65 -1.32 0.00 0.00 176.35 172.57 1wuu n PRO 123 N 4.96 1.50 -3.74 0.98 -0.02 -1.26 -5.09 135.00 132.33 1wuu n PRO 123 Ca -0.16 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.07 1wuu n PRO 123 Cb 0.51 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 34.00 1wuu n PRO 123 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1wuu s GLY 124 N -0.58 2.27 -0.13 -1.23 0.00 -1.10 -4.83 107.32 101.72 1wuu s GLY 124 Ca 0.00 -1.35 -0.30 0.00 0.00 0.00 0.00 44.72 43.07 1wuu s GLY 124 CO 0.00 -1.92 0.96 -0.11 0.00 0.00 0.00 173.10 172.03 1wuu s PHE 125 N -2.79 -0.39 -0.21 1.90 -0.12 0.32 -1.98 117.98 114.71 1wuu s PHE 125 Ca 0.38 0.62 -0.03 0.00 -0.05 0.00 0.00 56.93 57.86 1wuu s PHE 125 Cb -0.03 0.46 0.00 0.00 -0.63 0.00 0.00 43.02 42.82 1wuu s PHE 125 CO 0.24 -0.39 -0.08 -1.12 -0.05 0.00 0.00 175.22 173.82 1wuu s SER 126 N -1.29 4.04 -0.08 1.98 0.01 0.22 -0.10 113.70 118.47 1wuu s SER 126 Ca -0.02 -0.51 -0.06 0.00 1.31 0.00 0.00 55.95 56.68 1wuu s SER 126 Cb -0.00 -1.67 0.03 0.00 0.21 0.00 0.00 66.02 64.58 1wuu s SER 126 CO 0.01 -0.03 0.20 0.00 0.41 0.00 0.00 173.24 173.83 1wuu s ALA 127 N 1.42 -0.47 -0.13 1.44 0.00 -1.02 0.28 121.76 123.28 1wuu s ALA 127 Ca 0.05 0.71 -0.04 0.00 0.00 0.00 0.00 51.96 52.68 1wuu s ALA 127 Cb -0.14 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 1wuu s ALA 127 CO -0.06 -0.14 0.03 0.08 0.00 0.00 0.00 175.76 175.67 1wuu s VAL 128 N 0.66 4.50 -0.21 0.00 1.01 -0.17 -2.72 120.40 123.47 1wuu s VAL 128 Ca -0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 61.72 1wuu s VAL 128 Cb -0.06 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 1wuu s VAL 128 CO -0.04 0.55 0.01 -0.69 0.00 0.00 0.00 175.10 174.93 1wuu s VAL 129 N -0.32 4.02 0.08 2.92 1.01 -0.61 -2.49 120.40 125.01 1wuu s VAL 129 Ca 0.07 -0.28 0.06 0.00 0.00 0.00 0.00 61.98 61.83 1wuu s VAL 129 Cb -0.12 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 1wuu s VAL 129 CO 0.02 0.41 -0.16 -0.69 0.00 0.00 0.00 175.10 174.68 1wuu s VAL 130 N 1.11 1.29 -0.27 2.92 1.01 0.95 -1.40 120.40 126.01 1wuu s VAL 130 Ca 0.03 -1.34 -0.24 0.00 0.00 0.00 0.00 61.98 60.43 1wuu s VAL 130 Cb -0.14 -1.21 0.07 0.00 0.00 0.00 0.00 36.38 35.10 1wuu s VAL 130 CO 0.02 -0.15 0.70 -0.55 0.00 0.00 0.00 175.10 175.13 1wuu s SER 131 N -1.71 -0.75 0.00 3.32 0.15 -1.26 0.14 113.70 113.59 1wuu s SER 131 Ca 0.01 1.43 0.19 0.00 0.70 0.00 0.00 55.95 58.27 1wuu s SER 131 Cb -0.10 1.44 0.51 0.00 -1.71 0.00 0.00 66.02 66.15 1wuu s SER 131 CO 0.03 -0.24 1.42 -1.54 1.20 0.00 0.00 173.24 174.10 1wuu n SER 132 N 2.81 3.55 -4.64 5.45 3.41 -1.26 -4.92 113.62 118.01 1wuu n SER 132 Ca -0.14 -1.98 -0.36 0.00 -0.26 0.00 0.00 58.87 56.12 1wuu n SER 132 Cb 0.55 -0.37 -0.10 0.00 -0.26 0.00 0.00 64.21 64.03 1wuu n SER 132 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1wuu s VAL 133 N -1.05 5.20 0.06 -3.33 1.01 -1.26 -4.83 120.40 116.20 1wuu s VAL 133 Ca 0.39 0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.19 1wuu s VAL 133 Cb 0.21 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 33.08 1wuu s VAL 133 CO 0.27 0.37 1.90 -2.84 0.00 0.00 0.00 175.10 174.80 1wuu s PRO 134 N 0.96 4.14 -0.12 2.72 0.02 -1.26 -4.89 135.00 136.57 1wuu s PRO 134 Ca 0.07 2.58 -0.29 0.00 0.02 0.00 0.00 61.00 63.37 1wuu s PRO 134 Cb -0.13 -3.96 -0.05 0.00 0.02 0.00 0.00 34.50 30.37 1wuu s PRO 134 CO 0.03 -0.91 1.87 -0.51 -0.33 0.00 0.00 177.00 177.15 1wuu s LEU 135 N 3.85 4.01 -0.44 -5.54 1.43 -1.26 -1.63 118.68 119.09 1wuu s LEU 135 Ca 0.85 2.08 -0.02 0.00 -1.03 0.00 0.00 54.13 56.01 1wuu s LEU 135 Cb -0.43 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.26 1wuu s LEU 135 CO 0.39 -1.32 0.22 0.61 0.23 0.00 0.00 176.35 176.48 1wuu n GLY 136 N 4.81 0.37 0.84 -3.19 0.00 -1.26 -4.93 105.19 101.83 1wuu n GLY 136 Ca 0.21 -0.49 0.11 0.00 0.00 0.00 0.00 46.02 45.85 1wuu n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wuu n GLY 137 N -0.97 0.70 1.77 -0.02 0.00 -0.65 -4.37 105.19 101.66 1wuu n GLY 137 Ca -0.02 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1wuu n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wuu n GLY 138 N 1.23 0.52 0.56 -0.02 0.00 -1.26 -1.64 105.19 104.57 1wuu n GLY 138 Ca 0.12 -0.33 0.07 0.00 0.00 0.00 0.00 46.02 45.88 1wuu n GLY 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wuu n LEU 139 N 0.00 3.07 -2.59 0.99 4.77 -1.26 -3.60 117.00 118.38 1wuu n LEU 139 Ca 0.00 -2.56 -0.10 0.00 -0.03 0.00 0.00 56.01 53.32 1wuu n LEU 139 Cb 0.00 -0.35 0.05 0.00 -2.33 0.00 0.00 43.42 40.79 1wuu n LEU 139 CO 0.00 0.67 0.05 -0.24 -1.33 0.00 0.00 177.39 176.54 1wuu n SER 140 N -0.32 -3.41 0.04 -1.43 2.88 -1.26 0.12 113.62 110.24 1wuu n SER 140 Ca 0.14 -0.43 0.08 0.00 -1.33 0.00 0.00 58.87 57.34 1wuu n SER 140 Cb 0.61 -3.50 0.35 0.00 -0.75 0.00 0.00 64.21 60.92 1wuu n SER 140 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1wuu n SER 141 N -2.48 0.21 -0.02 -3.46 3.41 -1.26 -1.23 113.62 108.79 1wuu n SER 141 Ca -0.12 0.56 -0.20 0.00 -0.26 0.00 0.00 58.87 58.85 1wuu n SER 141 Cb 0.59 -0.60 -0.13 0.00 -0.26 0.00 0.00 64.21 63.81 1wuu n SER 141 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1wuu h SER 142 N 0.00 0.26 1.36 4.04 4.64 -1.93 -3.09 113.55 118.83 1wuu h SER 142 Ca 0.00 -0.84 -0.08 0.00 -0.47 0.00 0.00 61.79 60.39 1wuu h SER 142 Cb 0.26 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1wuu h SER 142 CO 0.00 1.43 -0.40 0.00 -0.87 0.00 0.00 176.83 176.99 1wuu h ALA 143 N -0.09 0.79 -0.02 5.18 0.00 -1.85 -2.30 119.26 120.97 1wuu h ALA 143 Ca -0.22 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.21 1wuu h ALA 143 Cb 1.51 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1wuu h ALA 143 CO 0.02 0.50 -0.51 1.03 0.00 0.00 0.00 179.25 180.29 1wuu h SER 144 N 0.00 0.06 0.00 0.00 0.87 -1.28 -2.84 113.55 110.36 1wuu h SER 144 Ca -0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1wuu h SER 144 Cb 1.19 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 1wuu h SER 144 CO 0.05 0.56 0.00 -0.11 -0.53 0.00 0.00 176.83 176.81 1wuu n LEU 145 N -3.93 0.56 -0.20 2.23 7.94 -1.15 -2.51 117.00 119.94 1wuu n LEU 145 Ca -0.02 0.50 0.01 0.00 -1.11 0.00 0.00 56.01 55.40 1wuu n LEU 145 Cb 0.53 -0.38 0.04 0.00 0.53 0.00 0.00 43.42 44.15 1wuu n LEU 145 CO 0.41 -0.38 0.32 -0.62 -1.11 0.00 0.00 177.39 176.02 1wuu n GLU 146 N -1.63 -0.09 0.03 1.96 1.02 -0.88 0.12 120.64 121.17 1wuu n GLU 146 Ca 0.00 0.81 -0.10 0.00 -0.02 0.00 0.00 57.16 57.84 1wuu n GLU 146 Cb 0.00 -1.20 -0.04 0.00 -0.02 0.00 0.00 31.44 30.18 1wuu n GLU 146 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1wuu h VAL 147 N 0.00 0.57 -0.24 2.62 2.07 -1.61 0.33 116.25 119.99 1wuu h VAL 147 Ca 0.21 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.73 1wuu h VAL 147 Cb 0.34 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1wuu h VAL 147 CO -0.53 0.00 0.15 0.00 0.02 0.00 0.00 177.57 177.22 1wuu h ALA 148 N 0.72 0.31 -1.19 1.67 0.00 0.12 0.76 119.26 121.64 1wuu h ALA 148 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1wuu h ALA 148 Cb 0.35 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1wuu h ALA 148 CO -0.20 -0.20 0.00 2.41 0.00 0.00 0.00 179.25 181.26 1wuu n THR 149 N -4.90 0.00 -0.29 0.00 -1.04 -0.09 0.96 114.28 108.92 1wuu n THR 149 Ca -0.03 1.30 -0.02 0.00 -2.04 0.00 0.00 64.05 63.27 1wuu n THR 149 Cb 0.04 -1.97 0.01 0.00 -1.82 0.00 0.00 70.33 66.60 1wuu n THR 149 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wuu n TYR 150 N -1.94 -0.03 0.13 -1.42 9.36 0.11 0.27 117.16 123.64 1wuu n TYR 150 Ca 0.00 0.93 0.19 0.00 3.32 0.00 0.00 57.90 62.34 1wuu n TYR 150 Cb 0.00 -0.75 0.77 0.00 -0.63 0.00 0.00 39.34 38.73 1wuu n TYR 150 CO 0.00 0.00 0.00 1.15 0.22 0.00 0.00 176.86 178.23 1wuu h THR 151 N 0.00 0.40 0.19 2.97 2.02 0.40 0.20 112.91 119.09 1wuu h THR 151 Ca 0.24 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.41 1wuu h THR 151 Cb 0.43 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1wuu h THR 151 CO -0.74 0.00 -0.09 0.15 0.37 0.00 0.00 175.52 175.21 1wuu h PHE 152 N 0.00 -0.23 -0.13 3.16 3.57 1.06 -3.33 116.94 121.04 1wuu h PHE 152 Ca 0.16 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.69 1wuu h PHE 152 Cb 0.89 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 1wuu h PHE 152 CO 0.00 0.14 0.13 -0.07 -2.23 0.00 0.00 178.31 176.27 1wuu h LEU 153 N -0.94 0.00 -0.24 0.59 3.38 0.95 0.76 115.31 119.82 1wuu h LEU 153 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1wuu h LEU 153 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1wuu h LEU 153 CO 0.04 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1wuu n GLN 154 N -3.97 0.10 0.01 1.13 6.02 -0.69 -1.17 117.38 118.82 1wuu n GLN 154 Ca 0.00 0.27 -0.07 0.00 -0.01 0.00 0.00 57.00 57.19 1wuu n GLN 154 Cb 0.24 -1.67 -0.12 0.00 1.02 0.00 0.00 30.24 29.70 1wuu n GLN 154 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1wuu h GLN 155 N 0.00 0.00 