#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wuu s ALA 2 N 0.00 3.41 0.02 -1.41 0.00 -1.26 -4.85 121.76 117.67 1wuu s ALA 2 Ca 0.00 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.69 1wuu s ALA 2 Cb 0.00 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 1wuu s ALA 2 CO 0.00 0.51 0.16 0.00 0.00 0.00 0.00 175.76 176.43 1wuu s ALA 3 N -1.71 3.85 0.10 0.00 0.00 -1.26 -4.54 121.76 118.20 1wuu s ALA 3 Ca 0.29 -0.83 -0.31 0.00 0.00 0.00 0.00 51.96 51.11 1wuu s ALA 3 Cb -0.10 -1.76 -0.07 0.00 0.00 0.00 0.00 23.12 21.19 1wuu s ALA 3 CO 0.21 0.76 1.31 -0.51 0.00 0.00 0.00 175.76 177.53 1wuu s LEU 4 N -2.10 4.38 -0.56 0.00 1.02 0.88 -4.95 118.68 117.35 1wuu s LEU 4 Ca 0.29 2.21 -0.28 0.00 0.02 0.00 0.00 54.13 56.37 1wuu s LEU 4 Cb -0.13 -3.59 0.02 0.00 0.02 0.00 0.00 46.19 42.52 1wuu s LEU 4 CO 0.20 -0.57 1.31 0.00 0.02 0.00 0.00 176.35 177.32 1wuu s ARG 5 N 0.97 3.42 -0.09 1.70 1.70 -1.26 -4.71 118.95 120.67 1wuu s ARG 5 Ca 0.62 0.39 -0.30 0.00 -0.47 0.00 0.00 55.73 55.97 1wuu s ARG 5 Cb -0.34 -4.07 -0.03 0.00 -0.57 0.00 0.00 34.95 29.94 1wuu s ARG 5 CO 0.30 -1.79 1.36 -0.65 -1.08 0.00 0.00 175.30 173.44 1wuu s GLN 6 N 5.21 4.25 0.31 3.89 -0.21 -1.26 -4.99 119.66 126.86 1wuu s GLN 6 Ca 0.48 1.83 -0.29 0.00 0.02 0.00 0.00 55.36 57.41 1wuu s GLN 6 Cb -0.09 -3.74 -0.10 0.00 1.00 0.00 0.00 33.01 30.08 1wuu s GLN 6 CO 0.26 -0.67 1.20 -1.25 -2.12 0.00 0.00 175.29 172.71 1wuu s PRO 7 N 3.19 4.49 0.31 2.91 0.04 -1.26 -5.02 135.00 139.66 1wuu s PRO 7 Ca 0.60 2.00 -0.07 0.00 0.04 0.00 0.00 61.00 63.57 1wuu s PRO 7 Cb -0.26 -3.12 -0.06 0.00 0.04 0.00 0.00 34.50 31.09 1wuu s PRO 7 CO 0.21 0.01 0.62 -0.65 0.04 0.00 0.00 177.00 177.23 1wuu s GLN 8 N -1.63 3.70 0.02 4.56 -0.21 -1.26 -4.85 119.66 119.99 1wuu s GLN 8 Ca 0.47 0.18 -0.03 0.00 0.02 0.00 0.00 55.36 56.00 1wuu s GLN 8 Cb -0.36 -2.57 -0.01 0.00 1.00 0.00 0.00 33.01 31.08 1wuu s GLN 8 CO 0.47 0.16 0.70 0.28 -2.12 0.00 0.00 175.29 174.77 1wuu n VAL 9 N -0.91 -0.06 -0.27 1.09 0.31 -1.26 -0.43 118.33 116.79 1wuu n VAL 9 Ca -0.00 1.06 0.08 0.00 -0.01 0.00 0.00 64.34 65.47 1wuu n VAL 9 Cb 0.54 -1.39 0.16 0.00 -0.91 0.00 0.00 33.84 32.24 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 -2.78 0.28 -0.10 3.52 0.00 -1.26 0.69 120.51 120.87 1wuu n ALA 10 Ca 0.00 0.83 -0.13 0.00 0.00 0.00 0.00 53.44 54.15 1wuu n ALA 10 Cb 0.02 -0.55 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 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 0.72 0.01 0.00 5.08 -1.13 -1.81 114.58 117.46 1wuu h GLU 11 Ca 0.41 -0.36 0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1wuu h GLU 11 Cb 0.75 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.97 1wuu h GLU 11 CO -0.76 0.98 -0.19 -0.07 -1.00 0.00 0.00 179.01 177.97 1wuu h LEU 12 N 0.48 -0.56 -1.84 1.33 3.38 0.77 -1.50 115.31 117.37 1wuu h LEU 12 Ca 0.06 0.08 0.10 0.00 0.09 0.00 0.00 57.88 58.20 1wuu h LEU 12 Cb 0.82 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1wuu h LEU 12 CO 0.07 -0.26 0.31 0.25 0.09 0.00 0.00 178.44 178.90 1wuu h LEU 13 N -0.31 0.16 0.02 1.67 5.85 -0.01 -1.02 115.31 121.68 1wuu h LEU 13 Ca 0.06 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1wuu h LEU 13 Cb 0.39 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1wuu h LEU 13 CO -0.17 0.10 -0.01 0.00 -0.34 0.00 0.00 178.44 178.01 1wuu h ALA 14 N 1.77 -0.03 -0.73 1.25 0.00 -0.69 -1.29 119.26 119.55 1wuu h ALA 14 Ca 0.21 -0.24 0.16 0.00 0.00 0.00 0.00 54.91 55.04 1wuu h ALA 14 Cb 0.59 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.26 1wuu h ALA 14 CO -0.03 -0.27 0.01 1.49 0.00 0.00 0.00 179.25 180.44 1wuu h GLU 15 N -0.52 0.11 -0.48 0.00 4.81 -0.27 0.22 114.58 118.45 1wuu h GLU 15 Ca -0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1wuu h GLU 15 Cb 0.49 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1wuu h GLU 15 CO 0.01 0.07 0.31 0.00 -0.73 0.00 0.00 179.01 178.66 1wuu h ALA 16 N 1.68 0.62 -0.06 2.92 0.00 -1.16 -0.75 119.26 122.50 1wuu h ALA 16 Ca 0.39 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1wuu h ALA 16 Cb 0.68 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1wuu h ALA 16 CO -0.63 0.08 0.03 0.00 0.00 0.00 0.00 179.25 178.73 1wuu h ARG 17 N 0.65 0.09 0.01 0.00 3.08 0.21 -2.43 114.38 115.99 1wuu h ARG 17 Ca 0.18 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.22 1wuu h ARG 17 Cb -0.04 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1wuu h ARG 17 CO -0.04 0.21 -0.22 -0.09 -1.07 0.00 0.00 179.97 178.76 1wuu h ARG 18 N -0.05 -0.27 -0.93 0.04 2.43 -0.38 0.80 114.38 116.02 1wuu h ARG 18 Ca 0.02 0.02 0.27 0.00 -0.81 0.00 0.00 59.98 59.48 1wuu h ARG 18 Cb 0.15 0.06 -0.15 0.00 -0.42 0.00 0.00 29.97 29.62 1wuu h ARG 18 CO -0.00 -0.18 0.34 0.00 -1.51 0.00 0.00 179.97 178.61 1wuu h ALA 19 N -1.06 1.51 0.25 2.80 0.00 -1.21 0.19 119.26 121.74 1wuu h ALA 19 Ca 0.00 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1wuu h ALA 19 Cb 0.30 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1wuu h ALA 19 CO -0.15 -0.52 -0.12 0.35 0.00 0.00 0.00 179.25 178.81 1wuu h PHE 20 N 0.23 -0.31 -0.01 0.00 3.57 -0.86 0.11 116.94 119.67 1wuu h PHE 20 Ca 0.62 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 62.12 1wuu h PHE 20 Cb 1.33 0.10 -0.00 0.00 2.79 0.00 0.00 35.95 40.18 1wuu h PHE 20 CO -0.19 0.03 0.11 0.00 -2.23 0.00 0.00 178.31 176.03 1wuu h ARG 21 N -0.72 0.00 0.00 1.11 3.08 0.23 0.31 114.38 118.38 1wuu h ARG 21 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1wuu h ARG 21 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1wuu h ARG 21 CO 0.06 0.00 -0.01 0.93 -1.07 0.00 0.00 179.97 179.88 1wuu h GLU 22 N 0.00 0.00 -0.28 0.04 5.08 -0.34 -3.23 114.58 115.84 1wuu h GLU 22 Ca 0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1wuu h GLU 22 Cb 0.22 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.39 1wuu h GLU 22 CO -0.00 0.00 -0.30 1.49 -1.00 0.00 0.00 179.01 179.20 1wuu h GLU 23 N -0.19 -0.28 -0.01 2.33 4.57 -0.28 -2.96 114.58 117.75 1wuu h GLU 23 Ca 0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1wuu h GLU 23 Cb 0.01 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.66 1wuu h GLU 23 CO 0.00 -0.19 -0.51 1.19 -1.18 0.00 0.00 179.01 178.32 1wuu n PHE 24 N -5.41 0.00 -2.63 0.92 3.72 0.05 -4.95 117.46 109.17 1wuu n PHE 24 Ca -0.01 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.25 1wuu n PHE 24 Cb 0.32 -0.04 0.02 0.00 -0.94 0.00 0.00 39.48 38.84 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 1.42 -0.10 3.75 1.37 0.00 -1.12 -5.00 105.19 105.51 1wuu n GLY 25 Ca 0.09 -0.24 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.87 -1.37 0.20 4.61 0.00 -1.25 -5.02 121.76 116.05 1wuu s ALA 26 Ca 0.15 -0.05 -0.28 0.00 0.00 0.00 0.00 51.96 51.78 1wuu s ALA 26 Cb -0.07 0.81 -0.08 0.00 0.00 0.00 0.00 23.12 23.78 1wuu s ALA 26 CO 0.18 -0.98 0.86 -1.21 0.00 0.00 0.00 175.76 174.61 1wuu s GLU 27 N -3.77 4.71 0.33 0.00 2.02 -1.26 -3.33 118.70 117.40 1wuu s GLU 27 Ca 0.09 1.32 -0.27 0.00 0.02 0.00 0.00 54.97 56.13 1wuu s GLU 27 Cb -0.04 -3.27 -0.09 0.00 0.10 0.00 0.00 34.13 30.82 1wuu s GLU 27 CO 0.02 0.54 1.09 -1.25 0.02 0.00 0.00 175.26 175.68 1wuu s PRO 28 N -1.14 4.43 -0.04 0.39 0.04 -1.26 -4.96 135.00 132.45 1wuu s PRO 28 Ca 0.38 1.72 -0.00 0.00 0.04 0.00 0.00 61.00 63.15 1wuu s PRO 28 Cb -0.24 -2.93 -0.26 0.00 0.04 0.00 0.00 34.50 31.10 1wuu s PRO 28 CO 0.29 0.04 0.68 0.93 0.04 0.00 0.00 177.00 178.98 1wuu h GLU 29 N 3.28 0.19 -5.86 4.56 5.08 -1.91 -3.48 114.58 116.45 1wuu h GLU 29 Ca -0.47 -0.33 -0.50 0.00 -1.00 0.00 0.00 59.36 57.05 1wuu h GLU 29 Cb 1.22 0.12 -0.21 0.00 0.50 0.00 0.00 28.75 30.38 1wuu h GLU 29 CO 0.65 1.00 -0.81 -0.51 -1.00 0.00 0.00 179.01 178.34 1wuu s LEU 30 N -6.79 2.30 -0.04 1.33 1.43 0.33 -4.70 118.68 112.54 1wuu s LEU 30 Ca -0.12 -0.68 -0.06 0.00 -1.03 0.00 0.00 54.13 52.24 1wuu s LEU 30 Cb 0.07 -0.75 0.01 0.00 0.03 0.00 0.00 46.19 45.55 1wuu s LEU 30 CO 0.82 0.00 0.16 0.00 0.23 0.00 0.00 176.35 177.56 1wuu s ALA 31 N -1.27 -0.38 0.07 4.21 0.00 -1.25 0.23 121.76 123.36 1wuu s ALA 31 Ca 0.04 0.25 -0.17 0.00 0.00 0.00 0.00 51.96 52.08 1wuu s ALA 31 Cb -0.10 -0.13 0.04 0.00 0.00 0.00 0.00 23.12 22.92 1wuu s ALA 31 CO 0.04 -0.13 0.41 0.14 0.00 0.00 0.00 175.76 176.22 1wuu s VAL 32 N -0.45 0.06 -0.00 0.00 -7.23 -0.63 -0.90 120.40 111.25 1wuu s VAL 32 Ca -0.05 -0.49 0.02 0.00 -1.81 0.00 0.00 61.98 59.64 1wuu s VAL 32 Cb -0.04 -1.01 -0.00 0.00 0.56 0.00 0.00 36.38 35.89 1wuu s VAL 32 CO 0.01 -0.27 -0.06 -0.94 -0.31 0.00 0.00 175.10 173.53 1wuu s SER 33 N -2.23 0.66 -0.02 4.85 1.04 -0.05 -0.38 113.70 117.57 1wuu s SER 33 Ca -0.03 -0.11 0.03 0.00 0.48 0.00 0.00 55.95 56.32 1wuu s SER 33 Cb -0.00 -0.07 -0.00 0.00 0.10 0.00 0.00 66.02 66.05 1wuu s SER 33 CO -0.05 0.06 -0.11 0.00 0.98 0.00 0.00 173.24 174.13 1wuu s ALA 34 N -0.15 0.97 0.21 5.32 0.00 0.36 -0.19 121.76 128.27 1wuu s ALA 34 Ca 0.02 -0.43 0.03 0.00 0.00 0.00 0.00 51.96 51.59 1wuu s ALA 34 Cb -0.02 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 1wuu s ALA 34 CO -0.00 0.19 0.34 -1.25 0.00 0.00 0.00 175.76 175.04 1wuu s PRO 35 N 0.02 3.45 0.00 0.00 0.04 -1.26 0.22 135.00 137.46 1wuu s PRO 35 Ca -0.01 -0.64 0.00 0.00 0.04 0.00 0.00 61.00 60.40 1wuu s PRO 35 Cb -0.07 -2.90 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1wuu s PRO 35 CO 0.00 0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.90 1wuu n GLY 36 N -1.03 -0.48 3.61 0.56 0.00 -0.13 -4.37 105.19 103.36 1wuu n GLY 36 Ca -0.08 -1.72 -0.08 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.01 0.43 -0.13 1.61 1.04 0.36 -1.83 118.95 119.42 1wuu s ARG 37 