0.00 -1.09 1.08 0.43 -1.96 115.11 113.57 1wuu h GLN 155 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1wuu h GLN 155 Cb 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 1wuu h GLN 155 CO 0.00 0.60 -0.33 -0.07 -0.95 0.00 0.00 178.83 178.07 1wuu h LEU 156 N 0.00 0.00 -5.00 1.46 3.38 -1.04 -3.41 115.31 110.70 1wuu h LEU 156 Ca -0.20 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 1wuu h LEU 156 Cb 1.89 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.53 1wuu h LEU 156 CO 0.09 0.04 0.02 0.00 0.09 0.00 0.00 178.44 178.68 1wuu n PRO 158 N 0.94 0.00 -4.19 0.00 -0.02 -0.74 -4.60 135.00 126.39 1wuu n PRO 158 Ca -0.03 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.15 1wuu n PRO 158 Cb 0.74 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 34.12 1wuu n PRO 158 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1wuu s ASP 159 N 0.00 4.64 -0.22 2.55 1.47 -1.26 -4.83 116.67 119.02 1wuu s ASP 159 Ca 0.00 -0.31 0.01 0.00 1.18 0.00 0.00 52.55 53.43 1wuu s ASP 159 Cb 0.00 -0.97 -0.20 0.00 -0.34 0.00 0.00 42.92 41.41 1wuu s ASP 159 CO 0.00 0.18 -0.05 -1.54 0.68 0.00 0.00 175.17 174.43 1wuu n SER 160 N 0.64 1.92 -3.02 2.11 3.41 -1.26 -5.05 113.62 112.37 1wuu n SER 160 Ca -0.12 -0.04 -0.02 0.00 -0.26 0.00 0.00 58.87 58.43 1wuu n SER 160 Cb 0.52 -0.46 0.02 0.00 -0.26 0.00 0.00 64.21 64.03 1wuu n SER 160 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wuu n GLY 161 N 2.16 -3.09 3.91 5.00 0.00 -1.26 -5.04 105.19 106.88 1wuu n GLY 161 Ca -0.41 -1.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 1wuu n GLY 161 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wuu s THR 162 N -0.92 3.86 0.10 2.61 -4.23 -1.26 -4.95 115.64 110.85 1wuu s THR 162 Ca 0.04 0.14 -0.24 0.00 -1.18 0.00 0.00 61.69 60.45 1wuu s THR 162 Cb -0.01 -3.53 -0.12 0.00 1.34 0.00 0.00 72.50 70.18 1wuu s THR 162 CO 0.04 -0.57 1.70 0.40 -0.54 0.00 0.00 174.62 175.65 1wuu h ILE 163 N -0.19 0.79 -0.15 2.99 2.04 -2.00 0.15 117.51 121.14 1wuu h ILE 163 Ca -0.45 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.45 1wuu h ILE 163 Cb 1.25 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1wuu h ILE 163 CO 0.61 0.00 0.36 0.00 0.00 0.00 0.00 178.15 179.12 1wuu h ALA 164 N 0.76 1.62 -0.03 1.87 0.00 -1.99 0.49 119.26 121.98 1wuu h ALA 164 Ca 0.02 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1wuu h ALA 164 Cb 0.19 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1wuu h ALA 164 CO -0.05 -0.44 -0.40 0.00 0.00 0.00 0.00 179.25 178.36 1wuu h ALA 165 N 1.42 0.08 -0.89 0.00 0.00 -1.11 -2.54 119.26 116.22 1wuu h ALA 165 Ca 0.07 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1wuu h ALA 165 Cb 0.79 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1wuu h ALA 165 CO -0.00 0.22 0.57 0.00 0.00 0.00 0.00 179.25 180.04 1wuu h ARG 166 N -0.24 1.18 -0.09 0.00 3.08 0.75 -1.93 114.38 117.13 1wuu h ARG 166 Ca -0.04 -0.08 0.01 0.00 0.07 0.00 0.00 59.98 59.93 1wuu h ARG 166 Cb 1.10 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 1wuu h ARG 166 CO 0.08 0.80 0.01 0.00 -1.07 0.00 0.00 179.97 179.79 1wuu h ALA 167 N 1.31 0.09 -0.95 0.04 0.00 -1.29 -1.75 119.26 116.71 1wuu h ALA 167 Ca 0.32 0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.40 1wuu h ALA 167 Cb -0.11 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 1wuu h ALA 167 CO -0.07 -0.45 0.60 1.96 0.00 0.00 0.00 179.25 181.30 1wuu h GLN 168 N 0.05 0.77 0.18 0.00 4.20 -0.99 0.14 115.11 119.46 1wuu h GLN 168 Ca 0.04 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1wuu h GLN 168 Cb 0.04 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.64 1wuu h GLN 168 CO -0.06 0.51 -0.11 0.28 -0.67 0.00 0.00 178.83 178.78 1wuu h VAL 169 N 0.79 0.00 -0.81 -0.54 2.07 -0.58 0.12 116.25 117.30 1wuu h VAL 169 Ca 0.49 0.00 0.19 0.00 0.82 0.00 0.00 66.70 68.20 1wuu h VAL 169 Cb 0.70 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.34 1wuu h VAL 169 CO -0.25 0.00 0.18 0.00 0.02 0.00 0.00 177.57 177.52 1wuu h GLN 171 N 0.23 -0.15 -0.75 0.00 4.15 -0.34 -1.04 115.11 117.21 1wuu h GLN 171 Ca 0.48 0.01 0.11 0.00 0.77 0.00 0.00 58.65 60.02 1wuu h GLN 171 Cb 0.88 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 28.56 1wuu h GLN 171 CO -0.59 -0.10 0.50 1.96 -1.93 0.00 0.00 178.83 178.66 1wuu h GLN 172 N -0.15 0.56 0.26 1.69 1.08 0.15 0.72 115.11 119.42 1wuu h GLN 172 Ca 0.10 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1wuu h GLN 172 Cb 0.30 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1wuu h GLN 172 CO -0.24 0.37 -0.12 0.00 -0.95 0.00 0.00 178.83 177.89 1wuu h ALA 173 N 1.63 -0.35 -1.01 3.87 0.00 -0.05 0.69 119.26 124.05 1wuu h ALA 173 Ca 0.36 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.20 1wuu h ALA 173 Cb 0.60 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.46 1wuu h ALA 173 CO -0.13 -0.62 0.65 1.49 0.00 0.00 0.00 179.25 180.64 1wuu h GLU 174 N -0.50 1.16 0.49 0.00 4.81 -0.52 0.55 114.58 120.56 1wuu h GLU 174 Ca -0.04 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 1wuu h GLU 174 Cb 0.37 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1wuu h GLU 174 CO 0.06 0.77 -0.23 0.45 -0.73 0.00 0.00 179.01 179.32 1wuu h HIS 175 N 1.20 -0.61 -0.05 0.92 3.86 -0.72 -0.05 115.15 119.71 1wuu h HIS 175 Ca 0.43 -0.01 -0.21 0.00 -1.16 0.00 0.00 60.37 59.42 1wuu h HIS 175 Cb 0.14 0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.81 1wuu h HIS 175 CO -0.00 -0.38 -0.85 0.77 0.86 0.00 0.00 177.93 178.34 1wuu h SER 176 N -0.84 0.57 0.00 2.45 0.02 0.39 -3.25 113.55 112.90 1wuu h SER 176 Ca -0.07 -0.41 -0.44 0.00 -0.84 0.00 0.00 61.79 60.02 1wuu h SER 176 Cb 0.50 -0.17 -0.07 0.00 0.14 0.00 0.00 62.40 62.80 1wuu h SER 176 CO 0.11 1.19 -2.46 0.49 -1.14 0.00 0.00 176.83 175.02 1wuu n PHE 177 N -3.80 0.08 0.53 3.45 3.01 0.18 -4.57 117.46 116.34 1wuu n PHE 177 Ca -0.06 0.03 0.13 0.00 1.01 0.00 0.00 57.45 58.56 1wuu n PHE 177 Cb 0.78 -1.01 0.31 0.00 -0.01 0.00 0.00 39.48 39.55 1wuu n PHE 177 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1wuu h ALA 178 N -0.85 0.92 -2.62 4.37 0.00 -0.57 -3.46 119.26 117.06 1wuu h ALA 178 Ca -0.67 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1wuu h ALA 178 Cb 1.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1wuu h ALA 178 CO -0.37 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.29 1wuu n GLY 179 N 1.27 -0.48 2.66 0.00 0.00 -0.13 -4.99 105.19 103.53 1wuu n GLY 179 Ca 0.05 -0.19 -0.11 0.00 0.00 0.00 0.00 46.02 45.78 1wuu n GLY 179 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wuu s PRO 181 N -1.16 1.02 0.56 1.61 0.04 -1.26 -5.00 135.00 130.82 1wuu s PRO 181 Ca 0.00 -1.35 0.02 0.00 0.04 0.00 0.00 61.00 59.71 1wuu s PRO 181 Cb 0.00 -0.44 0.05 0.00 0.04 0.00 0.00 34.50 34.14 1wuu s PRO 181 CO 0.00 -1.34 0.79 0.00 0.04 0.00 0.00 177.00 176.49 1wuu n GLY 183 N -2.37 0.88 2.38 0.00 0.00 -1.26 -4.93 105.19 99.89 1wuu n GLY 183 Ca 0.09 -1.89 -0.27 0.00 0.00 0.00 0.00 46.02 43.95 1wuu n GLY 183 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wuu n ILE 184 N -0.14 3.25 0.00 -0.61 -0.00 -1.26 -4.85 119.36 115.75 1wuu n ILE 184 Ca 0.00 -2.82 0.00 0.00 -0.00 0.00 0.00 62.75 59.93 1wuu n ILE 184 Cb 0.00 -1.44 0.00 0.00 -0.00 0.00 0.00 39.64 38.20 1wuu n ILE 184 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 1wuu n ASP 186 N 0.38 0.00 -0.04 4.38 8.00 -1.26 -2.95 116.55 125.05 1wuu n ASP 186 Ca 0.46 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.88 1wuu n ASP 186 Cb 0.53 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.61 1wuu n ASP 186 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1wuu h GLN 187 N 0.00 -0.25 -0.09 -1.24 7.50 -1.88 -1.44 115.11 117.71 1wuu h GLN 187 Ca 0.00 0.02 0.03 0.00 0.50 0.00 0.00 58.65 59.19 1wuu h GLN 187 Cb 0.00 0.06 -0.06 0.00 0.05 0.00 0.00 27.48 27.53 1wuu h GLN 187 CO 0.00 -0.17 -0.54 0.35 -1.50 0.00 0.00 178.83 176.97 1wuu h PHE 188 N -0.26 -1.60 -0.88 2.96 3.57 -1.90 0.67 116.94 119.50 1wuu h PHE 188 Ca 0.13 0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.71 1wuu h PHE 188 Cb 0.46 0.71 -0.05 0.00 2.79 0.00 0.00 35.95 39.86 1wuu h PHE 188 CO -0.39 -0.56 0.58 0.97 -2.23 0.00 0.00 178.31 176.68 1wuu h ILE 189 N -0.62 1.18 -0.62 1.41 6.09 -1.82 -1.94 117.51 121.19 1wuu h ILE 189 Ca 0.03 -0.39 0.13 0.00 -1.37 0.00 0.00 64.86 63.25 1wuu h ILE 189 Cb 0.70 -0.06 -0.11 0.00 0.47 0.00 0.00 36.82 37.81 1wuu h ILE 189 CO -0.41 0.21 -0.11 -1.28 -3.07 0.00 0.00 178.15 173.49 1wuu h SER 190 N 1.14 -0.49 -0.00 2.19 0.87 0.00 1.67 113.55 118.93 1wuu h SER 190 Ca 0.34 0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 61.08 1wuu h SER 190 Cb -0.05 0.35 -0.00 0.00 -0.44 0.00 0.00 62.40 62.26 1wuu h SER 190 CO -0.10 -0.18 0.00 0.18 -0.53 0.00 0.00 176.83 176.20 1wuu n LEU 191 N -5.38 1.33 -0.85 2.23 4.77 0.07 -2.02 117.00 117.15 1wuu n LEU 191 Ca 0.08 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 1wuu n LEU 191 Cb 0.34 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1wuu n LEU 191 CO 0.07 0.29 -0.26 0.61 -1.33 0.00 0.00 177.39 176.77 1wuu n GLY 193 N 0.08 -3.52 2.93 -0.72 0.00 0.57 -3.85 105.19 100.68 1wuu n GLY 193 Ca 0.00 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.84 1wuu n GLY 193 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wuu s GLN 194 N -4.76 0.09 0.46 1.61 2.00 -1.08 -1.33 119.66 116.64 1wuu s GLN 194 Ca 0.00 0.31 -0.21 0.00 -2.00 0.00 0.00 55.36 53.46 1wuu s GLN 194 Cb 0.00 -0.12 -0.13 0.00 0.80 0.00 0.00 33.01 33.56 1wuu s GLN 194 CO 0.00 -0.13 0.40 1.17 -0.50 0.00 0.00 175.29 176.23 1wuu n LYS 195 N 3.90 0.41 -3.48 1.67 4.81 -1.16 -2.37 118.16 121.94 1wuu n LYS 195 Ca -0.23 0.15 -0.23 0.00 -0.87 0.00 0.00 58.31 57.13 1wuu n LYS 195 Cb 0.53 -1.41 -0.03 0.00 0.02 0.00 0.00 35.03 34.15 1wuu n LYS 195 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wuu n GLY 196 N 1.95 -0.46 3.01 3.14 0.00 0.15 -4.87 105.19 108.10 1wuu n GLY 196 Ca 0.11 0.06 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1wuu n GLY 196 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wuu s HIS 197 N -2.79 -0.23 0.52 1.61 3.76 -1.00 -1.96 115.29 115.20 1wuu s HIS 197 Ca 0.42 0.59 -0.05 0.00 -0.15 0.00 0.00 55.06 55.87 1wuu s HIS 197 Cb -0.24 0.01 -0.02 0.00 1.11 0.00 0.00 32.58 33.44 1wuu s HIS 197 CO 0.52 -0.17 0.81 0.00 -0.85 0.00 0.00 174.74 175.05 1wuu s ALA 198 N 0.88 3.40 -0.20 -1.40 0.00 0.44 -4.57 121.76 120.31 1wuu s ALA 198 Ca -0.06 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.27 1wuu s ALA 198 Cb -0.08 -2.54 0.04 0.00 0.00 0.00 0.00 23.12 20.54 1wuu s ALA 198 CO -0.05 -0.52 -0.12 -0.51 0.00 0.00 0.00 175.76 174.56 1wuu s LEU 199 N -4.81 2.38 -0.52 0.00 1.02 0.43 -0.08 118.68 117.09 1wuu s LEU 199 Ca 0.50 -0.89 -0.24 0.00 0.02 0.00 0.00 54.13 53.51 1wuu s LEU 199 Cb -0.10 -1.32 0.04 0.00 0.02 0.00 0.00 46.19 44.83 1wuu s LEU 199 CO 0.44 -0.12 0.93 -0.22 0.02 0.00 0.00 176.35 177.40 1wuu s LEU 200 N 1.34 4.07 -0.12 1.79 2.96 -0.15 -2.89 118.68 125.69 1wuu s LEU 200 Ca -0.01 -0.20 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 1wuu s LEU 200 Cb -0.16 -2.94 -0.03 0.00 0.50 0.00 0.00 46.19 43.56 1wuu s LEU 200 CO -0.09 -1.17 -0.06 -0.63 -1.32 0.00 0.00 176.35 173.08 1wuu s ILE 201 N 3.87 3.69 -0.44 6.68 1.01 -0.94 -0.87 121.20 134.20 1wuu s ILE 201 Ca 0.32 -0.45 -0.20 0.00 0.00 0.00 0.00 60.65 60.32 1wuu s ILE 201 Cb -0.12 -2.57 0.03 0.00 0.01 0.00 0.00 42.46 39.81 1wuu s ILE 201 CO 0.21 0.54 0.60 -0.62 0.00 0.00 0.00 174.94 175.67 1wuu s ASP 202 N -0.07 6.29 -0.03 3.58 -1.08 0.45 -2.35 116.67 123.46 1wuu s ASP 202 Ca 0.01 -0.46 0.06 0.00 -0.52 0.00 0.00 52.55 51.64 1wuu s ASP 202 Cb -0.13 -2.30 0.22 0.00 -1.46 0.00 0.00 42.92 39.25 1wuu s ASP 202 CO 0.03 -0.75 1.07 0.00 0.52 0.00 0.00 175.17 176.04 1wuu n ARG 204 N 0.18 0.20 0.00 0.00 0.63 -1.25 -4.52 116.66 111.90 1wuu n ARG 204 Ca 0.08 0.08 0.15 0.00 -0.92 0.00 0.00 57.85 57.24 1wuu n ARG 204 Cb 0.32 -0.83 0.74 0.00 0.45 0.00 0.00 32.46 33.14 1wuu n ARG 204 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1wuu n SER 205 N -3.25 0.17 0.00 6.15 3.41 -1.21 -4.85 113.62 114.03 1wuu n SER 205 Ca -0.05 -0.44 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 1wuu n SER 205 Cb 0.19 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1wuu n SER 205 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1wuu n LEU 206 N -1.11 0.99 -4.78 1.04 7.94 0.18 -4.92 117.00 116.35 1wuu n LEU 206 Ca 0.16 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 54.69 1wuu n LEU 206 Cb 0.23 -2.41 -0.03 0.00 0.53 0.00 0.00 43.42 41.74 1wuu n LEU 206 CO 0.22 -0.95 0.77 -1.61 -1.11 0.00 0.00 177.39 174.71 1wuu s GLU 207 N -1.91 4.14 0.01 1.96 2.02 -1.16 -4.74 118.70 119.03 1wuu s GLU 207 Ca 0.00 1.62 -0.03 0.00 0.02 0.00 0.00 54.97 56.57 1wuu s GLU 207 Cb 0.00 -2.60 -0.01 0.00 0.10 0.00 0.00 34.13 31.62 1wuu s GLU 207 CO 0.00 -0.19 0.05 0.95 0.02 0.00 0.00 175.26 176.09 1wuu s THR 208 N -1.56 0.10 0.00 3.63 -4.23 -1.26 0.17 115.64 112.49 1wuu s THR 208 Ca 0.57 -0.81 0.00 0.00 -1.18 0.00 0.00 61.69 60.28 1wuu s THR 208 Cb -0.25 -0.34 -0.00 0.00 1.34 0.00 0.00 72.50 73.24 1wuu s THR 208 CO 0.31 -0.44 -0.01 -0.94 -0.54 0.00 0.00 174.62 173.00 1wuu s SER 209 N -1.43 0.13 -0.07 3.99 1.04 -0.05 -4.97 113.70 112.34 1wuu s SER 209 Ca -0.15 -0.11 -0.26 0.00 0.48 0.00 0.00 55.95 55.90 1wuu s SER 209 Cb -0.09 0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.01 1wuu s SER 209 CO 0.00 -0.05 0.84 -0.76 0.98 0.00 0.00 173.24 174.25 1wuu s LEU 210 N -0.31 4.29 -0.24 2.42 1.43 -1.26 -0.98 118.68 124.03 1wuu s LEU 210 Ca -0.03 1.35 -0.00 0.00 -1.03 0.00 0.00 54.13 54.42 1wuu s LEU 210 Cb -0.02 -3.30 0.04 0.00 0.03 0.00 0.00 46.19 42.94 1wuu s LEU 210 CO -0.00 -0.25 -0.09 -0.69 0.23 0.00 0.00 176.35 175.55 1wuu s VAL 211 N 1.27 2.57 -0.25 -1.59 1.01 0.89 -4.95 120.40 119.34 1wuu s VAL 211 Ca 0.43 -1.20 -0.28 0.00 0.00 0.00 0.00 61.98 60.93 1wuu s VAL 211 Cb -0.18 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1wuu s VAL 211 CO 0.20 0.17 2.02 -2.84 0.00 0.00 0.00 175.10 174.65 1wuu s PRO 212 N 1.26 3.27 -0.93 2.72 0.01 -1.26 0.17 135.00 140.23 1wuu s PRO 212 Ca -0.02 1.80 -0.02 0.00 0.01 0.00 0.00 61.00 62.77 1wuu s PRO 212 Cb -0.17 -4.28 0.25 0.00 0.01 0.00 0.00 34.50 30.30 1wuu s PRO 212 CO -0.06 -1.94 0.93 1.28 0.01 0.00 0.00 177.00 177.22 1wuu n LEU 213 N 10.88 4.67 -3.19 -5.54 4.77 -0.83 -4.91 117.00 122.86 1wuu n LEU 213 Ca 0.26 -5.17 -0.23 0.00 -0.03 0.00 0.00 56.01 50.84 1wuu n LEU 213 Cb 0.46 -1.13 -0.06 0.00 -2.33 0.00 0.00 43.42 40.36 1wuu n LEU 213 CO 0.67 1.61 -0.13 -1.54 -1.33 0.00 0.00 177.39 176.67 1wuu n SER 214 N 2.04 1.77 -3.43 -1.43 3.41 -1.26 -4.50 113.62 110.21 1wuu n SER 214 Ca 0.24 -3.09 -0.18 0.00 -0.26 0.00 0.00 58.87 55.57 1wuu n SER 214 Cb 0.37 -0.63 -0.11 0.00 -0.26 0.00 0.00 64.21 63.59 1wuu n SER 214 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1wuu s ASP 215 N -2.18 1.71 0.30 4.04 2.15 -1.26 -5.02 116.67 116.42 1wuu s ASP 215 Ca 0.40 -0.63 -0.00 0.00 0.43 0.00 0.00 52.55 52.74 1wuu s ASP 215 Cb 0.24 0.43 0.69 0.00 -0.30 0.00 0.00 42.92 43.97 1wuu s ASP 215 CO -0.09 -0.38 1.54 -0.81 -0.17 0.00 0.00 175.17 175.27 1wuu n PRO 216 N 5.31 -0.08 0.00 4.34 -0.04 -1.26 0.13 135.00 143.40 1wuu n PRO 216 Ca -0.03 1.49 0.07 0.00 -0.04 0.00 0.00 63.50 64.98 1wuu n PRO 216 Cb 0.47 -2.34 0.36 0.00 -0.04 0.00 0.00 33.50 31.95 1wuu n PRO 216 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1wuu n LYS 217 N -5.51 0.27 -5.05 0.54 5.02 -1.26 -4.62 118.16 107.55 1wuu n LYS 217 Ca 0.22 0.11 -0.32 0.00 -2.02 0.00 0.00 58.31 56.29 1wuu n LYS 217 Cb 0.70 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 34.06 1wuu n LYS 217 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1wuu s LEU 218 N -2.38 2.41 0.12 -0.35 2.96 0.35 -1.30 118.68 120.48 1wuu s LEU 218 Ca 0.15 -0.38 0.10 0.00 -0.22 0.00 0.00 54.13 53.78 1wuu s LEU 218 Cb 0.09 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.26 1wuu s LEU 218 CO 0.19 0.25 -0.24 0.00 -1.32 0.00 0.00 176.35 175.23 1wuu s ALA 219 N -0.19 2.12 -0.24 5.97 0.00 -0.58 -4.71 121.76 124.12 1wuu s ALA 219 Ca -0.01 -1.37 0.02 0.00 0.00 0.00 0.00 51.96 50.59 1wuu s ALA 219 Cb -0.13 -0.32 0.05 0.00 0.00 0.00 0.00 23.12 22.71 1wuu s ALA 219 CO 0.03 0.46 -0.12 0.08 0.00 0.00 0.00 175.76 176.21 1wuu s VAL 220 N -1.12 2.30 -0.21 0.00 1.01 -1.26 -2.00 120.40 119.11 1wuu s VAL 220 Ca 0.11 -1.38 -0.04 0.00 0.00 0.00 0.00 61.98 60.67 1wuu s VAL 220 Cb -0.10 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 1wuu s VAL 220 CO 0.05 0.13 -0.03 -0.22 0.00 0.00 0.00 175.10 175.03 1wuu s LEU 221 N 1.18 3.02 -0.33 3.92 2.96 0.22 -1.54 118.68 128.12 1wuu s LEU 221 Ca -0.04 -0.32 -0.13 0.00 -0.22 0.00 0.00 54.13 53.42 1wuu s LEU 221 Cb -0.18 -1.77 -0.02 0.00 0.50 0.00 0.00 46.19 44.72 1wuu s LEU 221 CO -0.06 0.01 0.23 -0.63 -1.32 0.00 0.00 176.35 174.58 1wuu s ILE 222 N 1.32 5.29 -0.27 6.68 1.01 0.65 0.94 121.20 136.82 1wuu s ILE 222 Ca 0.04 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.52 1wuu s ILE 222 Cb -0.14 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.65 1wuu s ILE 222 CO -0.01 0.05 0.03 -0.89 0.00 0.00 0.00 174.94 174.12 1wuu s THR 223 N 1.74 3.72 -0.27 2.92 2.01 0.15 0.30 115.64 126.22 1wuu s THR 223 Ca 0.07 -0.64 -0.22 0.00 0.31 0.00 0.00 61.69 61.20 1wuu s THR 223 Cb -0.17 -2.85 -0.01 0.00 0.01 0.00 0.00 72.50 69.48 1wuu s THR 223 CO 0.11 0.20 0.73 0.21 -0.69 0.00 0.00 174.62 175.17 1wuu s ASN 224 N 1.48 6.66 0.23 3.53 3.84 0.38 -1.73 114.94 129.33 1wuu s ASN 224 Ca 0.03 0.75 0.26 0.00 0.21 0.00 0.00 52.86 54.11 1wuu s ASN 224 Cb -0.16 -2.38 0.85 0.00 -0.55 0.00 0.00 41.25 39.01 1wuu s ASN 224 CO 0.00 -0.49 1.76 -1.54 -2.79 0.00 0.00 177.10 174.04 1wuu n SER 225 N 5.95 0.81 -0.40 -4.21 3.41 -0.71 -0.02 113.62 118.45 1wuu n SER 225 Ca 