Ca 0.00 0.20 0.01 0.00 -1.04 0.00 0.00 55.73 54.91 1wuu s ARG 37 Cb 0.00 0.21 -0.01 0.00 -2.04 0.00 0.00 34.95 33.11 1wuu s ARG 37 CO 0.00 -0.11 -0.17 0.54 -0.04 0.00 0.00 175.30 175.52 1wuu s VAL 38 N -0.73 2.67 -0.20 4.99 0.11 -1.26 -4.08 120.40 121.90 1wuu s VAL 38 Ca 0.02 -0.79 -0.19 0.00 -2.93 0.00 0.00 61.98 58.09 1wuu s VAL 38 Cb -0.02 -2.10 -0.03 0.00 -1.53 0.00 0.00 36.38 32.70 1wuu s VAL 38 CO -0.03 0.53 0.55 0.21 -3.33 0.00 0.00 175.10 173.03 1wuu s ASN 39 N 0.50 6.59 0.12 3.54 3.04 -1.26 -4.53 114.94 122.95 1wuu s ASN 39 Ca -0.11 0.71 0.07 0.00 0.04 0.00 0.00 52.86 53.57 1wuu s ASN 39 Cb -0.16 -2.31 -0.19 0.00 -1.54 0.00 0.00 41.25 37.05 1wuu s ASN 39 CO 0.05 -0.21 1.29 -0.07 -3.04 0.00 0.00 177.10 175.12 1wuu h LEU 40 N 8.03 0.00 -7.00 3.21 3.38 -1.39 -3.44 115.31 118.11 1wuu h LEU 40 Ca -0.33 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.70 1wuu h LEU 40 Cb 1.15 -0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.71 1wuu h LEU 40 CO 0.75 0.99 0.46 -0.51 0.09 0.00 0.00 178.44 180.22 1wuu s ILE 41 N -2.74 0.00 0.00 1.22 2.07 -1.20 -5.02 121.20 115.53 1wuu s ILE 41 Ca 0.01 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.25 1wuu s ILE 41 Cb 0.10 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.69 1wuu s ILE 41 CO 0.82 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 174.46 1wuu n GLY 42 N 0.42 0.60 3.73 1.50 0.00 -1.26 -0.61 105.19 109.57 1wuu n GLY 42 Ca -0.11 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 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 0.71 4.63 -1.64 1.61 2.56 -1.26 -3.81 118.70 121.50 1wuu s GLU 43 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 54.97 56.32 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 0.19 0.00 0.72 -0.56 0.00 0.00 175.26 175.61 1wuu n HIS 44 N 2.96 -0.76 -0.04 5.30 8.25 -1.26 -4.83 115.22 124.85 1wuu n HIS 44 Ca 0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.47 1wuu n HIS 44 Cb 0.50 -3.57 -0.11 0.00 1.12 0.00 0.00 29.99 27.93 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 -3.80 0.53 0.06 1.59 -2.24 -1.25 -4.68 114.28 104.49 1wuu n THR 45 Ca -0.22 -0.47 -0.07 0.00 -2.27 0.00 0.00 64.05 61.03 1wuu n THR 45 Cb 0.66 -0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 68.54 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 -0.62 0.00 3.42 2.03 -1.85 0.35 116.42 119.74 1wuu h ASP 46 Ca -0.21 0.06 0.00 0.00 -0.73 0.00 0.00 57.03 56.15 1wuu h ASP 46 Cb 1.33 0.23 0.00 0.00 -0.83 0.00 0.00 39.33 40.06 1wuu h ASP 46 CO 0.01 -0.23 0.00 0.00 -1.03 0.00 0.00 179.24 178.00 1wuu n TYR 47 N -3.63 0.00 -0.51 4.15 0.18 -1.26 -1.15 117.16 114.94 1wuu n TYR 47 Ca -0.04 0.00 0.09 0.00 1.88 0.00 0.00 57.90 59.84 1wuu n TYR 47 Cb 0.17 -0.20 0.31 0.00 -0.38 0.00 0.00 39.34 39.23 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 -1.20 4.19 -2.39 9.48 3.02 0.11 -4.93 115.26 123.55 1wuu n ASN 48 Ca 0.00 -2.30 -0.20 0.00 -0.03 0.00 0.00 54.58 52.05 1wuu n ASN 48 Cb 0.00 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.68 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 1.04 -2.44 0.00 3.52 6.02 -0.30 -2.78 117.38 122.45 1wuu n GLN 49 Ca 0.23 0.92 0.00 0.00 -0.01 0.00 0.00 57.00 58.13 1wuu n GLN 49 Cb 0.75 -5.54 0.00 0.00 1.02 0.00 0.00 30.24 26.47 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 -1.15 0.89 3.51 1.08 0.00 -0.51 -3.72 105.19 105.29 1wuu n GLY 50 Ca -0.19 -1.78 -0.30 0.00 0.00 0.00 0.00 46.02 43.75 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 2.79 0.05 0.99 1.43 -1.26 -1.36 118.68 121.32 1wuu s LEU 51 Ca 0.00 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1wuu s LEU 51 Cb 0.00 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 1wuu s LEU 51 CO 0.00 0.19 -0.06 0.68 0.23 0.00 0.00 176.35 177.39 1wuu s VAL 52 N -1.14 0.41 -0.45 -1.59 -7.23 -0.94 -4.49 120.40 104.98 1wuu s VAL 52 Ca 0.18 -1.34 0.06 0.00 -1.81 0.00 0.00 61.98 59.07 1wuu s VAL 52 Cb -0.11 -0.91 0.21 0.00 0.56 0.00 0.00 36.38 36.14 1wuu s VAL 52 CO 0.10 -0.62 0.48 -0.11 -0.31 0.00 0.00 175.10 174.64 1wuu n LEU 53 N 0.94 0.56 0.00 1.32 7.94 0.22 -1.79 117.00 126.21 1wuu n LEU 53 Ca -0.19 -4.70 0.00 0.00 -1.11 0.00 0.00 56.01 50.01 1wuu n LEU 53 Cb 0.57 0.34 0.00 0.00 0.53 0.00 0.00 43.42 44.87 1wuu n LEU 53 CO 0.24 1.97 0.00 -0.81 -1.11 0.00 0.00 177.39 177.67 1wuu n PRO 54 N 1.92 3.22 -4.25 1.96 -0.04 -1.24 -0.98 135.00 135.58 1wuu n PRO 54 Ca 0.25 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.44 1wuu n PRO 54 Cb 0.48 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.85 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 -3.24 3.03 0.19 0.55 0.00 -1.26 -1.51 121.76 119.52 1wuu s ALA 56 Ca 0.00 -1.40 0.10 0.00 0.00 0.00 0.00 51.96 50.67 1wuu s ALA 56 Cb 0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 1wuu s ALA 56 CO 0.00 0.50 -0.17 -0.51 0.00 0.00 0.00 175.76 175.58 1wuu s LEU 57 N -2.76 2.69 0.00 0.00 1.43 -0.76 -1.57 118.68 117.71 1wuu s LEU 57 Ca 0.25 -0.73 0.11 0.00 -1.03 0.00 0.00 54.13 52.73 1wuu s LEU 57 Cb -0.09 -1.40 0.50 0.00 0.03 0.00 0.00 46.19 45.23 1wuu s LEU 57 CO 0.16 0.11 1.33 -0.62 0.23 0.00 0.00 176.35 177.57 1wuu n GLU 58 N 0.15 0.04 -2.91 1.70 1.02 -1.26 -4.23 120.64 115.15 1wuu n GLU 58 Ca -0.12 0.28 -0.33 0.00 -0.02 0.00 0.00 57.16 56.97 1wuu n GLU 58 Cb 0.56 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.41 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 -2.90 4.00 -0.05 -4.62 1.43 -1.26 -4.81 118.68 110.48 1wuu s LEU 59 Ca 0.07 1.59 0.07 0.00 -1.03 0.00 0.00 54.13 54.82 1wuu s LEU 59 Cb 0.07 -4.37 -0.01 0.00 0.03 0.00 0.00 46.19 41.91 1wuu s LEU 59 CO 0.20 -0.30 -0.25 -0.89 0.23 0.00 0.00 176.35 175.34 1wuu s THR 61 N -2.08 2.04 -0.03 5.49 2.01 0.58 -0.95 115.64 122.70 1wuu s THR 61 Ca 0.59 -1.08 0.05 0.00 0.31 0.00 0.00 61.69 61.56 1wuu s THR 61 Cb -0.10 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.68 1wuu s THR 61 CO 0.15 0.57 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.78 1wuu s VAL 62 N -0.30 1.44 -0.14 3.82 1.01 0.32 0.14 120.40 126.69 1wuu s VAL 62 Ca 0.01 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1wuu s VAL 62 Cb -0.13 -1.21 0.05 0.00 0.00 0.00 0.00 36.38 35.09 1wuu s VAL 62 CO 0.02 0.41 0.07 -0.22 0.00 0.00 0.00 175.10 175.39 1wuu s LEU 63 N -0.24 0.40 0.07 3.92 0.20 0.49 0.17 118.68 123.69 1wuu s LEU 63 Ca 0.03 -0.44 0.05 0.00 0.69 0.00 0.00 54.13 54.45 1wuu s LEU 63 Cb -0.09 -0.27 -0.04 0.00 -0.43 0.00 0.00 46.19 45.37 1wuu s LEU 63 CO 0.00 -0.31 -0.04 0.68 -0.29 0.00 0.00 176.35 176.40 1wuu s VAL 64 N 2.11 3.81 0.18 1.68 -7.23 -1.08 -1.60 120.40 118.26 1wuu s VAL 64 Ca 0.03 -0.99 -0.19 0.00 -1.81 0.00 0.00 61.98 59.01 1wuu s VAL 64 Cb -0.15 -2.78 0.07 0.00 0.56 0.00 0.00 36.38 34.08 1wuu s VAL 64 CO -0.07 0.18 0.93 0.61 -0.31 0.00 0.00 175.10 176.44 1wuu n GLY 65 N 0.82 0.68 3.20 2.32 0.00 0.63 -1.67 105.19 111.17 1wuu n GLY 65 Ca -0.12 -1.13 -0.13 0.00 0.00 0.00 0.00 46.02 44.63 1wuu n GLY 65 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wuu s SER 66 N -3.21 -0.26 1.36 1.61 0.15 0.17 0.12 113.70 113.64 1wuu s SER 66 Ca 0.21 0.40 -0.19 0.00 0.70 0.00 0.00 55.95 57.07 1wuu s SER 66 Cb -0.03 0.50 0.35 0.00 -1.71 0.00 0.00 66.02 65.14 1wuu s SER 66 CO 0.05 -0.22 0.94 -2.65 1.20 0.00 0.00 173.24 172.56 1wuu n PRO 67 N 2.34 -3.88 -3.77 5.44 -0.02 -1.26 0.11 135.00 133.95 1wuu n PRO 67 Ca -0.16 -1.13 -0.13 0.00 -2.02 0.00 0.00 63.50 60.05 1wuu n PRO 67 Cb 0.57 -2.04 -0.14 0.00 -0.02 0.00 0.00 33.50 31.88 1wuu n PRO 67 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1wuu s ARG 68 N -4.75 0.10 0.00 -0.52 0.52 0.52 -4.43 118.95 110.38 1wuu s ARG 68 Ca 0.68 0.30 0.22 0.00 -0.52 0.00 0.00 55.73 56.41 1wuu s ARG 68 Cb -0.19 -0.11 0.91 0.00 0.52 0.00 0.00 34.95 36.08 1wuu s ARG 68 CO 0.61 -0.12 1.64 1.63 0.02 0.00 0.00 175.30 179.08 1wuu n LYS 69 N 3.87 1.54 0.17 3.54 5.02 -1.26 -3.68 118.16 127.34 1wuu n LYS 69 Ca -0.23 -0.80 0.04 0.00 -2.02 0.00 0.00 58.31 55.31 1wuu n LYS 69 Cb 0.54 -1.39 0.20 0.00 -0.02 0.00 0.00 35.03 34.36 1wuu n LYS 69 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1wuu h ASP 70 N 1.67 0.00 0.00 4.39 3.45 -1.91 -3.48 116.42 120.54 1wuu h ASP 70 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1wuu h ASP 70 Cb 0.36 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.13 1wuu h ASP 70 CO 0.00 0.43 0.00 0.61 -1.57 0.00 0.00 179.24 178.71 1wuu n GLY 71 N 0.69 1.64 0.31 2.75 0.00 -1.26 -5.02 105.19 104.30 1wuu n GLY 71 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 1wuu n GLY 71 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wuu n LEU 72 N 0.00 0.00 -3.81 0.99 -0.00 -1.26 -3.40 117.00 109.52 1wuu n LEU 72 Ca 0.00 -0.27 -0.21 0.00 -0.00 0.00 0.00 56.01 55.53 1wuu n LEU 72 Cb 0.00 0.02 -0.17 0.00 -0.00 0.00 0.00 43.42 43.27 1wuu n LEU 72 CO 0.00 -0.08 -0.39 -0.69 -0.00 0.00 0.00 177.39 176.23 1wuu s VAL 73 N -0.99 0.41 -0.06 1.47 1.01 0.43 -1.72 120.40 120.96 1wuu s VAL 73 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1wuu s VAL 73 Cb -0.00 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 35.88 1wuu s VAL 73 CO 0.00 0.24 -0.07 -0.94 0.00 0.00 0.00 175.10 174.33 1wuu s SER 74 N 1.55 1.43 0.22 3.32 1.04 -0.92 0.13 113.70 120.47 1wuu s SER 74 Ca -0.01 -0.20 0.11 0.00 0.48 0.00 0.00 55.95 56.32 1wuu s SER 74 Cb -0.13 -0.62 -0.05 0.00 0.10 0.00 0.00 66.02 65.33 1wuu s SER 74 CO -0.03 -0.05 -0.19 -0.76 0.98 0.00 0.00 173.24 173.19 1wuu s LEU 75 N 1.03 2.62 -0.04 2.42 1.43 0.42 -2.27 118.68 124.30 1wuu s LEU 75 Ca -0.09 -0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 52.16 