0.02 0.60 -0.05 0.00 -0.26 0.00 0.00 58.87 59.19 1wuu n SER 225 Cb 0.48 -0.81 -0.02 0.00 -0.26 0.00 0.00 64.21 63.60 1wuu n SER 225 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1wuu n ASN 226 N -2.28 -5.13 -4.74 4.04 3.02 -1.26 -4.63 115.26 104.28 1wuu n ASN 226 Ca 0.05 0.12 -0.34 0.00 -0.03 0.00 0.00 54.58 54.38 1wuu n ASN 226 Cb 0.38 -3.43 -0.08 0.00 -0.61 0.00 0.00 39.78 36.04 1wuu n ASN 226 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1wuu s VAL 227 N -1.31 4.57 -0.18 2.41 1.01 -1.26 -5.02 120.40 120.62 1wuu s VAL 227 Ca 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 1wuu s VAL 227 Cb 0.00 -3.02 0.07 0.00 0.00 0.00 0.00 36.38 33.42 1wuu s VAL 227 CO 0.00 0.46 0.10 -0.13 0.00 0.00 0.00 175.10 175.53 1wuu s ARG 228 N -1.38 0.08 0.00 2.72 0.52 -1.26 -1.22 118.95 118.41 1wuu s ARG 228 Ca 0.19 -0.09 0.27 0.00 -0.52 0.00 0.00 55.73 55.57 1wuu s ARG 228 Cb -0.12 -1.73 0.87 0.00 0.52 0.00 0.00 34.95 34.50 1wuu s ARG 228 CO 0.09 -0.70 1.64 0.72 0.02 0.00 0.00 175.30 177.07 1wuu n HIS 229 N 5.28 0.00 -1.36 -0.53 8.25 -1.18 -5.04 115.22 120.64 1wuu n HIS 229 Ca -0.07 0.00 -0.56 0.00 -0.26 0.00 0.00 57.72 56.83 1wuu n HIS 229 Cb 0.48 -0.21 -0.09 0.00 1.12 0.00 0.00 29.99 31.30 1wuu n HIS 229 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1wuu n LEU 231 N -1.04 0.91 -2.10 2.41 4.77 -1.26 -4.95 117.00 115.73 1wuu n LEU 231 Ca 0.11 0.87 -0.22 0.00 -0.03 0.00 0.00 56.01 56.74 1wuu n LEU 231 Cb 0.32 -0.76 0.15 0.00 -2.33 0.00 0.00 43.42 40.80 1wuu n LEU 231 CO 0.28 -0.70 1.22 0.00 -1.33 0.00 0.00 177.39 176.85 1wuu n ALA 232 N 4.48 5.32 -0.45 -1.18 0.00 -1.26 -4.53 120.51 122.90 1wuu n ALA 232 Ca 0.34 -2.61 0.36 0.00 0.00 0.00 0.00 53.44 51.53 1wuu n ALA 232 Cb -0.05 -1.42 0.59 0.00 0.00 0.00 0.00 19.45 18.57 1wuu n ALA 232 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1wuu n SER 233 N -0.94 0.11 -0.35 0.00 3.41 -1.26 0.39 113.62 114.99 1wuu n SER 233 Ca 0.53 1.01 0.16 0.00 -0.26 0.00 0.00 58.87 60.31 1wuu n SER 233 Cb 1.48 -0.50 0.37 0.00 -0.26 0.00 0.00 64.21 65.30 1wuu n SER 233 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1wuu h SER 234 N 0.00 0.71 -0.18 4.04 0.02 -2.00 -1.79 113.55 114.35 1wuu h SER 234 Ca 0.73 0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 61.71 1wuu h SER 234 Cb 2.55 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 65.08 1wuu h SER 234 CO -0.25 0.15 -0.19 -0.33 -1.14 0.00 0.00 176.83 175.07 1wuu h GLU 235 N 0.63 0.61 0.20 3.45 4.39 0.71 -3.32 114.58 121.26 1wuu h GLU 235 Ca 0.63 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 60.11 1wuu h GLU 235 Cb 1.13 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.71 1wuu h GLU 235 CO -0.45 0.77 -0.40 -0.92 -1.16 0.00 0.00 179.01 176.84 1wuu h TYR 236 N 0.54 -1.15 -0.13 4.33 3.20 -1.41 0.53 116.97 122.88 1wuu h TYR 236 Ca 0.08 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.02 1wuu h TYR 236 Cb 0.64 0.48 -0.01 0.00 1.54 0.00 0.00 36.73 39.38 1wuu h TYR 236 CO 0.03 -0.48 0.11 -1.35 -1.64 0.00 0.00 178.16 174.82 1wuu h PRO 237 N -0.66 0.00 0.70 1.82 0.11 -1.69 -1.48 132.00 130.80 1wuu h PRO 237 Ca -0.02 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 1wuu h PRO 237 Cb 0.62 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.73 1wuu h PRO 237 CO -0.16 0.00 -0.40 0.28 -0.21 0.00 0.00 178.00 177.51 1wuu h VAL 238 N 0.00 0.19 -0.90 3.15 2.07 -1.37 -2.49 116.25 116.90 1wuu h VAL 238 Ca 0.06 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.68 1wuu h VAL 238 Cb 0.27 0.19 -0.08 0.00 -1.52 0.00 0.00 31.29 30.16 1wuu h VAL 238 CO -0.00 0.00 0.54 0.03 0.02 0.00 0.00 177.57 178.16 1wuu h ARG 239 N -1.02 0.86 -0.76 1.57 2.47 0.08 -0.88 114.38 116.70 1wuu h ARG 239 Ca -0.09 -0.05 0.13 0.00 -1.26 0.00 0.00 59.98 58.71 1wuu h ARG 239 Cb 0.81 -0.20 -0.09 0.00 -1.65 0.00 0.00 29.97 28.85 1wuu h ARG 239 CO 0.12 0.57 0.34 -0.09 0.56 0.00 0.00 179.97 181.47 1wuu h ARG 240 N 0.89 0.50 0.00 0.04 2.43 -1.21 -1.88 114.38 115.15 1wuu h ARG 240 Ca 0.44 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1wuu h ARG 240 Cb 0.40 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1wuu h ARG 240 CO -0.25 0.33 0.00 0.54 -1.51 0.00 0.00 179.97 179.08 1wuu n ARG 241 N -4.94 0.00 -0.21 0.20 1.74 -0.37 -1.14 116.66 111.94 1wuu n ARG 241 Ca 0.14 0.36 -0.05 0.00 -0.77 0.00 0.00 57.85 57.53 1wuu n ARG 241 Cb 0.38 -1.29 -0.05 0.00 -1.02 0.00 0.00 32.46 30.48 1wuu n ARG 241 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1wuu n GLN 242 N -1.49 -0.22 -0.39 5.56 6.02 -1.00 0.30 117.38 126.16 1wuu n GLN 242 Ca 0.00 0.92 -0.06 0.00 -0.01 0.00 0.00 57.00 57.85 1wuu n GLN 242 Cb 0.00 -1.36 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 1wuu n GLN 242 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1wuu h GLU 244 N -0.01 -0.86 0.00 0.00 5.08 0.61 -2.13 114.58 117.26 1wuu h GLU 244 Ca 0.25 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1wuu h GLU 244 Cb 0.51 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1wuu h GLU 244 CO -0.95 -0.57 0.00 0.39 -1.00 0.00 0.00 179.01 176.88 1wuu n GLU 245 N -5.51 0.00 0.00 2.33 1.02 0.20 -1.36 120.64 117.32 1wuu n GLU 245 Ca -0.12 0.73 0.00 0.00 -0.02 0.00 0.00 57.16 57.76 1wuu n GLU 245 Cb 0.40 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.61 1wuu n GLU 245 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1wuu n VAL 246 N -1.98 0.00 -0.18 2.62 0.31 -0.20 0.32 118.33 119.21 1wuu n VAL 246 Ca 0.00 0.41 0.04 0.00 -0.01 0.00 0.00 64.34 64.78 1wuu n VAL 246 Cb 0.00 -0.57 0.09 0.00 -0.91 0.00 0.00 33.84 32.45 1wuu n VAL 246 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wuu n ALA 247 N -1.52 0.15 -0.94 3.52 0.00 -0.49 0.14 120.51 121.38 1wuu n ALA 247 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1wuu n ALA 247 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1wuu n ALA 247 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1wuu n ARG 248 N -4.79 0.00 -0.06 0.00 0.63 0.96 -0.95 116.66 112.46 1wuu n ARG 248 Ca 0.09 0.25 0.03 0.00 -0.92 0.00 0.00 57.85 57.30 1wuu n ARG 248 Cb 0.29 -1.03 0.05 0.00 0.45 0.00 0.00 32.46 32.22 1wuu n ARG 248 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1wuu n ALA 249 N -0.83 0.09 0.27 5.13 0.00 0.38 0.40 120.51 125.96 1wuu n ALA 249 Ca 0.00 0.18 -0.02 0.00 0.00 0.00 0.00 53.44 53.61 1wuu n ALA 249 Cb 0.00 -0.14 0.11 0.00 0.00 0.00 0.00 19.45 19.43 1wuu n ALA 249 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wuu n LEU 250 N -3.95 3.34 -4.29 0.00 4.77 -0.20 -4.83 117.00 111.83 1wuu n LEU 250 Ca 0.04 -1.71 -0.38 0.00 -0.03 0.00 0.00 56.01 53.93 1wuu n LEU 250 Cb 0.14 -0.59 -0.08 0.00 -2.33 0.00 0.00 43.42 40.56 1wuu n LEU 250 CO -0.01 0.51 -0.18 0.61 -1.33 0.00 0.00 177.39 176.98 1wuu n GLY 251 N 0.10 -0.34 3.23 -0.72 0.00 1.33 -4.87 105.19 103.93 1wuu n GLY 251 Ca 0.14 0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1wuu n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuu s LYS 252 N -6.79 2.63 0.18 1.61 -0.14 -0.12 -5.04 119.74 112.07 1wuu s LYS 252 Ca 0.68 -0.85 -0.17 0.00 -1.36 0.00 0.00 55.97 54.27 1wuu s LYS 252 Cb -0.39 -2.12 0.13 0.00 -1.68 0.00 0.00 37.83 33.76 1wuu s LYS 252 CO 0.94 0.28 1.65 1.49 -0.76 0.00 0.00 175.35 178.95 1wuu h GLU 253 N 6.36 -0.03 -3.49 1.68 4.81 -1.89 -3.35 114.58 118.66 1wuu h GLU 253 Ca -0.27 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.85 1wuu h GLU 253 Cb 1.20 0.01 -0.17 0.00 0.63 0.00 0.00 28.75 30.41 1wuu h GLU 253 CO 0.47 -0.02 -0.37 -1.54 -0.73 0.00 0.00 179.01 176.82 1wuu s SER 254 N -5.20 -0.00 0.55 1.04 1.04 -1.26 -4.97 113.70 104.90 1wuu s SER 254 Ca -0.14 -0.31 0.22 0.00 0.48 0.00 0.00 55.95 56.20 1wuu s SER 254 Cb 0.16 0.30 1.20 0.00 0.10 0.00 0.00 66.02 67.77 1wuu s SER 254 CO 0.71 -0.56 1.64 -0.07 0.98 0.00 0.00 173.24 175.94 1wuu h LEU 255 N 3.46 0.00 -1.75 2.42 3.38 -1.85 2.23 115.31 123.20 1wuu h LEU 255 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1wuu h LEU 255 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1wuu h LEU 255 CO 0.47 0.00 0.00 -0.09 0.09 0.00 0.00 178.44 178.91 1wuu h ARG 256 N 0.00 0.00 0.00 1.13 9.65 -1.63 -2.31 114.38 121.22 1wuu h ARG 256 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1wuu h ARG 256 Cb 0.76 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.34 1wuu h ARG 256 CO 0.00 0.00 -0.33 0.39 2.80 0.00 0.00 179.97 182.83 1wuu n GLU 257 N -2.82 0.17 -3.64 0.20 4.71 0.75 -4.89 120.64 115.12 1wuu n GLU 257 Ca -0.00 0.08 -0.30 0.00 -0.01 0.00 0.00 57.16 56.93 1wuu n GLU 257 Cb 0.19 -1.64 -0.04 0.00 -1.01 0.00 0.00 31.44 28.94 1wuu n GLU 257 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1wuu s VAL 258 N -3.09 5.15 0.06 2.62 1.01 -0.87 -5.05 120.40 120.24 1wuu s VAL 258 Ca 0.10 -0.03 0.07 0.00 0.00 0.00 0.00 61.98 62.11 1wuu s VAL 258 Cb 0.15 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 1wuu s VAL 258 CO 0.65 -0.04 -0.16 -1.10 0.00 0.00 0.00 175.10 174.44 1wuu s GLN 259 N -2.88 2.06 0.25 2.72 -1.52 -1.26 -4.94 119.66 114.08 1wuu s GLN 259 Ca 0.41 -1.00 -0.11 0.00 -1.95 0.00 0.00 55.36 52.71 1wuu s GLN 259 Cb -0.12 -2.21 0.35 0.00 -0.22 0.00 0.00 33.01 30.82 1wuu s GLN 259 CO 0.26 0.53 1.59 1.25 -0.25 0.00 0.00 175.29 178.67 1wuu h LEU 260 N 4.30 -0.82 -0.61 2.90 5.85 -1.98 0.49 115.31 125.44 1wuu h LEU 260 Ca -0.48 0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1wuu h LEU 260 Cb 1.16 0.53 -0.03 0.00 0.37 0.00 0.00 40.66 42.69 1wuu h LEU 260 CO 0.48 -0.28 0.39 -0.33 -0.34 0.00 0.00 178.44 178.36 1wuu h GLU 261 N -0.01 0.82 0.00 1.25 3.07 -2.00 -1.65 114.58 116.06 1wuu h GLU 261 Ca 0.40 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1wuu h GLU 261 Cb 0.61 -0.18 -0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1wuu h GLU 261 CO -0.87 0.57 -0.01 0.93 -1.40 0.00 0.00 179.01 178.23 1wuu h GLU 262 N 0.83 0.00 -0.14 2.33 5.08 -0.63 -2.98 114.58 119.07 1wuu h GLU 262 Ca 0.22 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.62 1wuu h GLU 262 Cb -0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1wuu h GLU 262 CO -0.04 0.01 0.19 1.25 -1.00 0.00 0.00 179.01 179.42 1wuu h LEU 263 N 0.00 0.00 0.26 1.33 5.85 0.61 -2.28 115.31 121.08 1wuu h LEU 263 Ca -0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1wuu h LEU 263 Cb 0.47 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1wuu h LEU 263 CO 0.00 0.00 -0.20 -0.33 -0.34 0.00 0.00 178.44 177.57 1wuu h GLU 264 N 0.00 -0.46 -0.46 1.25 4.39 -1.64 -3.22 114.58 114.45 1wuu h GLU 264 Ca 0.07 0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.84 1wuu h GLU 264 Cb 0.45 0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 29.15 1wuu h GLU 264 CO -0.00 -0.31 -0.27 0.00 -1.16 0.00 0.00 179.01 177.27 1wuu n ALA 265 N -2.42 -0.29 0.30 3.43 0.00 -0.86 -0.00 120.51 120.67 1wuu n ALA 265 Ca -0.09 0.39 0.18 0.00 0.00 0.00 0.00 53.44 53.92 1wuu n ALA 265 Cb 0.24 -0.05 0.77 0.00 0.00 0.00 0.00 19.45 20.42 1wuu n ALA 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wuu h ALA 266 N 0.20 1.00 -0.67 0.00 0.00 -1.69 -3.33 119.26 114.78 1wuu h ALA 266 Ca 0.07 0.00 0.24 0.00 0.00 0.00 0.00 54.91 55.22 1wuu h ALA 266 Cb 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.86 1wuu h ALA 266 CO -0.43 0.00 0.21 -2.13 0.00 0.00 0.00 179.25 176.90 1wuu n ARG 267 N -2.93 -0.05 0.07 0.00 0.63 1.00 0.40 116.66 115.78 1wuu n ARG 267 Ca -0.00 0.95 0.00 0.00 -0.92 0.00 0.00 57.85 57.88 1wuu n ARG 267 Cb 0.23 -1.62 -0.05 0.00 0.45 0.00 0.00 32.46 31.47 1wuu n ARG 267 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1wuu h ASP 268 N 0.00 0.00 0.58 6.15 3.32 -1.78 -3.29 116.42 121.40 1wuu h ASP 268 Ca 0.49 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.41 1wuu h ASP 268 Cb 1.21 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 1wuu h ASP 268 CO -0.56 0.60 -0.62 -0.07 -1.72 0.00 0.00 179.24 176.87 1wuu h LEU 269 N 0.00 0.04 -8.97 1.55 3.38 0.76 -3.46 115.31 108.62 1wuu h LEU 269 Ca -0.09 -0.03 -0.47 0.00 0.09 0.00 0.00 57.88 57.38 1wuu h LEU 269 Cb 1.54 -0.01 -0.14 0.00 0.09 0.00 0.00 40.66 42.13 1wuu h LEU 269 CO 0.06 0.65 -0.72 0.68 0.09 0.00 0.00 178.44 179.20 1wuu s VAL 270 N -3.63 1.76 1.19 1.22 -7.23 0.15 -4.98 120.40 108.87 1wuu s VAL 270 Ca -0.02 -2.20 -0.15 0.00 -1.81 0.00 0.00 61.98 57.80 1wuu s VAL 270 Cb 0.13 -2.16 0.25 0.00 0.56 0.00 0.00 36.38 35.16 1wuu s VAL 270 CO 0.77 -0.51 0.72 -1.54 -0.31 0.00 0.00 175.10 174.22 1wuu n SER 271 N -0.44 -2.08 -0.01 4.85 3.41 -1.26 -4.77 113.62 113.32 1wuu n SER 271 Ca -0.07 -0.21 -0.17 0.00 -0.26 0.00 0.00 58.87 58.17 1wuu n SER 271 Cb 0.61 -1.16 -0.10 0.00 -0.26 0.00 0.00 64.21 63.30 1wuu n SER 271 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1wuu h LYS 272 N -2.60 0.44 -0.38 4.33 1.57 -1.99 -2.56 116.57 115.38 1wuu h LYS 272 Ca -0.61 -0.42 -0.10 0.00 -1.87 0.00 0.00 60.65 57.65 1wuu h LYS 272 Cb 1.35 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.75 1wuu h LYS 272 CO 0.47 1.07 -0.15 1.49 -0.57 0.00 0.00 179.45 181.76 1wuu h GLU 273 N -0.03 0.78 0.00 3.15 4.81 -1.99 -2.40 114.58 118.89 1wuu h GLU 273 Ca -0.06 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1wuu h GLU 273 Cb 1.22 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1wuu h GLU 273 CO 0.11 0.94 0.00 0.78 -0.73 0.00 0.00 179.01 180.11 1wuu h GLY 274 N 0.58 0.00 0.76 1.92 0.00 -1.94 -1.89 103.07 102.51 1wuu h GLY 274 Ca 0.09 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.25 1wuu h GLY 274 CO 0.05 0.00 -0.68 -2.75 0.00 0.00 0.00 176.54 173.16 1wuu h PHE 275 N 0.00 0.60 -0.55 5.60 3.57 -1.00 -3.15 116.94 122.01 1wuu h PHE 275 Ca 0.00 -0.36 -0.01 0.00 3.53 0.00 0.00 57.97 61.14 1wuu h PHE 275 Cb 0.33 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1wuu h PHE 275 CO 0.00 1.20 0.31 0.00 -2.23 0.00 0.00 178.31 177.59 1wuu h ARG 276 N -0.18 0.75 0.37 1.11 3.08 -1.19 -1.70 114.38 116.63 1wuu h ARG 276 Ca -0.10 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 1wuu h ARG 276 Cb 1.42 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.31 1wuu h ARG 276 CO 0.13 0.57 -0.30 0.00 -1.07 0.00 0.00 179.97 179.30 1wuu h ARG 277 N 0.73 -0.65 -0.12 0.04 2.47 -1.47 -0.00 114.38 115.37 1wuu h ARG 277 Ca 0.19 0.04 0.03 0.00 -1.26 0.00 0.00 59.98 58.99 1wuu h ARG 277 Cb 0.03 0.15 -0.04 0.00 -1.65 0.00 0.00 29.97 28.46 1wuu h ARG 277 CO -0.03 -0.44 -0.10 0.00 0.56 0.00 0.00 179.97 179.96 1wuu h ALA 278 N -0.16 0.00 -0.89 0.04 0.00 -1.53 -0.09 119.26 116.63 1wuu h ALA 278 Ca -0.03 0.05 0.23 0.00 0.00 0.00 0.00 54.91 55.16 1wuu h ALA 278 Cb 0.59 0.21 -0.13 0.00 0.00 0.00 0.00 17.79 18.46 1wuu h ALA 278 CO -0.02 -0.55 0.35 -0.09 0.00 0.00 0.00 179.25 178.94 1wuu h ARG 279 N -0.11 0.32 0.44 0.00 2.43 -1.17 0.81 114.38 117.09 1wuu h ARG 279 Ca 0.08 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1wuu h ARG 279 Cb 0.23 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1wuu h ARG 279 CO -0.19 0.21 -0.21 1.25 -1.51 0.00 0.00 179.97 179.52 1wuu h HIS 280 N 0.33 -0.55 0.17 2.20 2.76 0.54 -1.29 115.15 119.31 1wuu h HIS 280 Ca 0.56 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.72 1wuu h HIS 280 Cb 1.11 0.18 -0.01 0.00 1.55 0.00 0.00 27.41 30.24 1wuu h HIS 280 CO -0.17 -0.27 -0.20 0.28 -1.30 0.00 0.00 177.93 176.27 1wuu h VAL 281 N -0.74 0.00 -0.98 5.26 2.07 0.16 0.57 116.25 122.58 1wuu h VAL 281 Ca -0.06 0.00 0.34 0.00 0.82 0.00 0.00 66.70 67.80 1wuu h VAL 281 Cb 0.53 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.13 1wuu h VAL 281 CO 0.10 0.00 0.45 0.58 0.02 0.00 0.00 177.57 178.72 1wuu h VAL 282 N -0.38 0.16 -0.19 2.57 2.07 0.24 0.32 116.25 121.05 1wuu h VAL 282 Ca -0.02 -0.05 -0.16 0.00 0.82 0.00 0.00 66.70 67.28 1wuu h VAL 282 Cb 0.33 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1wuu h VAL 282 CO -0.04 0.03 -0.56 1.23 0.02 0.00 0.00 177.57 178.25 1wuu h GLY 283 N 0.16 0.63 1.33 2.17 0.00 -0.30 -3.24 103.07 103.81 1wuu h GLY 283 Ca 0.74 -0.73 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1wuu h GLY 283 CO -0.71 0.66 0.13 -2.09 0.00 0.00 0.00 176.54 174.53 1wuu h GLU 284 N 0.44 0.84 -0.30 4.80 4.57 0.40 -2.64 114.58 122.69 1wuu h GLU 284 Ca 0.01 -0.18 -0.10 0.00 -1.18 0.00 0.00 59.36 57.92 1wuu h GLU 284 Cb 1.11 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.56 1wuu h GLU 284 CO 0.11 0.76 -0.19 0.82 -1.18 0.00 0.00 179.01 179.33 1wuu h ILE 285 N 0.81 1.30 -0.12 2.32 2.04 -1.36 0.24 117.51 122.74 1wuu h ILE 285 Ca 0.18 -1.32 -0.02 0.00 1.00 0.00 0.00 64.86 64.70 1wuu h ILE 285 Cb 0.30 1.49 -0.00 0.00 -0.74 0.00 0.00 36.82 37.87 1wuu h ILE 285 CO -0.00 0.42 -0.01 -0.09 0.00 0.00 0.00 178.15 178.47 1wuu h ARG 286 N 0.41 0.22 -0.14 2.37 2.43 -1.59 -1.46 114.38 116.62 1wuu h ARG 286 Ca 0.06 -0.08 0.05 0.00 -0.81 0.00 0.00 59.98 59.20 1wuu h ARG 286 Cb 0.73 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.21 1wuu h ARG 286 CO 0.05 0.49 -0.20 0.00 -1.51 0.00 0.00 179.97 178.80 1wuu h ARG 287 N -0.07 -0.23 -0.50 0.20 3.08 -1.50 0.44 114.38 115.80 1wuu h ARG 287 Ca 0.03 0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.20 1wuu h ARG 287 Cb 0.39 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.41 1wuu h ARG 287 CO 0.01 -0.16 0.01 1.15 -1.07 0.00 0.00 179.97 179.91 1wuu h THR 288 N -0.24 0.61 -0.28 2.04 2.02 -0.41 0.29 112.91 116.93 1wuu h THR 288 Ca 0.10 -0.04 0.05 0.00 0.77 0.00 0.00 66.41 67.29 1wuu h THR 288 Cb 0.39 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.23 1wuu h THR 288 CO -0.28 0.02 -0.02 0.00 0.37 0.00 0.00 175.52 175.61 1wuu h ALA 289 N 1.44 0.23 -0.35 6.16 0.00 -0.06 -1.80 119.26 124.89 1wuu h ALA 289 Ca 0.25 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1wuu h ALA 289 Cb 0.38 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1wuu h ALA 289 CO -0.41 -0.43 0.16 1.96 0.00 0.00 0.00 179.25 180.53 1wuu h GLN 290 N 0.06 0.52 -0.90 0.00 4.20 0.91 -3.06 115.11 116.84 1wuu h GLN 290 Ca 0.14 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.78 1wuu h GLN 290 Cb 0.19 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 1wuu h GLN 290 CO -0.25 0.48 0.59 0.00 -0.67 0.00 0.00 178.83 178.98 1wuu h ALA 291 N 1.01 1.15 -0.65 3.87 0.00 -0.20 0.16 119.26 124.60 1wuu h ALA 291 Ca 0.12 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1wuu h ALA 291 Cb 0.14 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1wuu h ALA 291 CO -0.01 0.50 0.40 0.00 0.00 0.00 0.00 179.25 180.14 1wuu h ALA 292 N 1.34 0.85 0.07 0.00 0.00 -1.26 0.23 119.26 120.49 1wuu h ALA 292 Ca 0.34 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1wuu h ALA 292 Cb -0.