1wuu s LEU 75 Cb -0.14 -1.28 0.03 0.00 0.03 0.00 0.00 46.19 44.83 1wuu s LEU 75 CO -0.00 0.09 0.02 -0.22 0.23 0.00 0.00 176.35 176.47 1wuu s LEU 76 N -2.99 0.73 0.02 1.79 2.96 -0.62 -2.22 118.68 118.36 1wuu s LEU 76 Ca 0.25 0.01 -0.06 0.00 -0.22 0.00 0.00 54.13 54.11 1wuu s LEU 76 Cb -0.07 -0.20 -0.05 0.00 0.50 0.00 0.00 46.19 46.37 1wuu s LEU 76 CO 0.13 -0.17 0.26 -0.89 -1.32 0.00 0.00 176.35 174.36 1wuu s THR 77 N 1.55 5.31 -0.98 3.68 2.01 0.30 -0.40 115.64 127.11 1wuu s THR 77 Ca -0.03 0.11 0.22 0.00 0.31 0.00 0.00 61.69 62.30 1wuu s THR 77 Cb -0.13 -3.57 -0.20 0.00 0.01 0.00 0.00 72.50 68.61 1wuu s THR 77 CO -0.03 0.33 0.96 0.41 -0.69 0.00 0.00 174.62 175.60 1wuu n THR 78 N 1.00 0.00 -2.24 -0.82 -1.04 -0.34 -4.83 114.28 106.01 1wuu n THR 78 Ca -0.10 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.49 1wuu n THR 78 Cb 0.53 0.89 -0.03 0.00 -1.82 0.00 0.00 70.33 69.90 1wuu n THR 78 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1wuu s SER 79 N -3.03 6.94 -0.02 8.00 0.15 -1.26 -4.95 113.70 119.54 1wuu s SER 79 Ca 0.08 2.50 -0.02 0.00 0.70 0.00 0.00 55.95 59.20 1wuu s SER 79 Cb 0.16 -2.63 -0.27 0.00 -1.71 0.00 0.00 66.02 61.57 1wuu s SER 79 CO 0.85 -0.42 0.78 -0.33 1.20 0.00 0.00 173.24 175.31 1wuu h GLU 80 N 4.02 0.24 0.00 5.44 5.08 -2.00 -3.36 114.58 123.99 1wuu h GLU 80 Ca -0.47 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 57.48 1wuu h GLU 80 Cb 1.22 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1wuu h GLU 80 CO 0.69 1.08 0.00 0.41 -1.00 0.00 0.00 179.01 180.19 1wuu n GLY 81 N 1.70 -0.71 3.38 -3.84 0.00 -1.26 -4.78 105.19 99.68 1wuu n GLY 81 Ca -0.19 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 1wuu n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wuu n ALA 82 N -0.64 -0.50 -1.79 4.61 0.00 -1.26 -4.96 120.51 115.97 1wuu n ALA 82 Ca 0.05 -1.62 -0.35 0.00 0.00 0.00 0.00 53.44 51.51 1wuu n ALA 82 Cb 0.02 0.12 -0.03 0.00 0.00 0.00 0.00 19.45 19.56 1wuu n ALA 82 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1wuu s ASP 83 N -4.86 6.43 -0.05 0.00 2.15 -1.26 -5.04 116.67 114.03 1wuu s ASP 83 Ca 0.61 2.03 -0.25 0.00 0.43 0.00 0.00 52.55 55.38 1wuu s ASP 83 Cb -0.03 -2.58 -0.03 0.00 -0.30 0.00 0.00 42.92 39.98 1wuu s ASP 83 CO 0.42 -0.72 0.76 -0.70 -0.17 0.00 0.00 175.17 174.76 1wuu s GLU 84 N -2.90 4.46 0.59 4.34 2.12 -1.26 -3.95 118.70 122.10 1wuu s GLU 84 Ca 0.64 1.00 0.04 0.00 0.36 0.00 0.00 54.97 57.01 1wuu s GLU 84 Cb -0.20 -3.45 0.08 0.00 0.26 0.00 0.00 34.13 30.81 1wuu s GLU 84 CO 0.25 0.03 0.82 -1.25 -0.54 0.00 0.00 175.26 174.57 1wuu s PRO 85 N 0.88 2.23 0.31 4.30 0.04 -1.26 -4.50 135.00 137.00 1wuu s PRO 85 Ca 0.41 -1.24 0.25 0.00 0.04 0.00 0.00 61.00 60.45 1wuu s PRO 85 Cb -0.18 -2.53 0.55 0.00 0.04 0.00 0.00 34.50 32.37 1wuu s PRO 85 CO 0.20 -0.93 1.65 0.37 0.04 0.00 0.00 177.00 178.34 1wuu h GLN 86 N 0.00 0.00 -6.23 4.56 4.15 -1.90 -3.45 115.11 112.24 1wuu h GLN 86 Ca -0.36 0.00 -0.55 0.00 0.77 0.00 0.00 58.65 58.51 1wuu h GLN 86 Cb 1.28 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.89 1wuu h GLN 86 CO 0.43 0.00 -0.60 1.03 -1.93 0.00 0.00 178.83 177.76 1wuu s ARG 87 N -3.16 2.57 -0.29 1.69 3.00 -1.26 -0.54 118.95 120.96 1wuu s ARG 87 Ca 0.08 -1.20 -0.19 0.00 0.00 0.00 0.00 55.73 54.43 1wuu s ARG 87 Cb 0.09 -2.37 0.16 0.00 0.00 0.00 0.00 34.95 32.84 1wuu s ARG 87 CO 0.64 0.40 1.12 -1.17 0.00 0.00 0.00 175.30 176.29 1wuu s LEU 88 N -3.55 -0.33 -0.03 2.53 2.96 -0.94 -4.85 118.68 114.47 1wuu s LEU 88 Ca 0.31 0.56 0.03 0.00 -0.22 0.00 0.00 54.13 54.80 1wuu s LEU 88 Cb -0.08 1.53 0.00 0.00 0.50 0.00 0.00 46.19 48.14 1wuu s LEU 88 CO 0.22 -0.09 -0.09 -1.10 -1.32 0.00 0.00 176.35 173.96 1wuu s GLN 89 N 0.89 0.97 -0.03 1.98 1.11 -1.26 0.16 119.66 123.48 1wuu s GLN 89 Ca -0.04 -0.31 -0.29 0.00 0.01 0.00 0.00 55.36 54.73 1wuu s GLN 89 Cb -0.04 -0.90 0.09 0.00 -1.01 0.00 0.00 33.01 31.15 1wuu s GLN 89 CO -0.12 0.12 0.78 -0.59 0.01 0.00 0.00 175.29 175.49 1wuu s PHE 90 N 0.17 -0.51 0.37 0.91 -0.12 0.35 -4.97 117.98 114.18 1wuu s PHE 90 Ca -0.03 0.70 -0.26 0.00 -0.05 0.00 0.00 56.93 57.29 1wuu s PHE 90 Cb -0.08 0.47 -0.09 0.00 -0.63 0.00 0.00 43.02 42.69 1wuu s PHE 90 CO 0.00 -0.58 1.08 -1.25 -0.05 0.00 0.00 175.22 174.42 1wuu s PRO 91 N -1.99 4.27 1.00 1.99 0.04 -1.26 -0.43 135.00 138.62 1wuu s PRO 91 Ca -0.04 1.63 -0.12 0.00 0.04 0.00 0.00 61.00 62.51 1wuu s PRO 91 Cb -0.00 -2.72 0.16 0.00 0.04 0.00 0.00 34.50 31.97 1wuu s PRO 91 CO 0.00 -0.08 0.88 1.28 0.04 0.00 0.00 177.00 179.12 1wuu n LEU 92 N 0.27 1.08 -4.84 -3.56 4.77 -1.22 -4.85 117.00 108.64 1wuu n LEU 92 Ca 0.03 0.23 -0.32 0.00 -0.03 0.00 0.00 56.01 55.92 1wuu n LEU 92 Cb 0.48 -1.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.21 1wuu n LEU 92 CO 0.48 -2.79 0.69 -2.16 -1.33 0.00 0.00 177.39 172.28 1wuu s PRO 93 N -4.28 3.83 0.09 3.23 0.04 -1.26 -4.94 135.00 131.71 1wuu s PRO 93 Ca 0.64 0.94 0.02 0.00 0.04 0.00 0.00 61.00 62.65 1wuu s PRO 93 Cb -0.22 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.19 1wuu s PRO 93 CO 0.62 -0.37 0.07 0.25 0.04 0.00 0.00 177.00 177.62 1wuu n THR 94 N -1.82 0.00 0.00 1.26 -2.24 0.23 -5.00 114.28 106.71 1wuu n THR 94 Ca 0.07 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1wuu n THR 94 Cb 0.54 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1wuu n THR 94 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wuu n ALA 95 N -2.38 -0.01 -0.60 6.98 0.00 -1.26 -4.00 120.51 119.24 1wuu n ALA 95 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1wuu n ALA 95 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1wuu n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wuu n GLN 96 N -0.54 0.00 -2.27 0.00 -0.00 -1.26 -4.51 117.38 108.80 1wuu n GLN 96 Ca 0.00 0.69 -0.40 0.00 -0.00 0.00 0.00 57.00 57.29 1wuu n GLN 96 Cb 0.00 -1.20 -0.03 0.00 -0.00 0.00 0.00 30.24 29.01 1wuu n GLN 96 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 1wuu s ARG 97 N -1.81 4.38 -0.02 2.61 1.70 -1.26 -5.07 118.95 119.49 1wuu s ARG 97 Ca 0.00 2.01 0.02 0.00 -0.47 0.00 0.00 55.73 57.28 1wuu s ARG 97 Cb 0.00 -3.02 0.00 0.00 -0.57 0.00 0.00 34.95 31.36 1wuu s ARG 97 CO 0.00 -0.09 -0.07 -1.12 -1.08 0.00 0.00 175.30 172.95 1wuu s SER 98 N -0.75 0.89 0.41 -2.89 0.01 -1.26 0.77 113.70 110.88 1wuu s SER 98 Ca 0.49 -0.13 -0.27 0.00 1.31 0.00 0.00 55.95 57.35 1wuu s SER 98 Cb -0.35 -0.21 -0.10 0.00 0.21 0.00 0.00 66.02 65.56 1wuu s SER 98 CO 0.46 0.05 1.47 0.18 0.41 0.00 0.00 173.24 175.81 1wuu n LEU 99 N 3.26 4.92 -4.19 2.44 4.77 -1.26 -5.00 117.00 121.94 1wuu n LEU 99 Ca -0.17 1.19 -0.19 0.00 -0.03 0.00 0.00 56.01 56.80 1wuu n LEU 99 Cb 0.55 -1.62 -0.12 0.00 -2.33 0.00 0.00 43.42 39.91 1wuu n LEU 99 CO 0.25 0.05 -0.47 -1.61 -1.33 0.00 0.00 177.39 174.28 1wuu s GLU 100 N -2.24 0.87 0.76 3.23 8.01 -1.26 -5.06 118.70 123.02 1wuu s GLU 100 Ca 0.56 -0.99 -0.15 0.00 0.01 0.00 0.00 54.97 54.40 1wuu s GLU 100 Cb -0.46 -0.91 0.01 0.00 -4.31 0.00 0.00 34.13 28.46 1wuu s GLU 100 CO 0.61 0.20 0.86 -2.30 0.01 0.00 0.00 175.26 174.64 1wuu n PRO 101 N 1.23 0.31 0.00 0.39 -0.01 -1.26 -4.92 135.00 130.73 1wuu n PRO 101 Ca -0.21 0.16 0.00 0.00 -0.01 0.00 0.00 63.50 63.44 1wuu n PRO 101 Cb 0.54 -2.14 0.00 0.00 -0.01 0.00 0.00 33.50 31.89 1wuu n PRO 101 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1wuu n GLY 102 N 1.15 2.21 3.15 -1.23 0.00 -1.26 -5.13 105.19 104.09 1wuu n GLY 102 Ca 0.12 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 1.08 -0.01 0.74 2.61 2.01 -1.26 -3.85 115.64 116.96 1wuu s THR 103 Ca 0.00 0.02 -0.12 0.00 0.31 0.00 0.00 61.69 61.91 1wuu s THR 103 Cb 0.00 -0.40 0.04 0.00 0.01 0.00 0.00 72.50 72.15 1wuu s THR 103 CO 0.00 0.01 1.09 -2.16 -0.69 0.00 0.00 174.62 172.87 1wuu s PRO 104 N 0.35 2.44 0.13 4.92 0.04 -1.26 -5.02 135.00 136.59 1wuu s PRO 104 Ca -0.02 1.21 -0.14 0.00 0.04 0.00 0.00 61.00 62.09 1wuu s PRO 104 Cb -0.03 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 1wuu s PRO 104 CO -0.01 -1.51 1.56 0.00 0.04 0.00 0.00 177.00 177.08 1wuu h ARG 105 N -0.81 0.72 -0.93 4.56 3.08 -1.89 -3.08 114.38 116.03 1wuu h ARG 105 Ca -0.44 -0.24 0.24 0.00 0.07 0.00 0.00 59.98 59.61 1wuu h ARG 105 Cb 1.23 -0.06 -0.13 0.00 0.08 0.00 0.00 29.97 31.09 1wuu h ARG 105 CO 0.52 0.82 0.46 0.11 -1.07 0.00 0.00 179.97 180.81 1wuu h TRP 106 N 0.55 0.76 -0.80 3.04 5.08 -1.92 0.33 115.95 122.99 1wuu h TRP 106 Ca 0.11 0.04 0.23 0.00 1.08 0.00 0.00 58.89 60.35 1wuu h TRP 106 Cb 0.50 -0.19 -0.03 0.00 -3.00 0.00 0.00 29.16 26.44 1wuu h TRP 106 CO 0.04 -0.04 0.57 0.00 -1.28 0.00 0.00 178.44 177.74 1wuu h ALA 107 N 1.73 2.74 -0.95 0.11 0.00 -1.93 -2.02 119.26 118.95 1wuu h ALA 107 Ca 0.60 -0.03 0.21 0.00 0.00 0.00 0.00 54.91 55.69 1wuu h ALA 107 Cb 1.17 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 1wuu h ALA 107 CO -0.53 -0.97 0.62 -0.91 0.00 0.00 0.00 179.25 177.46 1wuu h ASN 108 N 0.01 0.49 -0.50 0.00 2.35 -0.47 0.22 115.58 117.68 1wuu h ASN 108 Ca 0.38 0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 56.17 1wuu h ASN 108 Cb 1.51 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 39.83 1wuu h ASN 108 CO -0.01 0.18 0.24 1.88 -1.65 0.00 0.00 177.43 178.06 1wuu h TYR 109 N 0.48 0.73 -0.52 1.19 -1.99 -1.51 0.63 116.97 115.98 1wuu h TYR 109 Ca 0.51 -0.04 -0.11 0.00 2.00 0.00 0.00 58.73 61.09 1wuu h TYR 109 Cb 1.17 -0.22 -0.02 0.00 2.00 0.00 0.00 36.73 39.66 1wuu h TYR 109 CO -0.00 0.58 -0.11 0.28 -0.00 0.00 0.00 178.16 178.91 1wuu h VAL 110 N 0.67 1.27 -0.27 -2.88 2.07 -0.78 -2.67 116.25 113.64 1wuu h VAL 110 Ca 0.17 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 1wuu h VAL 110 Cb 0.13 