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1wuu h ALA 292 CO -0.09 0.16 -0.03 0.00 0.00 0.00 0.00 179.25 179.29 1wuu h ALA 293 N 1.28 -0.09 -0.77 0.00 0.00 -1.33 0.67 119.26 119.02 1wuu h ALA 293 Ca 0.26 -0.06 0.18 0.00 0.00 0.00 0.00 54.91 55.29 1wuu h ALA 293 Cb 0.02 0.04 -0.12 0.00 0.00 0.00 0.00 17.79 17.72 1wuu h ALA 293 CO -0.10 -0.51 0.12 0.00 0.00 0.00 0.00 179.25 178.76 1wuu h ALA 294 N 0.75 0.95 0.21 0.00 0.00 0.08 0.35 119.26 121.59 1wuu h ALA 294 Ca -0.01 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1wuu h ALA 294 Cb 0.15 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1wuu h ALA 294 CO 0.02 -0.40 -0.10 1.25 0.00 0.00 0.00 179.25 180.02 1wuu h LEU 295 N 0.19 -0.24 -0.30 0.00 5.85 -0.25 3.04 115.31 123.61 1wuu h LEU 295 Ca 0.44 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 59.04 1wuu h LEU 295 Cb 0.79 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.80 1wuu h LEU 295 CO -0.59 0.07 -0.29 0.03 -0.34 0.00 0.00 178.44 177.32 1wuu h ARG 296 N -0.56 -0.26 -0.21 1.25 3.08 -0.03 0.41 114.38 118.07 1wuu h ARG 296 Ca -0.03 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.10 1wuu h ARG 296 Cb 0.41 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 1wuu h ARG 296 CO 0.05 -0.17 0.19 -0.09 -1.07 0.00 0.00 179.97 178.88 1wuu h ARG 297 N -0.27 0.00 0.00 0.04 2.43 -0.30 -3.46 114.38 112.82 1wuu h ARG 297 Ca 0.15 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1wuu h ARG 297 Cb 0.51 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1wuu h ARG 297 CO -0.45 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.42 1wuu n GLY 298 N -1.48 0.62 3.43 2.80 0.00 0.15 -4.98 105.19 105.72 1wuu n GLY 298 Ca 0.02 -0.70 -0.44 0.00 0.00 0.00 0.00 46.02 44.90 1wuu n GLY 298 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wuu s ASP 299 N -2.64 6.78 0.29 1.61 3.68 0.99 -4.74 116.67 122.63 1wuu s ASP 299 Ca 0.00 -2.42 0.04 0.00 2.13 0.00 0.00 52.55 52.30 1wuu s ASP 299 Cb 0.00 -2.36 0.43 0.00 -1.45 0.00 0.00 42.92 39.54 1wuu s ASP 299 CO 0.00 -0.88 1.71 1.88 0.13 0.00 0.00 175.17 178.00 1wuu h TYR 300 N 8.21 0.41 0.57 -5.34 0.99 -1.92 -1.11 116.97 118.79 1wuu h TYR 300 Ca 0.18 -0.10 -0.03 0.00 2.00 0.00 0.00 58.73 60.79 1wuu h TYR 300 Cb 0.99 -0.10 0.01 0.00 1.00 0.00 0.00 36.73 38.63 1wuu h TYR 300 CO 1.11 0.66 -0.27 0.00 -0.00 0.00 0.00 178.16 179.66 1wuu h ARG 301 N 0.31 -0.74 -0.50 4.88 3.08 -1.92 -0.30 114.38 119.19 1wuu h ARG 301 Ca 0.04 0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.15 1wuu h ARG 301 Cb 0.75 0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.94 1wuu h ARG 301 CO 0.06 -0.46 0.32 0.00 -1.07 0.00 0.00 179.97 178.82 1wuu h ALA 302 N -0.43 0.63 -0.75 0.04 0.00 -1.93 -1.99 119.26 114.83 1wuu h ALA 302 Ca -0.08 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.91 1wuu h ALA 302 Cb 0.61 -0.19 -0.12 0.00 0.00 0.00 0.00 17.79 18.09 1wuu h ALA 302 CO 0.13 0.05 -0.42 0.35 0.00 0.00 0.00 179.25 179.36 1wuu h PHE 303 N 0.65 -1.23 -0.69 0.00 3.57 -0.92 0.11 116.94 118.43 1wuu h PHE 303 Ca 0.19 0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 1wuu h PHE 303 Cb -0.05 0.64 -0.03 0.00 2.79 0.00 0.00 35.95 39.30 1wuu h PHE 303 CO -0.05 -0.41 0.33 0.78 -2.23 0.00 0.00 178.31 176.74 1wuu h GLY 304 N -0.13 1.05 0.88 2.40 0.00 -0.67 -1.48 103.07 105.13 1wuu h GLY 304 Ca 0.24 -0.50 0.03 0.00 0.00 0.00 0.00 47.33 47.09 1wuu h GLY 304 CO -0.80 0.48 0.46 3.21 0.00 0.00 0.00 176.54 179.89 1wuu h ARG 305 N 0.98 0.88 -1.75 4.80 3.08 -0.21 -1.32 114.38 120.83 1wuu h ARG 305 Ca 0.24 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1wuu h ARG 305 Cb 0.10 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1wuu h ARG 305 CO -0.03 0.58 0.00 1.28 -1.07 0.00 0.00 179.97 180.73 1wuu n LEU 306 N -4.64 0.87 0.00 3.04 4.77 0.17 -2.12 117.00 119.09 1wuu n LEU 306 Ca 0.08 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 1wuu n LEU 306 Cb 0.08 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1wuu n LEU 306 CO 0.33 0.15 0.00 0.52 -1.33 0.00 0.00 177.39 177.06 1wuu n VAL 308 N 0.95 0.00 -0.30 4.08 0.31 -0.50 -1.18 118.33 121.70 1wuu n VAL 308 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 1wuu n VAL 308 Cb 0.14 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.13 1wuu n VAL 308 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1wuu h GLU 309 N 0.00 1.19 -0.06 5.55 5.08 -1.69 -1.34 114.58 123.31 1wuu h GLU 309 Ca 0.00 -0.19 0.03 0.00 -1.00 0.00 0.00 59.36 58.20 1wuu h GLU 309 Cb 0.00 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.01 1wuu h GLU 309 CO 0.00 0.93 -0.14 1.03 -1.00 0.00 0.00 179.01 179.82 1wuu h SER 310 N 1.16 -0.43 0.09 1.42 0.87 -1.42 -0.09 113.55 115.15 1wuu h SER 310 Ca 0.28 0.07 0.02 0.00 -1.23 0.00 0.00 61.79 60.93 1wuu h SER 310 Cb 0.15 0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.26 1wuu h SER 310 CO -0.03 -0.19 -0.27 -0.74 -0.53 0.00 0.00 176.83 175.06 1wuu h HIS 311 N -0.21 -0.74 -0.50 2.24 -0.00 -1.70 0.93 115.15 115.18 1wuu h HIS 311 Ca 0.07 0.02 0.10 0.00 -0.00 0.00 0.00 60.37 60.55 1wuu h HIS 311 Cb 0.31 0.31 -0.08 0.00 -0.00 0.00 0.00 27.41 27.95 1wuu h HIS 311 CO -0.23 -0.38 -0.01 0.00 -0.00 0.00 0.00 177.93 177.32 1wuu h ARG 312 N -0.47 0.11 -0.47 5.26 3.08 -1.07 1.14 114.38 121.96 1wuu h ARG 312 Ca 0.04 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.17 1wuu h ARG 312 Cb 0.51 -0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.46 1wuu h ARG 312 CO -0.18 0.07 -0.04 1.03 -1.07 0.00 0.00 179.97 179.79 1wuu h SER 313 N 0.11 -0.27 0.05 7.04 0.87 -0.04 1.11 113.55 122.42 1wuu h SER 313 Ca 0.25 0.12 -0.06 0.00 -1.23 0.00 0.00 61.79 60.87 1wuu h SER 313 Cb 0.38 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 1wuu h SER 313 CO -0.42 -0.09 -0.18 -0.07 -0.53 0.00 0.00 176.83 175.54 1wuu h LEU 314 N 0.08 0.24 0.09 2.23 3.38 0.53 0.19 115.31 122.04 1wuu h LEU 314 Ca 0.23 -0.06 -0.32 0.00 0.09 0.00 0.00 57.88 57.83 1wuu h LEU 314 Cb 0.35 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1wuu h LEU 314 CO -0.42 0.44 -1.70 -0.09 0.09 0.00 0.00 178.44 176.77 1wuu h ARG 315 N 0.24 0.18 0.00 1.13 2.43 0.23 -2.08 114.38 116.51 1wuu h ARG 315 Ca 0.04 -0.31 -0.41 0.00 -0.81 0.00 0.00 59.98 58.49 1wuu h ARG 315 Cb 0.46 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.06 1wuu h ARG 315 CO 0.03 0.97 -2.48 -0.25 -1.51 0.00 0.00 179.97 176.73 1wuu n ASP 316 N -3.35 1.98 -0.08 -3.80 9.92 0.37 -4.14 116.55 117.45 1wuu n ASP 316 Ca -0.20 0.04 -0.19 0.00 -0.53 0.00 0.00 54.79 53.91 1wuu n ASP 316 Cb 1.04 -0.57 -0.12 0.00 -0.64 0.00 0.00 41.12 40.83 1wuu n ASP 316 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 1wuu h ASP 317 N -0.35 0.04 1.02 -2.24 3.32 -0.75 -3.40 116.42 114.06 1wuu h ASP 317 Ca -0.62 -0.73 -0.19 0.00 0.02 0.00 0.00 57.03 55.51 1wuu h ASP 317 Cb 1.80 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 41.31 1wuu h ASP 317 CO -0.20 1.33 -1.01 0.22 -1.72 0.00 0.00 179.24 177.85 1wuu h TYR 318 N -0.92 0.00 -5.63 4.55 3.20 -1.62 -3.32 116.97 113.23 1wuu h TYR 318 Ca -0.22 0.00 -0.31 0.00 3.14 0.00 0.00 58.73 61.35 1wuu h TYR 318 Cb 1.25 0.00 0.17 0.00 1.54 0.00 0.00 36.73 39.68 1wuu h TYR 318 CO 0.17 0.85 -0.83 0.39 -1.64 0.00 0.00 178.16 177.10 1wuu n GLU 319 N -3.24 -4.13 0.00 1.82 1.02 -0.94 -4.93 120.64 110.23 1wuu n GLU 319 Ca -0.03 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 1wuu n GLU 319 Cb 0.90 -5.69 0.00 0.00 -0.02 0.00 0.00 31.44 26.63 1wuu n GLU 319 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1wuu n VAL 320 N -3.73 0.11 -0.23 2.62 0.24 -0.83 -4.97 118.33 111.54 1wuu n VAL 320 Ca -0.18 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.61 1wuu n VAL 320 Cb 0.64 1.02 0.00 0.00 -1.47 0.00 0.00 33.84 34.03 1wuu n VAL 320 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1wuu n SER 321 N -0.06 -0.20 -3.52 -1.34 2.88 -1.23 0.23 113.62 110.38 1wuu n SER 321 Ca 0.00 -0.23 -0.12 0.00 -1.33 0.00 0.00 58.87 57.19 1wuu n SER 321 Cb 0.05 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.47 1wuu n SER 321 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wuu h PRO 323 N 2.44 0.24 -0.34 0.00 0.11 -1.99 0.24 132.00 