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1wuu h VAL 110 CO -0.02 0.44 0.06 0.11 0.02 0.00 0.00 177.57 178.18 1wuu h LYS 111 N 0.85 0.44 -0.19 1.57 1.57 -0.90 -0.17 116.57 119.74 1wuu h LYS 111 Ca 0.13 -0.11 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1wuu h LYS 111 Cb 0.67 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.86 1wuu h LYS 111 CO 0.05 0.54 -0.27 0.78 -0.57 0.00 0.00 179.45 179.97 1wuu h GLY 112 N 0.27 -0.28 1.02 3.86 0.00 -0.83 0.68 103.07 107.79 1wuu h GLY 112 Ca 0.09 0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.75 1wuu h GLY 112 CO 0.00 -0.21 0.52 -2.08 0.00 0.00 0.00 176.54 174.77 1wuu h VAL 113 N -0.31 1.24 -0.56 4.60 2.07 -1.32 -1.50 116.25 120.46 1wuu h VAL 113 Ca 0.12 -0.53 -0.07 0.00 0.82 0.00 0.00 66.70 67.04 1wuu h VAL 113 Cb 0.49 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1wuu h VAL 113 CO -0.37 0.25 0.08 0.40 0.02 0.00 0.00 177.57 177.95 1wuu h ILE 114 N 1.18 1.26 -0.67 4.57 2.04 -0.24 -2.59 117.51 123.05 1wuu h ILE 114 Ca 0.31 -0.99 0.02 0.00 1.00 0.00 0.00 64.86 65.20 1wuu h ILE 114 Cb -0.04 0.80 -0.04 0.00 -0.74 0.00 0.00 36.82 36.80 1wuu h ILE 114 CO -0.06 0.36 0.45 -0.61 0.00 0.00 0.00 178.15 178.29 1wuu h GLN 115 N 0.83 0.85 -0.31 2.37 5.75 0.14 -3.21 115.11 121.53 1wuu h GLN 115 Ca 0.17 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.62 1wuu h GLN 115 Cb 0.43 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 28.79 1wuu h GLN 115 CO 0.01 0.56 0.00 0.66 -2.65 0.00 0.00 178.83 177.41 1wuu n TYR 116 N -4.44 0.40 -1.64 3.99 4.02 -0.82 -5.00 117.16 113.67 1wuu n TYR 116 Ca 0.08 -0.26 -0.48 0.00 -0.01 0.00 0.00 57.90 57.22 1wuu n TYR 116 Cb 0.07 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.34 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 1.10 1.93 0.23 -0.72 9.36 -0.99 -4.86 117.16 123.22 1wuu n TYR 117 Ca 0.15 0.44 0.12 0.00 3.32 0.00 0.00 57.90 61.94 1wuu n TYR 117 Cb 0.50 -2.44 0.41 0.00 -0.63 0.00 0.00 39.34 37.18 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 5.11 0.00 -6.28 2.98 0.13 -1.94 -3.47 132.00 128.53 1wuu h PRO 118 Ca -0.46 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.14 1wuu h PRO 118 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1wuu h PRO 118 CO 0.82 0.11 -0.22 0.00 -0.23 0.00 0.00 178.00 178.49 1wuu s ALA 119 N -3.46 4.53 0.05 -0.56 0.00 -1.26 -5.07 121.76 115.99 1wuu s ALA 119 Ca 0.03 -1.71 -0.27 0.00 0.00 0.00 0.00 51.96 50.00 1wuu s ALA 119 Cb 0.08 -1.10 0.09 0.00 0.00 0.00 0.00 23.12 22.19 1wuu s ALA 119 CO 0.62 -0.61 0.87 0.00 0.00 0.00 0.00 175.76 176.64 1wuu s ALA 120 N -2.69 -1.75 0.23 0.00 0.00 -1.26 -4.56 121.76 111.73 1wuu s ALA 120 Ca 0.48 0.73 -0.18 0.00 0.00 0.00 0.00 51.96 52.98 1wuu s ALA 120 Cb -0.04 0.53 -0.08 0.00 0.00 0.00 0.00 23.12 23.53 1wuu s ALA 120 CO 0.30 -0.78 0.71 -2.14 0.00 0.00 0.00 175.76 173.84 1wuu s PRO 121 N -3.24 4.18 -0.36 0.00 0.02 -1.26 -5.03 135.00 129.31 1wuu s PRO 121 Ca 0.06 0.79 -0.13 0.00 0.02 0.00 0.00 61.00 61.74 1wuu s PRO 121 Cb -0.01 -2.82 -0.01 0.00 0.02 0.00 0.00 34.50 31.68 1wuu s PRO 121 CO -0.07 0.37 0.26 -1.17 -0.33 0.00 0.00 177.00 176.06 1wuu s LEU 122 N -2.13 4.66 0.82 -5.54 2.96 -1.26 -4.65 118.68 113.54 1wuu s LEU 122 Ca 0.44 -0.53 -0.11 0.00 -0.22 0.00 0.00 54.13 53.71 1wuu s LEU 122 Cb -0.15 -2.15 0.08 0.00 0.50 0.00 0.00 46.19 44.47 1wuu s LEU 122 CO 0.20 -0.29 1.10 -2.16 -1.32 0.00 0.00 176.35 173.88 1wuu s PRO 123 N 1.72 1.88 0.63 0.98 0.04 -1.26 -5.06 135.00 133.93 1wuu s PRO 123 Ca 0.06 0.70 -0.12 0.00 0.04 0.00 0.00 61.00 61.68 1wuu s PRO 123 Cb -0.18 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1wuu s PRO 123 CO 0.10 -1.78 1.04 0.20 0.04 0.00 0.00 177.00 176.61 1wuu s GLY 124 N -3.77 1.80 0.21 0.56 0.00 -1.24 -4.85 107.32 100.04 1wuu s GLY 124 Ca 0.61 0.10 -0.12 0.00 0.00 0.00 0.00 44.72 45.31 1wuu s GLY 124 CO 0.55 0.39 0.42 -0.11 0.00 0.00 0.00 173.10 174.35 1wuu s PHE 125 N -2.93 0.31 -0.17 1.90 -0.12 -0.70 0.20 117.98 116.47 1wuu s PHE 125 Ca 0.58 -0.67 -0.02 0.00 -0.05 0.00 0.00 56.93 56.77 1wuu s PHE 125 Cb -0.13 0.13 -0.01 0.00 -0.63 0.00 0.00 43.02 42.38 1wuu s PHE 125 CO 0.48 -0.89 -0.08 -1.12 -0.05 0.00 0.00 175.22 173.56 1wuu s SER 126 N -2.98 4.22 0.01 1.98 0.01 0.30 -2.15 113.70 115.09 1wuu s SER 126 Ca 0.19 -0.34 0.00 0.00 1.31 0.00 0.00 55.95 57.11 1wuu s SER 126 Cb 0.01 -1.69 -0.01 0.00 0.21 0.00 0.00 66.02 64.54 1wuu s SER 126 CO 0.04 0.08 -0.02 0.00 0.41 0.00 0.00 173.24 173.75 1wuu s ALA 127 N 0.88 0.13 -0.08 1.44 0.00 -0.96 0.42 121.76 123.59 1wuu s ALA 127 Ca -0.02 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.58 1wuu s ALA 127 Cb -0.15 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.06 1wuu s ALA 127 CO 0.01 -0.08 -0.17 0.08 0.00 0.00 0.00 175.76 175.60 1wuu s VAL 128 N -0.90 1.49 -0.25 0.00 1.01 -0.67 -1.58 120.40 119.50 1wuu s VAL 128 Ca -0.09 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.10 1wuu s VAL 128 Cb -0.06 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1wuu s VAL 128 CO -0.01 0.43 0.13 -0.69 0.00 0.00 0.00 175.10 174.97 1wuu s VAL 129 N 0.50 5.01 -0.03 2.92 1.01 0.46 -2.65 120.40 127.63 1wuu s VAL 129 Ca -0.15 0.06 0.06 0.00 0.00 0.00 0.00 61.98 61.95 1wuu s VAL 129 Cb -0.16 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 1wuu s VAL 129 CO 0.06 0.33 -0.22 -0.69 0.00 0.00 0.00 175.10 174.58 1wuu s VAL 130 N 1.30 1.74 0.10 2.92 1.01 0.13 -1.20 120.40 126.39 1wuu s VAL 130 Ca 0.06 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 1wuu s VAL 130 Cb -0.14 -1.45 0.01 0.00 0.00 0.00 0.00 36.38 34.79 1wuu s VAL 130 CO 0.06 0.49 0.25 -0.55 0.00 0.00 0.00 175.10 175.34 1wuu s SER 131 N -0.40 0.03 0.00 3.32 0.15 -1.26 0.12 113.70 115.65 1wuu s SER 131 Ca 0.05 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 56.14 1wuu s SER 131 Cb -0.10 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 1wuu s SER 131 CO 0.00 -0.76 0.00 -1.54 1.20 0.00 0.00 173.24 172.14 1wuu n SER 132 N -0.10 0.61 -4.77 5.45 3.41 -1.26 -4.97 113.62 111.99 1wuu n SER 132 Ca -0.15 -0.39 -0.39 0.00 -0.26 0.00 0.00 58.87 57.68 1wuu n SER 132 Cb 0.63 0.90 -0.04 0.00 -0.26 0.00 0.00 64.21 65.44 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 -1.02 3.45 -0.15 -3.33 1.01 -1.26 -4.93 120.40 114.18 1wuu s VAL 133 Ca 0.00 1.33 -0.16 0.00 0.00 0.00 0.00 61.98 63.15 1wuu s VAL 133 Cb 0.00 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1wuu s VAL 133 CO 0.00 0.22 0.40 -2.16 0.00 0.00 0.00 175.10 173.56 1wuu s PRO 134 N -1.85 4.29 0.16 2.72 0.04 -1.26 -5.00 135.00 134.10 1wuu s PRO 134 Ca 0.50 0.29 -0.32 0.00 0.04 0.00 0.00 61.00 61.51 1wuu s PRO 134 Cb -0.30 -3.45 -0.10 0.00 0.04 0.00 0.00 34.50 30.69 1wuu s PRO 134 CO 0.38 0.15 1.59 -0.51 0.04 0.00 0.00 177.00 178.65 1wuu s LEU 135 N 0.69 4.37 -1.41 -3.56 1.43 -1.26 -2.45 118.68 116.49 1wuu s LEU 135 Ca 0.22 2.64 -0.09 0.00 -1.03 0.00 0.00 54.13 55.86 1wuu s LEU 135 Cb -0.14 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.51 1wuu s LEU 135 CO 0.08 -0.84 1.09 0.61 0.23 0.00 0.00 176.35 177.51 1wuu n GLY 136 N 3.80 -0.54 0.06 -3.19 0.00 -1.26 -4.90 105.19 99.16 1wuu n GLY 136 Ca 0.14 0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.50 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 -1.91 -0.93 1.06 -0.02 0.00 -1.02 -4.40 105.19 97.97 1wuu n GLY 137 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 1.49 0.70 1.62 -0.02 0.00 -1.26 -1.46 105.19 106.25 1wuu n GLY 138 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.10 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 5.27 -3.13 0.99 4.77 -1.26 -3.86 117.00 119.78 1wuu n LEU 139 Ca 0.00 -3.11 -0.05 0.00 -0.03 0.00 0.00 56.01 52.82 1wuu n LEU 139 Cb 0.00 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1wuu n LEU 139 CO 0.00 0.74 0.23 -0.24 -1.33 0.00 0.00 177.39 176.79 1wuu n SER 140 N -0.05 -7.42 0.10 -1.43 2.88 -1.26 -0.49 113.62 105.94 1wuu n SER 140 Ca 0.31 -0.11 0.13 0.00 -1.33 0.00 0.00 58.87 57.87 1wuu n SER 140 Cb 1.17 -4.81 0.44 0.00 -0.75 0.00 0.00 64.21 60.26 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 -1.67 0.70 0.06 -3.46 3.41 -1.26 -2.92 113.62 108.48 1wuu n SER 141 Ca -0.03 0.58 -0.07 0.00 -0.26 0.00 0.00 58.87 59.10 1wuu n SER 141 Cb 0.52 -0.76 -0.04 0.00 -0.26 0.00 0.00 64.21 63.67 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 -0.21 -0.24 4.04 4.64 -1.96 -2.34 113.55 117.48 1wuu h SER 142 Ca 0.00 -0.16 -0.08 0.00 -0.47 0.00 0.00 61.79 61.07 1wuu h SER 142 Cb 0.65 0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.78 1wuu h SER 142 CO 0.00 0.32 -0.12 0.00 -0.87 0.00 0.00 176.83 176.16 1wuu h ALA 143 N -0.79 1.10 -0.98 5.18 0.00 -1.89 0.31 119.26 122.18 1wuu h ALA 143 Ca -0.03 -0.30 0.10 0.00 0.00 0.00 0.00 54.91 54.69 1wuu h ALA 143 Cb 0.36 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1wuu h ALA 143 CO 0.04 0.56 0.63 1.03 0.00 0.00 0.00 179.25 181.51 1wuu h SER 144 N 0.59 0.93 -0.18 0.00 0.87 -1.63 0.45 113.55 114.58 1wuu h SER 144 Ca 0.10 0.03 -0.14 0.00 -1.23 0.00 0.00 61.79 60.56 1wuu h SER 144 Cb 0.56 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1wuu h SER 144 CO 0.03 0.53 -0.42 0.25 -0.53 0.00 0.00 176.83 176.70 1wuu h LEU 145 N 1.02 0.69 -0.00 2.23 5.85 -0.69 -1.43 115.31 122.98 1wuu h LEU 145 Ca 0.47 -0.56 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 1wuu h LEU 145 Cb 0.40 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 1wuu h LEU 145 CO -0.22 1.12 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.67 1wuu h GLU 146 N 0.28 0.00 -0.66 1.25 5.08 -0.12 -1.76 114.58 118.65 1wuu h GLU 146 Ca 0.00 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1wuu h GLU 146 Cb 1.02 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.23 1wuu h GLU 146 CO 0.09 0.38 0.40 0.28 -1.00 0.00 0.00 179.01 179.16 1wuu h VAL 147 N -0.37 1.05 -0.58 3.13 2.07 -0.22 0.39 116.25 121.72 1wuu h VAL 147 Ca 0.00 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.29 1wuu h VAL 147 Cb 0.38 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 1wuu h VAL 147 CO 0.00 0.14 0.34 0.00 0.02 0.00 0.00 177.57 178.07 1wuu h ALA 148 N 1.30 0.75 0.17 1.67 0.00 -1.21 -0.30 119.26 121.64 1wuu h ALA 148 Ca 0.27 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1wuu h ALA 148 Cb 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1wuu h ALA 148 CO -0.13 0.06 -0.08 1.15 0.00 0.00 0.00 179.25 180.25 1wuu h THR 149 N 0.67 0.86 -0.35 0.00 2.02 -0.35 -1.78 112.91 113.99 1wuu h THR 149 Ca 0.24 -0.15 0.07 0.00 0.77 0.00 0.00 66.41 67.34 1wuu h THR 149 Cb 0.05 0.96 -0.07 0.00 -1.74 0.00 0.00 68.15 67.35 1wuu h THR 149 CO -0.12 0.04 -0.12 0.22 0.37 0.00 0.00 175.52 175.91 1wuu h TYR 150 N -0.30 -0.27 -0.90 3.16 3.20 -0.04 0.05 116.97 121.87 1wuu h TYR 150 Ca -0.02 0.03 0.13 0.00 3.14 0.00 0.00 58.73 62.01 1wuu h TYR 150 Cb 0.24 0.17 -0.07 0.00 1.54 0.00 0.00 36.73 38.61 1wuu h TYR 150 CO -0.04 -0.19 0.58 1.15 -1.64 0.00 0.00 178.16 178.02 1wuu h THR 151 N -0.04 0.88 0.31 1.81 2.02 -0.83 -1.59 112.91 115.48 1wuu h THR 151 Ca 0.17 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 1wuu h THR 151 Cb 0.30 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.75 1wuu h THR 151 CO -0.38 0.14 -0.15 0.15 0.37 0.00 0.00 175.52 175.65 1wuu h PHE 152 N 0.78 -0.39 -0.97 3.16 3.57 -0.18 -2.80 116.94 120.11 1wuu h PHE 152 Ca 0.44 -0.01 0.24 0.00 3.53 0.00 0.00 57.97 62.17 1wuu h PHE 152 Cb 0.60 0.13 -0.12 0.00 2.79 0.00 0.00 35.95 39.34 1wuu h PHE 152 CO -0.00 -0.05 0.54 -0.07 -2.23 0.00 0.00 178.31 176.49 1wuu h LEU 153 N -0.77 0.58 -1.90 0.59 3.38 -0.40 1.26 115.31 118.06 1wuu h LEU 153 Ca -0.04 0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.19 1wuu h LEU 153 Cb 0.51 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1wuu h LEU 153 CO 0.07 0.08 0.50 1.56 0.09 0.00 0.00 178.44 180.74 1wuu h GLN 154 N 0.54 0.00 0.00 1.13 4.20 -1.04 1.68 115.11 121.62 1wuu h GLN 154 Ca 0.62 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 59.18 1wuu h GLN 154 Cb 1.17 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.92 1wuu h GLN 154 CO -0.49 0.00 -1.10 1.96 -0.67 0.00 0.00 178.83 178.53 1wuu h GLN 155 N 0.00 0.00 0.03 1.46 1.08 0.17 -1.05 115.11 116.79 1wuu h GLN 155 Ca 0.20 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 57.13 1wuu h GLN 155 Cb 1.19 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.59 1wuu h GLN 155 CO -0.00 0.39 -1.42 -0.07 -0.95 0.00 0.00 178.83 176.78 1wuu h LEU 156 N 0.00 0.08 -5.00 1.46 3.38 0.29 -3.42 115.31 112.10 1wuu h LEU 156 Ca -0.10 -0.12 -0.23 0.00 0.09 0.00 0.00 57.88 57.51 1wuu h LEU 156 Cb 1.53 -0.03 -0.15 0.00 0.09 0.00 0.00 40.66 42.11 1wuu h LEU 156 CO 0.06 1.10 -0.43 0.00 0.09 0.00 0.00 178.44 179.26 1wuu n PRO 158 N 0.48 0.00 -3.62 0.00 -0.04 -0.40 -4.57 135.00 126.85 1wuu n PRO 158 Ca 0.06 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.28 1wuu n PRO 158 Cb 0.70 -0.29 0.02 0.00 -0.04 0.00 0.00 33.50 33.89 1wuu n PRO 158 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1wuu s ASP 159 N -0.24 4.77 -0.48 3.54 -4.77 -1.26 -4.83 116.67 113.40 1wuu s ASP 159 Ca 0.18 -1.13 0.03 0.00 -3.30 0.00 0.00 52.55 48.33 1wuu s ASP 159 Cb -0.26 0.40 0.15 0.00 -1.09 0.00 0.00 42.92 42.12 1wuu s ASP 159 CO 0.15 -1.19 0.32 -0.94 0.70 0.00 0.00 175.17 174.21 1wuu s SER 160 N -4.41 3.27 0.18 2.11 1.04 -1.26 -5.10 113.70 109.53 1wuu s SER 160 Ca 0.43 -2.97 -0.22 0.00 0.48 0.00 0.00 55.95 53.66 1wuu s SER 160 Cb -0.03 -0.96 0.08 0.00 0.10 0.00 0.00 66.02 65.20 1wuu s SER 160 CO 0.27 -0.21 1.05 -0.83 0.98 0.00 0.00 173.24 174.50 1wuu s GLY 161 N -0.06 0.13 0.59 7.32 0.00 -1.26 -5.11 107.32 108.94 1wuu s GLY 161 Ca 0.23 -0.37 -0.15 0.00 0.00 0.00 0.00 44.72 44.44 1wuu s GLY 161 CO -0.09 2.84 1.04 -0.51 0.00 0.00 0.00 173.10 176.38 1wuu s THR 162 N -2.08 4.11 0.15 0.90 -4.23 -1.26 -4.94 115.64 108.29 1wuu s THR 162 Ca 0.23 0.92 -0.17 0.00 -1.18 0.00 0.00 61.69 61.49 1wuu s THR 162 Cb -0.03 -3.51 -0.00 0.00 1.34 0.00 0.00 72.50 70.30 1wuu s THR 162 CO 0.05 -0.67 1.80 0.40 -0.54 0.00 0.00 174.62 175.66 1wuu h ILE 163 N 0.29 1.10 -0.52 2.99 2.04 -2.01 -2.35 117.51 119.05 1wuu h ILE 163 Ca -0.46 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.27 1wuu h ILE 163 Cb 1.21 0.57 -0.10 0.00 -0.74 0.00 0.00 36.82 37.77 1wuu h ILE 163 CO 0.59 0.10 -0.50 0.00 0.00 0.00 0.00 178.15 178.34 1wuu h ALA 164 N 1.13 -0.55 -1.44 1.87 0.00 -2.00 2.23 119.26 120.50 1wuu h ALA 164 Ca 0.13 0.06 0.43 0.00 0.00 0.00 0.00 54.91 55.54 1wuu h ALA 164 Cb -0.04 1.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 1wuu h ALA 164 CO -0.03 -0.94 0.98 0.00 0.00 0.00 0.00 179.25 179.27 1wuu h ALA 165 N 0.31 3.07 -0.04 0.00 0.00 -1.81 0.25 119.26 121.04 1wuu h ALA 165 Ca 0.13 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1wuu h ALA 165 Cb 0.57 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1wuu h ALA 165 CO -0.66 -1.59 -0.16 0.00 0.00 0.00 0.00 179.25 176.83 1wuu h ARG 166 N 0.08 0.18 0.39 0.00 3.08 0.41 -2.77 114.38 115.74 1wuu h ARG 166 Ca 0.77 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.68 1wuu h ARG 166 Cb 2.71 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 32.77 1wuu h ARG 166 CO -0.21 0.79 -0.36 0.00 -1.07 0.00 0.00 179.97 179.12 1wuu h ALA 167 N 0.39 -0.80 -1.52 0.04 0.00 0.44 -1.98 119.26 115.83 1wuu h ALA 167 Ca -0.01 -0.13 0.44 0.00 0.00 0.00 0.00 54.91 55.21 1wuu h ALA 167 Cb 0.82 0.51 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 1wuu h ALA 167 CO 0.03 -0.98 1.12 1.96 0.00 0.00 0.00 179.25 181.39 1wuu h GLN 168 N -0.77 0.00 0.09 0.00 4.20 -1.04 1.22 115.11 118.81 1wuu h GLN 168 Ca -0.03 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.42 1wuu h GLN 168 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.46 1wuu h GLN 168 CO -0.05 0.00 -1.15 0.28 -0.67 0.00 0.00 178.83 177.24 1wuu h VAL 169 N 0.00 1.47 -0.13 -0.54 2.07 -1.07 -2.58 116.25 115.48 1wuu h VAL 169 Ca 0.72 -2.89 -0.08 0.00 0.82 0.00 0.00 66.70 65.28 1wuu h VAL 169 Cb 2.96 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 35.52 1wuu h VAL 169 CO -0.01 0.85 -0.22 0.00 0.02 0.00 0.00 177.57 178.21 1wuu h GLN 171 N -0.03 0.97 -0.35 0.00 4.15 -0.47 -1.43 115.11 117.95 1wuu h GLN 171 Ca 0.01 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 1wuu h GLN 171 Cb 0.80 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 28.25 1wuu h GLN 171 CO 0.05 0.64 0.16 0.37 -1.93 0.00 0.00 178.83 178.12 1wuu h GLN 172 N 1.00 0.51 -0.33 1.69 5.75 -1.39 -1.00 115.11 121.33 1wuu h GLN 172 Ca 0.40 -0.08 0.07 0.00 -0.15 0.00 0.00 58.65 58.89 1wuu h GLN 172 Cb 0.22 -0.09 -0.08 0.00 1.07 0.00 0.00 27.48 28.60 1wuu h GLN 172 CO -0.19 0.47 -0.35 0.00 -2.65 0.00 0.00 178.83 176.11 1wuu h ALA 173 N 1.01 -0.30 -0.42 3.38 0.00 -0.22 0.11 119.26 122.83 1wuu h ALA 173 Ca 0.12 0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1wuu h ALA 173 Cb 0.14 0.73 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1wuu h ALA 173 CO -0.01 -0.78 0.14 1.49 0.00 0.00 0.00 179.25 180.08 1wuu h GLU 174 N -0.31 0.29 0.74 0.00 4.81 -1.19 0.74 114.58 119.66 1wuu h GLU 174 Ca 0.15 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1wuu h GLU 174 Cb 0.56 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.88 1wuu h GLU 174 CO -0.50 0.19 -0.35 0.45 -0.73 0.00 0.00 179.01 178.06 1wuu h HIS 175 N 0.30 -0.92 0.19 0.92 3.86 -0.58 -0.65 115.15 118.27 1wuu h HIS 175 Ca 0.19 -0.02 -0.31 0.00 -1.16 0.00 0.00 60.37 59.07 1wuu h HIS 175 Cb 0.19 0.30 0.02 0.00 1.06 0.00 0.00 27.41 28.98 1wuu h HIS 175 CO -0.16 -0.57 -1.45 0.77 0.86 0.00 0.00 177.93 177.39 1wuu h SER 176 N -1.00 0.62 0.08 2.45 0.02 -0.68 -2.83 113.55 112.21 1wuu h SER 176 Ca -0.10 -0.71 -0.35 0.00 -0.84 0.00 0.00 61.79 59.79 1wuu h SER 176 Cb 0.76 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 1wuu h SER 176 CO 0.17 1.57 -1.95 0.49 -1.14 0.00 0.00 176.83 175.96 1wuu n PHE 177 N -3.60 1.01 1.13 3.45 3.01 0.25 -4.44 117.46 118.28 1wuu n PHE 177 Ca -0.15 0.25 0.13 0.00 1.01 0.00 0.00 57.45 58.69 1wuu n PHE 177 Cb 1.07 -1.13 0.21 0.00 -0.01 0.00 0.00 39.48 39.63 1wuu n PHE 177 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1wuu n ALA 178 N -3.16 2.51 -2.95 4.37 0.00 -0.60 -4.74 120.51 115.94 1wuu n ALA 178 Ca -0.35 -0.62 -0.06 0.00 0.00 0.00 0.00 53.44 52.41 1wuu n ALA 178 Cb 0.97 -0.91 0.01 0.00 0.00 0.00 0.00 19.45 19.52 1wuu n ALA 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wuu n GLY 179 N 1.30 -2.17 2.58 0.00 0.00 -0.35 -4.92 105.19 101.63 1wuu n GLY 179 Ca 0.15 0.56 -0.12 0.00 0.00 0.00 0.00 46.02 46.62 1wuu n GLY 179 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wuu n PRO 181 N 0.59 0.96 -0.82 1.61 -0.04 -1.26 -4.99 135.00 131.05 1wuu n PRO 181 Ca 0.01 -2.29 -0.27 0.00 -0.04 0.00 0.00 63.50 60.92 1wuu n PRO 181 Cb 0.29 -1.25 0.23 0.00 -0.04 0.00 0.00 33.50 32.72 1wuu n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wuu n GLY 183 N -4.10 1.81 2.75 0.00 0.00 -1.26 -4.87 105.19 99.53 1wuu n GLY 183 Ca 0.13 -1.83 -0.35 0.00 0.00 0.00 0.00 46.02 43.98 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 0.00 4.05 0.00 -0.61 5.41 -1.26 -4.89 119.36 122.06 1wuu n ILE 184 Ca 0.00 -5.26 0.00 0.00 1.00 0.00 0.00 62.75 58.49 