132.70 1wuu h PRO 323 Ca -0.23 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 1wuu h PRO 323 Cb 1.20 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1wuu h PRO 323 CO 0.34 0.16 0.08 0.93 -0.21 0.00 0.00 178.00 179.30 1wuu h GLU 324 N 0.24 0.49 -0.06 1.05 3.07 -1.98 0.36 114.58 117.75 1wuu h GLU 324 Ca 0.34 -0.07 -0.04 0.00 -0.50 0.00 0.00 59.36 59.09 1wuu h GLU 324 Cb 0.53 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1wuu h GLU 324 CO -0.45 0.45 -0.10 -0.07 -1.40 0.00 0.00 179.01 177.45 1wuu h LEU 325 N 0.48 0.20 -1.29 1.33 3.38 -1.29 -2.14 115.31 115.98 1wuu h LEU 325 Ca 0.12 -0.54 -0.07 0.00 0.09 0.00 0.00 57.88 57.48 1wuu h LEU 325 Cb 0.19 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1wuu h LEU 325 CO -0.00 0.70 -0.27 0.44 0.09 0.00 0.00 178.44 179.40 1wuu h ASP 326 N -0.30 0.13 -0.04 -0.43 3.32 -0.26 -1.81 116.42 117.04 1wuu h ASP 326 Ca 0.01 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1wuu h ASP 326 Cb 0.66 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.17 1wuu h ASP 326 CO 0.02 0.40 0.00 -0.61 -1.72 0.00 0.00 179.24 177.34 1wuu h GLN 327 N 0.12 0.07 -0.79 3.56 4.15 -0.28 -1.62 115.11 120.33 1wuu h GLN 327 Ca 0.02 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.42 1wuu h GLN 327 Cb 0.54 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.19 1wuu h GLN 327 CO 0.04 0.34 0.51 -0.07 -1.93 0.00 0.00 178.83 177.72 1wuu h LEU 328 N -0.20 0.91 0.04 -2.39 3.38 -1.18 -1.81 115.31 114.06 1wuu h LEU 328 Ca 0.01 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1wuu h LEU 328 Cb 0.30 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1wuu h LEU 328 CO 0.00 0.67 -0.02 0.58 0.09 0.00 0.00 178.44 179.76 1wuu h VAL 329 N 1.07 1.18 -0.50 1.22 2.07 -1.29 -1.55 116.25 118.44 1wuu h VAL 329 Ca 0.29 -0.74 0.09 0.00 0.82 0.00 0.00 66.70 67.16 1wuu h VAL 329 Cb -0.11 1.67 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 1wuu h VAL 329 CO -0.06 0.19 0.04 -0.08 0.02 0.00 0.00 177.57 177.67 1wuu h GLU 330 N -0.38 0.15 -0.56 1.57 4.81 -1.27 0.23 114.58 119.13 1wuu h GLU 330 Ca -0.01 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1wuu h GLU 330 Cb 0.35 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.64 1wuu h GLU 330 CO 0.01 0.10 0.26 0.00 -0.73 0.00 0.00 179.01 178.65 1wuu h ALA 331 N 1.43 0.72 0.20 2.92 0.00 -1.28 -2.97 119.26 120.27 1wuu h ALA 331 Ca 0.25 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1wuu h ALA 331 Cb 0.37 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1wuu h ALA 331 CO -0.39 -0.12 -0.09 0.00 0.00 0.00 0.00 179.25 178.65 1wuu h ALA 332 N 1.33 -0.26 -0.79 0.00 0.00 -0.58 -3.19 119.26 115.77 1wuu h ALA 332 Ca 0.26 -0.14 0.23 0.00 0.00 0.00 0.00 54.91 55.26 1wuu h ALA 332 Cb 0.23 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1wuu h ALA 332 CO -0.21 -0.54 0.66 -0.07 0.00 0.00 0.00 179.25 179.08 1wuu h LEU 333 N -0.48 0.00 -0.13 0.00 3.38 -0.42 0.18 115.31 117.84 1wuu h LEU 333 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1wuu h LEU 333 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1wuu h LEU 333 CO 0.04 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1wuu n ALA 334 N -2.56 2.13 -2.63 1.53 0.00 -1.14 -4.74 120.51 113.09 1wuu n ALA 334 Ca 0.16 -0.02 -0.40 0.00 0.00 0.00 0.00 53.44 53.18 1wuu n ALA 334 Cb 0.94 -1.44 -0.07 0.00 0.00 0.00 0.00 19.45 18.88 1wuu n ALA 334 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wuu s VAL 335 N -3.11 5.05 0.18 0.00 1.01 0.62 -5.01 120.40 119.14 1wuu s VAL 335 Ca 0.10 0.99 -0.31 0.00 0.00 0.00 0.00 61.98 62.76 1wuu s VAL 335 Cb 0.13 -3.87 -0.10 0.00 0.00 0.00 0.00 36.38 32.54 1wuu s VAL 335 CO 0.52 0.09 1.53 -2.16 0.00 0.00 0.00 175.10 175.08 1wuu s PRO 336 N 2.17 4.23 0.00 2.72 0.04 -1.26 -1.64 135.00 141.26 1wuu s PRO 336 Ca 0.24 2.33 0.00 0.00 0.04 0.00 0.00 61.00 63.61 1wuu s PRO 336 Cb -0.16 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1wuu s PRO 336 CO 0.09 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 176.99 1wuu n GLY 337 N 3.37 2.11 3.71 0.56 0.00 -1.26 -4.86 105.19 108.82 1wuu n GLY 337 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1wuu n GLY 337 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wuu s VAL 338 N -2.05 4.35 -0.14 1.61 1.01 -0.65 -0.24 120.40 124.29 1wuu s VAL 338 Ca 0.00 1.68 0.02 0.00 0.00 0.00 0.00 61.98 63.68 1wuu s VAL 338 Cb 0.00 -4.08 -0.24 0.00 0.00 0.00 0.00 36.38 32.07 1wuu s VAL 338 CO 0.00 0.11 0.29 -1.22 0.00 0.00 0.00 175.10 174.28 1wuu n TYR 339 N 4.11 0.83 -3.60 5.22 4.02 0.21 -4.94 117.16 123.00 1wuu n TYR 339 Ca 0.08 0.21 -0.03 0.00 -0.01 0.00 0.00 57.90 58.15 1wuu n TYR 339 Cb 0.48 -1.12 -0.02 0.00 -0.02 0.00 0.00 39.34 38.66 1wuu n TYR 339 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1wuu s GLY 340 N -5.65 -0.31 0.00 2.72 0.00 -0.91 -3.96 107.32 99.21 1wuu s GLY 340 Ca -0.19 1.45 -0.18 0.00 0.00 0.00 0.00 44.72 45.79 1wuu s GLY 340 CO 0.76 0.46 0.40 -0.45 0.00 0.00 0.00 173.10 174.27 1wuu s SER 341 N -2.32 -0.29 0.00 1.64 0.15 -1.26 -0.43 113.70 111.19 1wuu s SER 341 Ca 0.10 0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.89 1wuu s SER 341 Cb 0.00 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.70 1wuu s SER 341 CO -0.04 -0.56 0.00 -2.11 1.20 0.00 0.00 173.24 171.73 1wuu n ARG 342 N 0.90 0.00 -3.70 5.44 1.85 -0.61 -4.11 116.66 116.43 1wuu n ARG 342 Ca -0.20 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.60 1wuu n ARG 342 Cb 0.58 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.97 1wuu n ARG 342 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 1wuu s THR 344 N 2.43 0.00 0.00 8.89 -1.32 -0.30 -0.79 115.64 124.55 1wuu s THR 344 Ca 0.00 -0.52 0.00 0.00 -1.21 0.00 0.00 61.69 59.96 1wuu s THR 344 Cb 0.00 -1.77 0.00 0.00 -1.51 0.00 0.00 72.50 69.22 1wuu s THR 344 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 1wuu n GLY 345 N -0.42 -0.99 0.27 6.08 0.00 -1.24 -3.96 105.19 104.92 1wuu n GLY 345 Ca -0.07 -1.19 0.10 0.00 0.00 0.00 0.00 46.02 44.86 1wuu n GLY 345 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wuu h GLY 346 N 0.00 0.00 0.00 -0.02 0.00 -1.94 -3.46 103.07 97.65 1wuu h GLY 346 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wuu h GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1wuu n GLY 347 N -1.33 -1.28 2.53 4.60 0.00 -1.25 -4.93 105.19 103.53 1wuu n GLY 347 Ca -0.03 -2.10 -0.21 0.00 0.00 0.00 0.00 46.02 43.68 1wuu n GLY 347 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wuu n PHE 348 N 0.00 -0.35 0.00 1.61 0.99 0.64 -4.67 117.46 115.68 1wuu n PHE 348 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1wuu n PHE 348 Cb 0.00 -3.63 0.00 0.00 -1.00 0.00 0.00 39.48 34.85 1wuu n PHE 348 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1wuu n GLY 349 N -0.64 0.85 7.00 1.37 0.00 -1.26 -3.08 105.19 109.42 1wuu n GLY 349 Ca -0.22 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1wuu n GLY 349 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wuu n GLY 350 N 0.00 0.97 3.68 -0.02 0.00 -0.36 -4.89 105.19 104.58 1wuu n GLY 350 Ca 0.00 -0.58 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 1wuu n GLY 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wuu s THR 352 N -2.39 2.03 -0.10 0.00 -4.23 -0.71 -1.15 115.64 109.09 1wuu s THR 352 Ca 0.34 -1.26 0.02 0.00 -1.18 0.00 0.00 61.69 59.61 1wuu s THR 352 Cb -0.04 -1.72 -0.01 0.00 1.34 0.00 0.00 72.50 72.07 1wuu s THR 352 CO 0.21 0.41 -0.16 0.54 -0.54 0.00 0.00 174.62 175.09 1wuu s VAL 353 N -0.73 2.84 0.00 2.29 0.11 0.03 -0.67 120.40 124.28 1wuu s VAL 353 Ca 0.11 -0.76 0.07 0.00 -2.93 0.00 0.00 61.98 58.47 1wuu s VAL 353 Cb -0.10 -2.15 -0.02 0.00 -1.53 0.00 0.00 36.38 32.58 1wuu s VAL 353 CO 0.01 0.55 -0.22 -0.89 -3.33 0.00 0.00 175.10 171.22 1wuu s THR 354 N 0.08 1.71 -0.13 5.04 2.01 0.27 -1.57 115.64 123.06 1wuu s THR 354 Ca -0.07 -1.02 0.01 0.00 0.31 0.00 0.00 61.69 60.93 1wuu s THR 354 Cb -0.15 -1.44 -0.01 0.00 0.01 0.00 0.00 72.50 70.91 1wuu s THR 354 CO 0.05 0.40 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.99 1wuu s LEU 355 N -0.72 2.46 0.00 4.42 2.96 0.43 0.70 118.68 128.93 1wuu s LEU 355 Ca 0.08 -0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 53.54 1wuu s LEU 355 Cb -0.08 -1.53 0.01 0.00 0.50 0.00 0.00 46.19 45.08 1wuu s LEU 355 CO 0.00 0.15 0.09 0.00 -1.32 0.00 0.00 176.35 175.27 1wuu n LEU 356 N 3.64 0.00 -4.67 -0.68 -0.00 -0.85 0.66 117.00 115.10 1wuu n LEU 356 Ca -0.19 -0.34 -0.40 0.00 -0.00 0.00 0.00 56.01 55.08 1wuu n LEU 356 Cb 0.53 0.46 -0.05 0.00 -0.00 0.00 0.00 43.42 44.35 1wuu n LEU 356 CO 0.29 -0.10 0.44 -1.61 -0.00 0.00 0.00 177.39 176.41 1wuu s GLU 357 N -2.03 4.28 0.63 1.47 2.02 0.67 -1.53 118.70 124.21 1wuu s GLU 357 Ca 0.02 0.77 0.22 0.00 0.02 0.00 0.00 54.97 56.01 1wuu s GLU 357 Cb -0.01 -3.55 1.08 0.00 0.10 0.00 0.00 34.13 31.76 1wuu s GLU 357 CO 0.02 -0.20 1.58 0.00 0.02 0.00 0.00 