1wuu n ILE 184 Cb 0.00 -1.38 0.00 0.00 -0.71 0.00 0.00 39.64 37.55 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 -0.31 0.00 -0.06 4.38 9.92 -1.26 -2.45 116.55 126.77 1wuu n ASP 186 Ca 0.44 0.00 -0.14 0.00 -0.53 0.00 0.00 54.79 54.56 1wuu n ASP 186 Cb 0.36 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.77 1wuu n ASP 186 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 1wuu h GLN 187 N 0.00 0.55 0.00 -1.24 1.08 -1.91 -2.24 115.11 111.34 1wuu h GLN 187 Ca 0.00 -0.33 0.00 0.00 -1.45 0.00 0.00 58.65 56.87 1wuu h GLN 187 Cb 0.00 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1wuu h GLN 187 CO 0.00 0.94 0.00 1.19 -0.95 0.00 0.00 178.83 180.01 1wuu n PHE 188 N -4.34 0.00 -0.30 2.96 3.01 -1.02 -0.96 117.46 116.81 1wuu n PHE 188 Ca -0.06 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.50 1wuu n PHE 188 Cb 0.48 -0.29 0.23 0.00 -0.01 0.00 0.00 39.48 39.89 1wuu n PHE 188 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 1wuu h ILE 189 N 0.00 0.22 -0.88 4.37 6.09 -1.84 1.07 117.51 126.54 1wuu h ILE 189 Ca 0.00 -0.03 0.13 0.00 -1.37 0.00 0.00 64.86 63.59 1wuu h ILE 189 Cb 0.00 0.12 -0.07 0.00 0.47 0.00 0.00 36.82 37.34 1wuu h ILE 189 CO 0.00 0.02 0.57 -1.28 -3.07 0.00 0.00 178.15 174.39 1wuu h SER 190 N 0.09 0.70 -0.03 2.19 0.87 -0.97 0.53 113.55 116.93 1wuu h SER 190 Ca 0.50 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 61.10 1wuu h SER 190 Cb 0.97 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1wuu h SER 190 CO -0.76 0.37 0.00 0.18 -0.53 0.00 0.00 176.83 176.09 1wuu n LEU 191 N -4.55 0.15 0.00 2.23 4.77 0.37 -1.15 117.00 118.82 1wuu n LEU 191 Ca 0.16 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1wuu n LEU 191 Cb 0.41 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1wuu n LEU 191 CO 0.30 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1wuu n GLY 193 N 0.60 -1.64 3.40 -0.72 0.00 0.17 -4.11 105.19 102.90 1wuu n GLY 193 Ca 0.04 -1.50 -0.07 0.00 0.00 0.00 0.00 46.02 44.48 1wuu n GLY 193 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wuu s GLN 194 N -3.30 0.46 0.03 1.61 -1.52 -0.87 -2.23 119.66 113.84 1wuu s GLN 194 Ca 0.00 1.07 -0.38 0.00 -1.95 0.00 0.00 55.36 54.10 1wuu s GLN 194 Cb 0.00 0.29 -0.20 0.00 -0.22 0.00 0.00 33.01 32.88 1wuu s GLN 194 CO 0.00 -0.20 0.99 1.17 -0.25 0.00 0.00 175.29 177.00 1wuu n LYS 195 N 4.87 0.00 -0.89 2.91 4.81 -1.08 -1.32 118.16 127.46 1wuu n LYS 195 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 1wuu n LYS 195 Cb 0.53 -1.42 0.00 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 1.57 0.43 3.74 3.14 0.00 0.92 -4.93 105.19 110.06 1wuu n GLY 196 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.13 2.30 0.25 1.61 3.76 -0.43 0.13 115.29 120.77 1wuu s HIS 197 Ca 0.00 -0.72 0.03 0.00 -0.15 0.00 0.00 55.06 54.22 1wuu s HIS 197 Cb 0.00 -1.84 -0.05 0.00 1.11 0.00 0.00 32.58 31.80 1wuu s HIS 197 CO 0.00 0.17 0.03 0.00 -0.85 0.00 0.00 174.74 174.10 1wuu s ALA 198 N -2.71 1.86 -0.09 -1.40 0.00 0.40 -4.68 121.76 115.14 1wuu s ALA 198 Ca 0.31 -1.83 -0.02 0.00 0.00 0.00 0.00 51.96 50.42 1wuu s ALA 198 Cb 0.04 0.67 0.03 0.00 0.00 0.00 0.00 23.12 23.86 1wuu s ALA 198 CO 0.17 -0.32 0.01 -0.51 0.00 0.00 0.00 175.76 175.11 1wuu s LEU 199 N -3.33 0.64 -0.41 0.00 1.02 -0.57 -1.27 118.68 114.76 1wuu s LEU 199 Ca 0.32 -0.18 -0.21 0.00 0.02 0.00 0.00 54.13 54.08 1wuu s LEU 199 Cb 0.07 -0.45 0.02 0.00 0.02 0.00 0.00 46.19 45.85 1wuu s LEU 199 CO 0.11 -0.21 0.66 -0.22 0.02 0.00 0.00 176.35 176.71 1wuu s LEU 200 N 1.97 4.38 -0.16 1.79 2.96 0.10 -3.66 118.68 126.06 1wuu s LEU 200 Ca 0.04 -0.13 -0.07 0.00 -0.22 0.00 0.00 54.13 53.76 1wuu s LEU 200 Cb -0.13 -2.78 -0.04 0.00 0.50 0.00 0.00 46.19 43.74 1wuu s LEU 200 CO -0.06 -0.73 0.07 -0.63 -1.32 0.00 0.00 176.35 173.68 1wuu s ILE 201 N 2.85 4.90 -0.54 6.68 1.01 -0.74 -1.35 121.20 134.02 1wuu s ILE 201 Ca 0.24 -0.00 -0.16 0.00 0.00 0.00 0.00 60.65 60.73 1wuu s ILE 201 Cb -0.14 -3.17 0.12 0.00 0.01 0.00 0.00 42.46 39.28 1wuu s ILE 201 CO 0.18 0.51 0.50 -0.62 0.00 0.00 0.00 174.94 175.52 1wuu s ASP 202 N -0.12 6.19 0.00 3.58 -1.08 0.55 -2.21 116.67 123.59 1wuu s ASP 202 Ca 0.07 -1.73 0.00 0.00 -0.52 0.00 0.00 52.55 50.38 1wuu s ASP 202 Cb -0.12 -2.21 0.00 0.00 -1.46 0.00 0.00 42.92 39.13 1wuu s ASP 202 CO 0.01 -0.85 0.51 0.00 0.52 0.00 0.00 175.17 175.36 1wuu n ARG 204 N -0.47 0.25 0.05 0.00 0.63 -1.24 -4.44 116.66 111.44 1wuu n ARG 204 Ca 0.00 0.11 -0.06 0.00 -0.92 0.00 0.00 57.85 56.98 1wuu n ARG 204 Cb 0.01 -0.93 -0.11 0.00 0.45 0.00 0.00 32.46 31.88 1wuu n ARG 204 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1wuu h SER 205 N -0.43 0.00 -0.06 6.15 4.64 -1.80 -3.47 113.55 118.57 1wuu h SER 205 Ca -0.28 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.02 1wuu h SER 205 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1wuu h SER 205 CO -0.17 0.95 -0.02 0.18 -0.87 0.00 0.00 176.83 176.90 1wuu n LEU 206 N -3.27 0.04 -4.78 5.97 4.77 1.05 -4.99 117.00 115.79 1wuu n LEU 206 Ca -0.03 0.03 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 1wuu n LEU 206 Cb 0.94 -0.89 -0.06 0.00 -2.33 0.00 0.00 43.42 41.08 1wuu n LEU 206 CO 0.46 -0.19 0.36 -0.70 -1.33 0.00 0.00 177.39 175.99 1wuu s GLU 207 N -0.98 4.37 0.22 3.23 2.12 -1.13 -4.77 118.70 121.76 1wuu s GLU 207 Ca 0.00 0.91 0.09 0.00 0.36 0.00 0.00 54.97 56.33 1wuu s GLU 207 Cb 0.00 -3.28 -0.04 0.00 0.26 0.00 0.00 34.13 31.06 1wuu s GLU 207 CO 0.00 0.52 -0.05 0.99 -0.54 0.00 0.00 175.26 176.18 1wuu s THR 208 N -0.79 3.34 -0.06 -1.70 2.01 -1.26 -0.33 115.64 116.86 1wuu s THR 208 Ca 0.33 -1.78 -0.03 0.00 0.31 0.00 0.00 61.69 60.52 1wuu s THR 208 Cb -0.20 -2.72 0.04 0.00 0.01 0.00 0.00 72.50 69.62 1wuu s THR 208 CO 0.21 -0.24 0.13 -0.44 -0.69 0.00 0.00 174.62 173.59 1wuu s SER 209 N -3.25 -0.09 -0.23 3.53 0.01 -0.46 -4.96 113.70 108.25 1wuu s SER 209 Ca 0.28 0.27 -0.10 0.00 1.31 0.00 0.00 55.95 57.71 1wuu s SER 209 Cb -0.08 0.16 -0.05 0.00 0.21 0.00 0.00 66.02 66.27 1wuu s SER 209 CO 0.18 -0.14 0.15 -0.76 0.41 0.00 0.00 173.24 173.08 1wuu s LEU 210 N 1.10 4.13 -0.25 2.44 1.43 -1.26 -0.72 118.68 125.54 1wuu s LEU 210 Ca -0.09 0.13 -0.01 0.00 -1.03 0.00 0.00 54.13 53.14 1wuu s LEU 210 Cb -0.11 -2.10 0.03 0.00 0.03 0.00 0.00 46.19 44.04 1wuu s LEU 210 CO -0.05 0.08 -0.07 -0.69 0.23 0.00 0.00 176.35 175.85 1wuu s VAL 211 N 0.94 2.72 0.03 -1.59 1.01 -0.40 -4.92 120.40 118.20 1wuu s VAL 211 Ca 0.08 -1.14 -0.30 0.00 0.00 0.00 0.00 61.98 60.61 1wuu s VAL 211 Cb -0.13 -2.42 -0.09 0.00 0.00 0.00 0.00 36.38 33.75 1wuu s VAL 211 CO 0.03 0.16 1.91 -2.84 0.00 0.00 0.00 175.10 174.36 1wuu s PRO 212 N 1.28 4.15 -0.44 2.72 0.02 -1.26 0.15 135.00 141.62 1wuu s PRO 212 Ca -0.01 2.55 0.06 0.00 0.02 0.00 0.00 61.00 63.62 1wuu s PRO 212 Cb -0.17 -4.09 0.42 0.00 0.02 0.00 0.00 34.50 30.68 1wuu s PRO 212 CO -0.05 -0.93 1.09 1.28 -0.33 0.00 0.00 177.00 178.06 1wuu n LEU 213 N 7.32 4.47 -2.44 -5.54 4.77 0.35 -4.88 117.00 121.05 1wuu n LEU 213 Ca 0.19 -5.15 -0.33 0.00 -0.03 0.00 0.00 56.01 50.69 1wuu n LEU 213 Cb 0.41 -0.40 0.05 0.00 -2.33 0.00 0.00 43.42 41.15 1wuu n LEU 213 CO 0.67 2.20 1.10 -1.54 -1.33 0.00 0.00 177.39 178.50 1wuu n SER 214 N -0.44 6.82 -4.44 -1.43 3.41 -1.24 -4.75 113.62 111.56 1wuu n SER 214 Ca 0.37 -3.79 -0.38 0.00 -0.26 0.00 0.00 58.87 54.81 1wuu n SER 214 Cb 0.65 -0.83 -0.12 0.00 -0.26 0.00 0.00 64.21 63.66 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 -2.15 5.36 0.00 4.04 -1.08 -1.26 -4.96 116.67 116.62 1wuu s ASP 215 Ca 0.57 -0.40 0.27 0.00 -0.52 0.00 0.00 52.55 52.48 1wuu s ASP 215 Cb 0.46 -1.96 1.23 0.00 -1.46 0.00 0.00 42.92 41.19 1wuu s ASP 215 CO -0.13 -0.12 1.90 -0.81 0.52 0.00 0.00 175.17 176.53 1wuu n PRO 216 N 4.95 0.10 0.00 4.34 -0.04 -1.26 -2.13 135.00 140.96 1wuu n PRO 216 Ca -0.15 0.03 0.11 0.00 -0.04 0.00 0.00 63.50 63.45 1wuu n PRO 216 Cb 0.50 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.44 0.33 -3.37 0.54 5.02 -1.26 -4.64 118.16 113.34 1wuu n LYS 217 Ca 0.08 -0.26 -0.21 0.00 -2.02 0.00 0.00 58.31 55.90 1wuu n LYS 217 Cb 0.29 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 33.81 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 -2.85 3.92 -0.15 -0.35 2.96 -0.91 -0.95 118.68 120.36 1wuu s LEU 218 Ca 0.12 0.13 -0.29 0.00 -0.22 0.00 0.00 54.13 53.87 1wuu s LEU 218 Cb 0.17 -3.01 0.09 0.00 0.50 0.00 0.00 46.19 43.95 1wuu s LEU 218 CO 0.75 -0.44 0.83 0.00 -1.32 0.00 0.00 176.35 176.17 1wuu s ALA 219 N -2.30 -1.85 -0.23 5.97 0.00 0.13 -3.92 121.76 119.57 1wuu s ALA 219 Ca 0.44 1.59 -0.01 0.00 0.00 0.00 0.00 51.96 53.98 1wuu s ALA 219 Cb -0.10 -0.60 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1wuu s ALA 219 CO 0.34 -0.33 -0.10 0.08 0.00 0.00 0.00 175.76 175.75 1wuu s VAL 220 N -0.73 2.64 -0.28 0.00 1.01 -1.26 -1.01 120.40 120.78 1wuu s VAL 220 Ca -0.05 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.86 1wuu s VAL 220 Cb -0.02 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.07 1wuu s VAL 220 CO 0.04 0.30 0.08 -0.22 0.00 0.00 0.00 175.10 175.29 1wuu s LEU 221 N 1.31 3.67 -0.26 3.92 2.96 0.85 -2.35 118.68 128.78 1wuu s LEU 221 Ca 0.01 -0.47 -0.08 0.00 -0.22 0.00 0.00 54.13 53.37 1wuu s LEU 221 Cb -0.16 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1wuu s LEU 221 CO -0.07 -0.12 0.10 -0.63 -1.32 0.00 0.00 176.35 174.31 1wuu s ILE 222 N 1.56 4.56 -0.21 6.68 1.01 -0.87 0.30 121.20 134.23 1wuu s ILE 222 Ca 0.05 -0.11 -0.00 0.00 0.00 0.00 0.00 60.65 60.59 1wuu s ILE 222 Cb -0.16 -3.16 0.02 0.00 0.01 0.00 0.00 42.46 39.17 1wuu s ILE 222 CO 0.03 0.30 -0.14 -0.89 0.00 0.00 0.00 174.94 174.25 1wuu s THR 223 N 1.65 2.48 -0.57 2.92 2.01 -0.54 -1.92 115.64 121.67 1wuu s THR 223 Ca 0.06 -0.92 -0.23 0.00 0.31 0.00 0.00 61.69 60.91 1wuu s THR 223 Cb -0.15 -2.14 0.05 0.00 0.01 0.00 0.00 72.50 70.26 1wuu s THR 223 CO 0.05 0.41 0.91 0.21 -0.69 0.00 0.00 174.62 175.52 1wuu s ASN 224 N 1.32 6.30 0.65 3.53 3.84 0.97 0.12 114.94 131.66 1wuu s ASN 224 Ca 0.03 -0.53 0.34 0.00 0.21 0.00 0.00 52.86 52.91 1wuu s ASN 224 Cb -0.14 -2.42 1.85 0.00 -0.55 0.00 0.00 41.25 39.98 1wuu s ASN 224 CO -0.09 -1.23 2.07 0.77 -2.79 0.00 0.00 177.10 175.83 1wuu h SER 225 N 9.32 0.00 -0.34 -4.21 4.64 -1.57 0.06 113.55 121.45 1wuu h SER 225 Ca -0.27 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.91 1wuu h SER 225 Cb 1.08 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.11 1wuu h SER 225 CO 1.09 0.00 -0.13 0.59 -0.87 0.00 0.00 176.83 177.51 1wuu n ASN 226 N -3.13 -5.21 -4.43 4.97 3.02 -1.26 -4.65 115.26 104.57 1wuu n ASN 226 Ca -0.01 0.18 -0.36 0.00 -0.03 0.00 0.00 54.58 54.36 1wuu n ASN 226 Cb 0.30 -3.34 -0.13 0.00 -0.61 0.00 0.00 39.78 36.01 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 -1.82 4.09 -0.66 2.41 1.01 -1.26 -4.98 120.40 119.19 1wuu s VAL 227 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 1wuu s VAL 227 Cb 0.00 -2.89 0.17 0.00 0.00 0.00 0.00 36.38 33.66 1wuu s VAL 227 CO 0.00 0.38 0.47 -0.13 0.00 0.00 0.00 175.10 175.81 1wuu s ARG 228 N 1.40 2.56 -0.39 2.72 0.52 -1.26 0.12 118.95 124.63 1wuu s ARG 228 Ca 0.05 -2.74 -0.22 0.00 -0.52 0.00 0.00 55.73 52.30 1wuu s ARG 228 Cb -0.15 -3.67 0.01 0.00 0.52 0.00 0.00 34.95 31.67 1wuu s ARG 228 CO 0.02 -1.19 0.72 -3.38 0.02 0.00 0.00 175.30 171.49 1wuu s HIS 229 N -0.44 3.10 0.00 -0.53 -3.43 -1.23 -5.05 115.29 107.70 1wuu s HIS 229 Ca 0.19 0.35 0.00 0.00 -0.80 0.00 0.00 55.06 54.80 1wuu s HIS 229 Cb -0.18 -3.36 0.00 0.00 -1.43 0.00 0.00 32.58 27.61 1wuu s HIS 229 CO -0.05 -0.76 0.00 0.43 -2.00 0.00 0.00 174.74 172.35 1wuu n SER 230 N 6.34 0.00 -3.63 7.38 7.64 -1.26 -4.95 113.62 125.15 1wuu n SER 230 Ca 0.01 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.65 1wuu n SER 230 Cb 0.48 -0.90 -0.17 0.00 -1.01 0.00 0.00 64.21 62.61 1wuu n SER 230 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1wuu s SER 233 N -2.82 1.92 0.14 6.43 1.04 -1.26 -5.10 113.70 114.05 1wuu s SER 233 Ca 0.00 -0.37 0.01 0.00 0.48 0.00 0.00 55.95 56.07 1wuu s SER 233 Cb 0.00 -0.18 -0.07 0.00 0.10 0.00 0.00 66.02 65.86 1wuu s SER 233 CO 0.00 -0.32 1.33 0.77 0.98 0.00 0.00 173.24 176.00 1wuu h SER 234 N 8.42 0.29 -0.35 7.02 4.64 -2.00 -3.31 113.55 128.27 1wuu h SER 234 Ca -0.14 -0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1wuu h SER 234 Cb 1.14 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 1wuu h SER 234 CO 0.24 1.09 0.21 -0.33 -0.87 0.00 0.00 176.83 177.17 1wuu h GLU 235 N 0.11 0.47 0.00 4.77 4.39 -1.99 -3.16 114.58 119.17 1wuu h GLU 235 Ca -0.06 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1wuu h GLU 235 Cb 1.60 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.16 1wuu h GLU 235 CO 0.15 0.37 0.00 0.98 -1.16 0.00 0.00 179.01 179.34 1wuu n TYR 236 N -4.80 0.00 -0.31 4.33 9.36 -1.25 0.16 117.16 124.66 1wuu n TYR 236 Ca -0.01 0.00 0.35 0.00 3.32 0.00 0.00 57.90 61.56 1wuu n TYR 236 Cb 0.06 -0.36 0.69 0.00 -0.63 0.00 0.00 39.34 39.11 1wuu n TYR 236 CO 0.00 0.00 0.00 -1.35 0.22 0.00 0.00 176.86 175.73 1wuu h PRO 237 N 0.00 0.00 0.35 2.98 0.10 -1.75 0.44 132.00 134.12 1wuu h PRO 237 Ca 0.00 0.00 -0.02 0.00 0.10 0.00 0.00 66.00 66.08 1wuu h PRO 237 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 31.00 31.10 1wuu h PRO 237 CO 0.00 0.00 -0.17 0.28 0.10 0.00 0.00 178.00 178.21 1wuu h VAL 238 N 0.00 0.00 -0.49 3.15 2.07 0.16 -2.46 116.25 118.68 1wuu h VAL 238 Ca 0.56 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 68.00 1wuu h VAL 238 Cb 2.54 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 32.25 1wuu h VAL 238 CO -0.01 0.00 -0.29 0.54 0.02 0.00 0.00 177.57 177.83 1wuu n ARG 239 N -3.59 -0.22 -0.31 1.57 5.12 0.14 0.77 116.66 120.15 1wuu n ARG 239 Ca -0.06 1.11 0.23 0.00 -1.93 0.00 0.00 57.85 57.20 1wuu n ARG 239 Cb 0.18 -1.64 0.43 0.00 -1.16 0.00 0.00 32.46 30.27 1wuu n ARG 239 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1wuu n ARG 240 N -4.13 -0.06 -0.08 5.56 0.63 -0.38 0.10 116.66 118.29 1wuu n ARG 240 Ca 0.01 1.34 -0.13 0.00 -0.92 0.00 0.00 57.85 58.16 1wuu n ARG 240 Cb 0.13 -2.28 -0.00 0.00 0.45 0.00 0.00 32.46 30.76 1wuu n ARG 240 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1wuu h ARG 241 N 0.00 0.84 0.00 -0.14 3.08 0.86 -2.59 114.38 116.43 1wuu h ARG 241 Ca 0.69 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1wuu h ARG 241 Cb 1.68 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.76 1wuu h ARG 241 CO -0.79 1.11 0.00 1.04 -1.07 0.00 0.00 179.97 180.26 1wuu n GLN 242 N -4.03 0.00 -0.29 0.04 6.02 0.11 -1.24 117.38 118.00 1wuu n GLN 242 Ca -0.03 0.55 -0.01 0.00 -0.01 0.00 0.00 57.00 57.50 1wuu n GLN 242 Cb 0.57 -1.43 0.03 0.00 1.02 0.00 0.00 30.24 30.43 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 0.00 0.22 0.17 0.00 5.08 -1.11 -0.29 114.58 118.64 1wuu h GLU 244 Ca 0.25 -0.01 -0.23 0.00 -1.00 0.00 0.00 59.36 58.37 1wuu h GLU 244 Cb 0.44 -0.05 0.03 0.00 0.50 0.00 0.00 28.75 29.67 1wuu h GLU 244 CO -0.74 0.14 -1.00 0.93 -1.00 0.00 0.00 179.01 177.34 1wuu h GLU 245 N 0.22 0.38 -0.31 2.33 5.08 0.68 -3.03 114.58 119.93 1wuu h GLU 245 Ca 0.29 -0.63 0.06 0.00 -1.00 0.00 0.00 59.36 58.08 1wuu h GLU 245 Cb 0.82 0.23 -0.08 0.00 0.50 0.00 0.00 28.75 30.23 1wuu h GLU 245 CO -0.06 1.30 -0.38 0.28 -1.00 0.00 0.00 179.01 179.15 1wuu h VAL 246 N -0.20 0.17 -1.00 3.13 2.07 -0.41 0.20 116.25 120.21 1wuu h VAL 246 Ca -0.17 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.48 1wuu h VAL 246 Cb 1.78 0.17 -0.14 0.00 -1.52 0.00 0.00 31.29 31.58 1wuu h VAL 246 CO 0.19 0.00 -0.47 0.00 0.02 0.00 0.00 177.57 177.31 1wuu h ALA 247 N 0.46 -0.12 -0.47 1.67 0.00 -1.12 0.41 119.26 120.09 1wuu h ALA 247 Ca 0.13 0.22 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 1wuu h ALA 247 Cb 0.58 1.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.51 1wuu h ALA 247 CO -0.50 -0.76 -0.05 0.07 0.00 0.00 0.00 179.25 178.01 1wuu h ARG 248 N -0.00 0.86 -0.97 0.00 -0.00 -1.10 0.26 114.38 113.42 1wuu h ARG 248 Ca 0.27 -0.30 0.33 0.00 -0.00 0.00 0.00 59.98 60.28 1wuu h ARG 248 Cb 0.52 -0.06 -0.16 0.00 -0.00 0.00 0.00 29.97 30.27 1wuu h ARG 248 CO -0.97 0.93 0.39 0.00 -0.00 0.00 0.00 179.97 180.32 1wuu h ALA 249 N 0.90 1.74 -0.39 0.08 0.00 0.27 4.02 119.26 125.88 1wuu h ALA 249 Ca 0.13 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1wuu h ALA 249 Cb 0.58 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1wuu h ALA 249 CO 0.03 -0.68 0.00 1.28 0.00 0.00 0.00 179.25 179.89 1wuu n LEU 250 N -5.24 3.50 -1.18 0.00 4.77 0.72 -4.86 117.00 114.70 1wuu n LEU 250 Ca 0.30 -1.77 -0.07 0.00 -0.03 0.00 0.00 56.01 54.45 1wuu n LEU 250 Cb 0.98 -0.52 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 1wuu n LEU 250 CO 0.03 0.52 -0.06 0.61 -1.33 0.00 0.00 177.39 177.16 1wuu n GLY 251 N 0.65 0.64 3.90 -0.72 0.00 1.33 -4.89 105.19 106.10 1wuu n GLY 251 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.55 3.61 0.03 1.61 3.01 0.71 -4.94 119.74 121.22 1wuu s LYS 252 Ca 0.00 -0.11 -0.24 0.00 -1.01 0.00 0.00 55.97 54.60 1wuu s LYS 252 Cb 0.00 -2.80 -0.18 0.00 -1.01 0.00 0.00 37.83 33.85 1wuu s LYS 252 CO 0.00 0.40 1.47 1.49 0.51 0.00 0.00 175.35 179.22 1wuu h GLU 253 N 2.41 0.02 -4.52 1.68 4.81 -1.90 -3.35 114.58 113.73 1wuu h GLU 253 Ca -0.47 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 58.54 1wuu h GLU 253 Cb 1.18 -0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.40 1wuu h GLU 253 CO 0.70 0.29 -0.63 -1.54 -0.73 0.00 0.00 179.01 177.10 1wuu s SER 254 N -5.50 0.26 0.00 1.04 1.04 -1.26 -4.97 113.70 104.31 1wuu s SER 254 Ca -0.15 -1.30 0.17 0.00 0.48 0.00 0.00 55.95 55.15 1wuu s SER 254 Cb 0.04 0.33 0.74 0.00 0.10 0.00 0.00 66.02 67.23 1wuu s SER 254 CO 0.67 -0.78 1.52 0.18 0.98 0.00 0.00 173.24 175.81 1wuu n LEU 255 N -0.19 0.00 0.31 2.42 4.77 -1.25 -1.82 117.00 121.23 1wuu n LEU 255 Ca -0.02 0.45 -0.17 0.00 -0.03 0.00 0.00 56.01 56.24 1wuu n LEU 255 Cb 0.65 -0.45 -0.08 0.00 -2.33 0.00 0.00 43.42 41.21 1wuu n LEU 255 CO 0.32 -0.19 0.65 -0.09 -1.33 0.00 0.00 177.39 176.75 1wuu h ARG 256 N 0.00 -0.78 -0.85 3.23 9.65 -1.84 -2.99 114.38 120.80 1wuu h ARG 256 Ca 0.00 0.05 0.21 0.00 -1.10 0.00 0.00 59.98 59.15 1wuu h ARG 256 Cb 0.25 0.18 -0.13 0.00 -1.39 0.00 0.00 29.97 28.88 1wuu h ARG 256 CO 0.00 -0.52 0.25 0.93 2.80 0.00 0.00 179.97 183.42 1wuu h GLU 257 N -0.81 0.25 -6.85 0.20 4.39 -1.68 -3.42 114.58 106.66 1wuu h GLU 257 Ca -0.06 -0.02 -0.51 0.00 0.34 0.00 0.00 59.36 59.12 1wuu h GLU 257 Cb 0.66 -0.06 0.03 0.00 -0.10 0.00 0.00 28.75 29.28 1wuu h GLU 257 CO 0.07 0.17 0.50 0.08 -1.16 0.00 0.00 179.01 178.66 1wuu s VAL 258 N -5.96 3.36 -0.03 3.13 1.01 -1.13 -5.05 120.40 115.72 1wuu s VAL 258 Ca -0.12 1.31 0.06 0.00 0.00 0.00 0.00 61.98 63.23 1wuu s VAL 258 Cb 0.25 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 1wuu s VAL 258 CO 0.77 0.27 -0.21 -1.10 0.00 0.00 0.00 175.10 174.82 1wuu s GLN 259 N -1.70 2.30 0.13 2.72 -0.21 -1.26 -4.91 119.66 116.72 1wuu s GLN 259 Ca 0.48 -0.84 -0.03 0.00 0.02 0.00 0.00 55.36 54.99 1wuu s GLN 259 Cb -0.32 -2.18 0.23 0.00 1.00 0.00 0.00 33.01 31.74 1wuu s GLN 259 CO 0.41 0.57 0.69 -0.11 -2.12 0.00 0.00 175.29 174.73 1wuu n LEU 260 N 2.44 -0.14 0.08 2.90 7.94 -1.26 0.18 117.00 129.14 1wuu n LEU 260 Ca -0.17 0.76 -0.14 0.00 -1.11 0.00 0.00 56.01 55.35 1wuu n LEU 260 Cb 0.52 -0.24 -0.08 0.00 0.53 0.00 0.00 43.42 44.15 1wuu n LEU 260 CO 0.24 -0.74 0.10 -0.33 -1.11 0.00 0.00 177.39 175.56 1wuu h GLU 261 N 0.00 0.37 0.00 1.96 3.07 -2.00 -2.87 114.58 115.11 1wuu h GLU 261 Ca 0.22 -0.46 0.00 0.00 -0.50 0.00 0.00 59.36 58.62 1wuu h GLU 261 Cb 0.37 0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1wuu h GLU 261 CO -0.45 1.15 0.00 0.39 -1.40 0.00 0.00 179.01 178.70 1wuu n GLU 262 N -3.68 0.61 0.17 2.33 1.02 0.48 -3.09 120.64 118.48 1wuu n GLU 262 Ca -0.08 0.02 0.03 0.00 -0.02 0.00 0.00 57.16 57.11 1wuu n GLU 262 Cb 0.90 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 31.09 1wuu n GLU 262 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1wuu h LEU 263 N 0.00 0.00 0.00 -4.62 5.85 -1.11 -3.32 115.31 112.11 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 0.