175.26 176.68 1wuu h ALA 358 N 7.29 2.07 -0.17 5.21 0.00 -1.45 0.86 119.26 133.06 1wuu h ALA 358 Ca -0.33 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 1wuu h ALA 358 Cb 1.15 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1wuu h ALA 358 CO 0.79 -0.89 -0.46 0.66 0.00 0.00 0.00 179.25 179.35 1wuu h SER 359 N 0.00 0.46 1.61 0.00 4.64 -1.92 -3.24 113.55 115.10 1wuu h SER 359 Ca 0.17 -0.21 -0.04 0.00 -0.47 0.00 0.00 61.79 61.23 1wuu h SER 359 Cb 1.59 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.55 1wuu h SER 359 CO -0.00 0.85 -0.20 0.00 -0.87 0.00 0.00 176.83 176.61 1wuu h ALA 360 N 1.17 0.89 -0.96 5.18 0.00 0.43 -3.39 119.26 122.57 1wuu h ALA 360 Ca 0.02 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 54.94 1wuu h ALA 360 Cb 0.94 -0.03 -0.18 0.00 0.00 0.00 0.00 17.79 18.52 1wuu h ALA 360 CO 0.08 0.24 -0.27 0.00 0.00 0.00 0.00 179.25 179.30 1wuu n ALA 361 N -2.16 0.14 0.06 0.00 0.00 -1.21 -1.16 120.51 116.19 1wuu n ALA 361 Ca 0.03 1.03 -0.13 0.00 0.00 0.00 0.00 53.44 54.37 1wuu n ALA 361 Cb 0.57 -0.58 -0.08 0.00 0.00 0.00 0.00 19.45 19.36 1wuu n ALA 361 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1wuu h PRO 362 N 0.00 -0.11 -0.38 0.00 0.11 -1.84 -3.06 132.00 126.73 1wuu h PRO 362 Ca 0.43 0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.61 1wuu h PRO 362 Cb 0.67 0.02 -0.05 0.00 0.11 0.00 0.00 31.00 31.75 1wuu h PRO 362 CO -0.98 0.06 0.05 1.25 -0.21 0.00 0.00 178.00 178.17 1wuu h HIS 363 N -0.25 0.08 0.00 0.65 -0.00 -1.42 -1.46 115.15 112.75 1wuu h HIS 363 Ca -0.01 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1wuu h HIS 363 Cb 0.21 0.02 0.00 0.00 -0.00 0.00 0.00 27.41 27.64 1wuu h HIS 363 CO -0.03 -0.01 0.00 0.00 -0.00 0.00 0.00 177.93 177.89 1wuu n ALA 364 N -2.46 0.59 0.00 5.26 0.00 -0.47 0.12 120.51 123.55 1wuu n ALA 364 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1wuu n ALA 364 Cb 0.18 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.13 1wuu n ALA 364 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wuu n ARG 366 N 0.07 0.00 -0.25 0.00 1.74 -0.55 0.10 116.66 117.78 1wuu n ARG 366 Ca 0.00 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.09 1wuu n ARG 366 Cb 0.00 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 31.53 1wuu n ARG 366 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1wuu h HIS 367 N 0.00 -0.33 -0.60 -1.55 2.76 0.67 0.61 115.15 116.70 1wuu h HIS 367 Ca 0.00 0.06 -0.05 0.00 -2.20 0.00 0.00 60.37 58.19 1wuu h HIS 367 Cb 0.00 0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.19 1wuu h HIS 367 CO 0.00 -0.30 0.19 0.82 -1.30 0.00 0.00 177.93 177.34 1wuu h ILE 368 N 0.01 1.23 -0.29 6.26 2.04 0.46 -2.55 117.51 124.67 1wuu h ILE 368 Ca 0.35 -0.78 -0.06 0.00 1.00 0.00 0.00 64.86 65.37 1wuu h ILE 368 Cb 0.55 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1wuu h ILE 368 CO -0.72 0.30 -0.06 -0.61 0.00 0.00 0.00 178.15 177.05 1wuu h GLN 369 N 0.88 0.56 -0.23 2.37 5.75 -1.24 -0.35 115.11 122.85 1wuu h GLN 369 Ca 0.20 -0.21 0.06 0.00 -0.15 0.00 0.00 58.65 58.55 1wuu h GLN 369 Cb 0.25 -0.03 -0.06 0.00 1.07 0.00 0.00 27.48 28.70 1wuu h GLN 369 CO -0.01 0.75 -0.16 0.93 -2.65 0.00 0.00 178.83 177.69 1wuu h GLU 370 N 0.32 -0.15 -0.01 1.69 5.08 -0.79 -2.08 114.58 118.64 1wuu h GLU 370 Ca 0.07 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1wuu h GLU 370 Cb 0.54 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1wuu h GLU 370 CO 0.03 -0.10 -0.01 0.72 -1.00 0.00 0.00 179.01 178.64 1wuu n HIS 371 N -5.32 0.00 -3.32 4.33 8.25 -0.98 -4.79 115.22 113.39 1wuu n HIS 371 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 1wuu n HIS 371 Cb 0.24 -0.02 -0.09 0.00 1.12 0.00 0.00 29.99 31.24 1wuu n HIS 371 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1wuu s TYR 372 N -2.05 3.21 -0.08 4.41 5.04 -0.15 -4.93 117.35 122.79 1wuu s TYR 372 Ca 0.41 0.18 -0.01 0.00 -2.44 0.00 0.00 57.07 55.20 1wuu s TYR 372 Cb 0.21 -2.76 0.01 0.00 0.35 0.00 0.00 41.96 39.77 1wuu s TYR 372 CO 0.36 -0.43 2.25 0.41 -1.34 0.00 0.00 175.55 176.80 1wuu n GLY 373 N 4.81 2.97 0.69 8.97 0.00 -1.26 -4.74 105.19 116.63 1wuu n GLY 373 Ca -0.07 -0.46 -0.01 0.00 0.00 0.00 0.00 46.02 45.48 1wuu n GLY 373 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wuu n GLY 374 N 1.37 1.32 3.19 -0.02 0.00 -1.26 -5.13 105.19 104.65 1wuu n GLY 374 Ca 0.14 -0.98 -0.38 0.00 0.00 0.00 0.00 46.02 44.79 1wuu n GLY 374 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wuu s THR 375 N -2.56 3.75 0.30 2.61 2.01 -1.26 -5.05 115.64 115.44 1wuu s THR 375 Ca 0.04 -1.74 -0.19 0.00 0.31 0.00 0.00 61.69 60.11 1wuu s THR 375 Cb -0.01 -3.42 -0.09 0.00 0.01 0.00 0.00 72.50 68.99 1wuu s THR 375 CO 0.01 -0.60 0.79 0.00 -0.69 0.00 0.00 174.62 174.13 1wuu s ALA 376 N 1.29 3.30 -0.03 7.40 0.00 -1.25 -4.33 121.76 128.14 1wuu s ALA 376 Ca 0.05 0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.25 1wuu s ALA 376 Cb -0.23 -2.90 -0.03 0.00 0.00 0.00 0.00 23.12 19.96 1wuu s ALA 376 CO -0.01 0.28 -0.13 0.99 0.00 0.00 0.00 175.76 176.89 1wuu s THR 377 N -1.80 3.20 0.19 0.00 2.01 0.97 -4.90 115.64 115.31 1wuu s THR 377 Ca 0.51 -0.78 0.08 0.00 0.31 0.00 0.00 61.69 61.81 1wuu s THR 377 Cb -0.13 -2.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.03 1wuu s THR 377 CO 0.19 0.51 -0.05 -0.36 -0.69 0.00 0.00 174.62 174.22 1wuu s PHE 378 N -0.82 2.72 -0.07 4.92 0.40 -1.26 0.14 117.98 124.01 1wuu s PHE 378 Ca 0.13 -0.19 -0.03 0.00 -0.60 0.00 0.00 56.93 56.24 1wuu s PHE 378 Cb -0.11 -1.31 0.04 0.00 0.51 0.00 0.00 43.02 42.15 1wuu s PHE 378 CO 0.03 0.53 0.15 0.71 0.70 0.00 0.00 175.22 177.34 1wuu s TYR 379 N -1.79 -0.17 -0.85 0.36 1.51 0.15 -3.42 117.35 113.13 1wuu s TYR 379 Ca 0.27 0.49 -0.08 0.00 -1.01 0.00 0.00 57.07 56.74 1wuu s TYR 379 Cb -0.09 -0.07 0.22 0.00 -0.11 0.00 0.00 41.96 41.92 1wuu s TYR 379 CO 0.17 -0.16 0.77 -0.51 -1.11 0.00 0.00 175.55 174.71 1wuu s LEU 380 N 1.09 6.11 0.35 -1.29 1.43 -1.26 -0.25 118.68 124.85 1wuu s LEU 380 Ca -0.08 -3.11 -0.27 0.00 -1.03 0.00 0.00 54.13 49.63 1wuu s LEU 380 Cb -0.11 -2.07 -0.09 0.00 0.03 0.00 0.00 46.19 43.95 1wuu s LEU 380 CO -0.06 -0.39 1.16 -0.44 0.23 0.00 0.00 176.35 176.85 1wuu s SER 381 N 1.21 6.81 -0.05 2.29 0.01 -0.59 -4.97 113.70 118.42 1wuu s SER 381 Ca 0.22 2.34 0.03 0.00 1.31 0.00 0.00 55.95 59.86 1wuu s SER 381 Cb -0.12 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.50 1wuu s SER 381 CO -0.08 -0.47 -0.13 -1.10 0.41 0.00 0.00 173.24 171.86 1wuu s GLN 382 N -1.98 1.59 -0.08 12.44 -1.52 -1.26 -4.24 119.66 124.61 1wuu s GLN 382 Ca 0.52 -0.47 -0.33 0.00 -1.95 0.00 0.00 55.36 53.14 1wuu s GLN 382 Cb -0.32 -1.36 -0.11 0.00 -0.22 0.00 0.00 33.01 31.01 1wuu s GLN 382 CO 0.40 0.13 1.95 0.00 -0.25 0.00 0.00 175.29 177.51 1wuu n ALA 383 N 3.46 1.14 -3.42 6.09 0.00 -1.26 -4.29 120.51 122.22 1wuu n ALA 383 Ca -0.20 0.21 -0.21 0.00 0.00 0.00 0.00 53.44 53.25 1wuu n ALA 383 Cb 0.53 -2.58 0.03 0.00 0.00 0.00 0.00 19.45 17.42 1wuu n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wuu n ALA 384 N 7.37 0.81 -2.04 0.00 0.00 -0.80 0.32 120.51 126.17 1wuu n ALA 384 Ca 0.23 -1.68 -0.20 0.00 0.00 0.00 0.00 53.44 51.79 1wuu n ALA 384 Cb 0.33 0.58 0.02 0.00 0.00 0.00 0.00 19.45 20.39 1wuu n ALA 384 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1wuu s ASP 385 N -3.66 5.48 0.00 0.00 -1.08 -1.26 -2.64 116.67 113.50 1wuu s ASP 385 Ca 0.36 -0.12 0.00 0.00 -0.52 0.00 0.00 52.55 52.26 1wuu s ASP 385 Cb -0.03 -0.88 0.00 0.00 -1.46 0.00 0.00 42.92 40.55 1wuu s ASP 385 CO 0.23 -0.95 0.00 0.61 0.52 0.00 0.00 175.17 175.58 1wuu n GLY 386 N -2.13 0.27 3.77 2.66 0.00 -0.44 -4.69 105.19 104.63 1wuu n GLY 386 Ca 0.07 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 1wuu n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wuu s ALA 387 N -3.59 3.60 0.14 4.61 0.00 -0.85 -4.71 121.76 120.96 1wuu s ALA 387 Ca 0.00 1.50 0.02 0.00 0.00 0.00 0.00 51.96 53.47 1wuu s ALA 387 Cb 0.00 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 1wuu s ALA 387 CO 0.00 -0.94 -0.03 0.15 0.00 0.00 0.00 175.76 174.94 1wuu s LYS 388 N -1.53 0.98 -0.17 0.00 1.02 -0.92 -5.03 119.74 114.10 1wuu s LYS 388 Ca 0.55 -1.44 -0.08 0.00 0.02 0.00 0.00 55.97 55.02 1wuu s LYS 388 Cb -0.45 -0.23 -0.04 0.00 -0.52 0.00 0.00 37.83 36.59 1wuu s LYS 388 CO 0.56 -0.08 0.10 0.08 -0.92 0.00 0.00 175.35 175.09 1wuu s VAL 389 N -3.65 5.13 -0.25 3.17 1.01 -1.26 -2.66 120.40 121.89 1wuu s VAL 389 Ca 0.19 0.08 -0.14 0.00 0.00 0.00 0.00 61.98 62.11 1wuu s VAL 389 Cb 0.06 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1wuu s VAL 389 CO 0.00 0.50 0.33 -0.76 0.00 0.00 0.00 175.10 175.17 1wuu s LEU 390 N -0.07 4.08 -0.23 3.92 1.43 0.30 -4.95 118.68 123.15 1wuu s LEU 390 Ca 0.08 0.29 -0.11 0.00 -1.03 0.00 0.00 54.13 53.35 1wuu s LEU 390 Cb -0.12 -2.37 -0.05 0.00 0.03 0.00 0.00 46.19 43.69 1wuu s LEU 390 CO 0.00 -0.10 0.20 0.00 0.23 0.00 0.00 176.35 176.68