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1wuu h LEU 263 CO 0.00 0.46 0.00 1.21 -0.34 0.00 0.00 178.44 179.77 1wuu n GLU 264 N -3.62 0.00 0.00 1.25 4.07 -1.18 -3.06 120.64 118.10 1wuu n GLU 264 Ca -0.01 0.36 0.00 0.00 -0.06 0.00 0.00 57.16 57.46 1wuu n GLU 264 Cb 0.55 -1.22 0.00 0.00 -0.06 0.00 0.00 31.44 30.71 1wuu n GLU 264 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1wuu n ALA 265 N -1.36 0.00 1.40 4.31 0.00 -1.25 0.42 120.51 124.03 1wuu n ALA 265 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1wuu n ALA 265 Cb 0.00 0.00 0.45 0.00 0.00 0.00 0.00 19.45 19.90 1wuu n ALA 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wuu n ALA 266 N -2.56 2.64 -0.34 0.00 0.00 -1.17 -4.19 120.51 114.89 1wuu n ALA 266 Ca 0.00 -0.47 0.16 0.00 0.00 0.00 0.00 53.44 53.13 1wuu n ALA 266 Cb 0.00 -1.11 0.32 0.00 0.00 0.00 0.00 19.45 18.66 1wuu n ALA 266 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1wuu h ARG 267 N 2.51 0.01 0.00 0.00 2.43 0.82 4.25 114.38 124.41 1wuu h ARG 267 Ca 0.00 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1wuu h ARG 267 Cb 0.57 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 1wuu h ARG 267 CO 0.00 0.01 -0.29 -0.44 -1.51 0.00 0.00 179.97 177.74 1wuu h ASP 268 N 0.02 0.00 1.34 -3.80 3.32 -1.76 -3.16 116.42 112.38 1wuu h ASP 268 Ca 0.62 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.56 1wuu h ASP 268 Cb 1.34 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.87 1wuu h ASP 268 CO -0.90 0.29 -0.53 -0.07 -1.72 0.00 0.00 179.24 176.31 1wuu h LEU 269 N 0.00 0.00 -8.36 1.55 3.38 0.76 -3.48 115.31 109.16 1wuu h LEU 269 Ca -0.00 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 1wuu h LEU 269 Cb 1.12 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.72 1wuu h LEU 269 CO 0.04 0.53 -0.68 0.68 0.09 0.00 0.00 178.44 179.10 1wuu s VAL 270 N -3.03 0.43 0.82 1.22 -7.23 0.26 -4.97 120.40 107.90 1wuu s VAL 270 Ca 0.03 -1.88 -0.16 0.00 -1.81 0.00 0.00 61.98 58.16 1wuu s VAL 270 Cb 0.08 -1.66 -0.10 0.00 0.56 0.00 0.00 36.38 35.27 1wuu s VAL 270 CO 0.74 -0.88 -0.18 -1.54 -0.31 0.00 0.00 175.10 172.93 1wuu n SER 271 N 0.01 -3.85 0.08 4.85 3.41 -1.26 -4.72 113.62 112.14 1wuu n SER 271 Ca -0.12 0.40 -0.13 0.00 -0.26 0.00 0.00 58.87 58.75 1wuu n SER 271 Cb 0.61 -0.95 -0.08 0.00 -0.26 0.00 0.00 64.21 63.53 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 -0.74 -0.14 0.00 4.33 1.57 -1.99 -1.18 116.57 118.43 1wuu h LYS 272 Ca -0.44 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1wuu h LYS 272 Cb 1.34 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1wuu h LYS 272 CO 0.33 0.04 0.00 0.39 -0.57 0.00 0.00 179.45 179.64 1wuu n GLU 273 N -5.08 0.00 -0.17 3.15 1.02 -1.26 -1.33 120.64 116.97 1wuu n GLU 273 Ca -0.08 0.30 -0.02 0.00 -0.02 0.00 0.00 57.16 57.34 1wuu n GLU 273 Cb 0.14 -1.17 -0.00 0.00 -0.02 0.00 0.00 31.44 30.39 1wuu n GLU 273 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wuu n GLY 274 N -0.76 -0.97 0.42 0.62 0.00 -1.24 0.41 105.19 103.67 1wuu n GLY 274 Ca 0.00 0.49 -0.11 0.00 0.00 0.00 0.00 46.02 46.41 1wuu n GLY 274 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1wuu h PHE 275 N 0.00 -1.63 -0.01 1.61 3.57 -0.88 0.68 116.94 120.28 1wuu h PHE 275 Ca 0.12 0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1wuu h PHE 275 Cb 0.23 0.80 -0.00 0.00 2.79 0.00 0.00 35.95 39.77 1wuu h PHE 275 CO -0.40 -0.43 0.02 0.00 -2.23 0.00 0.00 178.31 175.27 1wuu h ARG 276 N -0.20 0.00 0.00 1.11 3.08 0.93 -0.70 114.38 118.60 1wuu h ARG 276 Ca 0.14 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 1wuu h ARG 276 Cb 0.53 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 1wuu h ARG 276 CO -0.76 0.00 -0.16 0.00 -1.07 0.00 0.00 179.97 177.98 1wuu h ARG 277 N 0.00 0.00 -0.95 0.04 2.47 0.14 -2.72 114.38 113.36 1wuu h ARG 277 Ca 0.01 0.00 0.30 0.00 -1.26 0.00 0.00 59.98 59.02 1wuu h ARG 277 Cb 0.05 0.00 -0.16 0.00 -1.65 0.00 0.00 29.97 28.21 1wuu h ARG 277 CO -0.00 0.06 0.32 0.00 0.56 0.00 0.00 179.97 180.91 1wuu h ALA 278 N -0.95 1.57 0.38 0.04 0.00 -0.94 1.72 119.26 121.08 1wuu h ALA 278 Ca -0.01 0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1wuu h ALA 278 Cb 0.20 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1wuu h ALA 278 CO -0.00 -0.60 -0.41 -0.09 0.00 0.00 0.00 179.25 178.15 1wuu h ARG 279 N 0.15 -0.78 -0.63 0.00 2.43 -1.23 0.39 114.38 114.71 1wuu h ARG 279 Ca 0.66 0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.94 1wuu h ARG 279 Cb 1.47 0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 31.11 1wuu h ARG 279 CO -0.72 -0.52 -0.47 1.25 -1.51 0.00 0.00 179.97 178.00 1wuu h HIS 280 N -0.81 -1.49 0.00 2.20 2.76 0.28 -1.72 115.15 116.37 1wuu h HIS 280 Ca -0.03 0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1wuu h HIS 280 Cb 0.73 0.74 0.00 0.00 1.55 0.00 0.00 27.41 30.43 1wuu h HIS 280 CO -0.23 -0.34 0.00 0.28 -1.30 0.00 0.00 177.93 176.34 1wuu n VAL 281 N -4.86 0.00 -0.32 5.26 0.31 0.00 -0.70 118.33 118.02 1wuu n VAL 281 Ca -0.00 1.25 0.28 0.00 -0.01 0.00 0.00 64.34 65.86 1wuu n VAL 281 Cb 0.24 -1.88 0.49 0.00 -0.91 0.00 0.00 33.84 31.78 1wuu n VAL 281 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1wuu n VAL 282 N -1.81 -0.21 0.02 2.52 0.31 0.13 0.21 118.33 119.50 1wuu n VAL 282 Ca 0.00 1.37 -0.04 0.00 -0.01 0.00 0.00 64.34 65.66 1wuu n VAL 282 Cb 0.00 -2.24 -0.11 0.00 -0.91 0.00 0.00 33.84 30.59 1wuu n VAL 282 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1wuu h GLY 283 N 0.00 0.00 0.92 2.92 0.00 -0.96 -3.30 103.07 102.66 1wuu h GLY 283 Ca 0.65 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.97 1wuu h GLY 283 CO -0.39 0.00 -0.05 -2.09 0.00 0.00 0.00 176.54 174.01 1wuu h GLU 284 N 0.00 -0.13 0.00 4.80 4.57 0.48 0.27 114.58 124.57 1wuu h GLU 284 Ca -0.20 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1wuu h GLU 284 Cb 1.78 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 30.40 1wuu h GLU 284 CO 0.07 -0.02 0.00 -0.89 -1.18 0.00 0.00 179.01 176.99 1wuu n ILE 285 N -5.11 0.00 -0.34 2.32 5.41 -0.41 0.84 119.36 122.06 1wuu n ILE 285 Ca -0.08 1.04 0.03 0.00 1.00 0.00 0.00 62.75 64.74 1wuu n ILE 285 Cb 0.11 -1.70 0.09 0.00 -0.71 0.00 0.00 39.64 37.43 1wuu n ILE 285 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1wuu n ARG 286 N -1.00 -0.14 -0.29 0.38 0.63 -1.23 0.26 116.66 115.26 1wuu n ARG 286 Ca 0.00 1.42 0.12 0.00 -0.92 0.00 0.00 57.85 58.47 1wuu n ARG 286 Cb 0.00 -2.12 0.27 0.00 0.45 0.00 0.00 32.46 31.06 1wuu n ARG 286 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1wuu h ARG 287 N 0.00 0.18 0.37 -0.14 3.08 0.59 0.35 114.38 118.81 1wuu h ARG 287 Ca 0.39 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.41 1wuu h ARG 287 Cb 0.62 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1wuu h ARG 287 CO -0.93 0.12 -0.18 1.15 -1.07 0.00 0.00 179.97 179.06 1wuu h THR 288 N 0.19 0.64 -0.98 2.04 2.02 1.00 -1.03 112.91 116.79 1wuu h THR 288 Ca 0.54 -0.11 0.22 0.00 0.77 0.00 0.00 66.41 67.82 1wuu h THR 288 Cb 1.07 0.70 -0.12 0.00 -1.74 0.00 0.00 68.15 68.06 1wuu h THR 288 CO -0.67 0.02 0.56 0.00 0.37 0.00 0.00 175.52 175.81 1wuu h ALA 289 N 0.04 1.68 -0.35 6.16 0.00 0.99 0.04 119.26 127.82 1wuu h ALA 289 Ca -0.05 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1wuu h ALA 289 Cb 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1wuu h ALA 289 CO 0.08 -0.21 0.03 1.96 0.00 0.00 0.00 179.25 181.11 1wuu h GLN 290 N 0.61 0.60 -0.61 0.00 7.50 0.29 -3.26 115.11 120.24 1wuu h GLN 290 Ca 0.61 -0.18 -0.09 0.00 0.50 0.00 0.00 58.65 59.49 1wuu h GLN 290 Cb 1.09 -0.06 -0.02 0.00 0.05 0.00 0.00 27.48 28.53 1wuu h GLN 290 CO -0.45 0.70 0.02 0.00 -1.50 0.00 0.00 178.83 177.59 1wuu h ALA 291 N 0.88 0.87 -0.26 3.87 0.00 0.28 -0.92 119.26 123.98 1wuu h ALA 291 Ca 0.10 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.77 1wuu h ALA 291 Cb 0.41 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 1wuu h ALA 291 CO 0.01 0.67 -0.20 0.00 0.00 0.00 0.00 179.25 179.73 1wuu h ALA 292 N 1.03 -0.03 0.48 0.00 0.00 -1.45 2.04 119.26 121.33 1wuu h ALA 292 Ca 0.18 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1wuu h ALA 292 Cb 0.54 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1wuu h ALA 292 CO 0.03 -0.61 -0.38 0.00 0.00 0.00 0.00 179.25 178.29 1wuu h ALA 293 N 0.94 -0.88 -0.63 0.00 0.00 -1.60 1.97 119.26 119.06 1wuu h ALA 293 Ca 0.14 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.00 1wuu h ALA 293 Cb 0.40 0.51 -0.12 0.00 0.00 0.00 0.00 17.79 18.58 1wuu h ALA 293 CO -0.37 -1.02 -0.38 0.00 0.00 0.00 0.00 179.25 177.48 1wuu h ALA 294 N -0.47 -0.15 -0.99 0.00 0.00 -0.81 0.63 119.26 117.46 1wuu h ALA 294 Ca -0.05 0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1wuu h ALA 294 Cb 0.72 0.89 -0.06 0.00 0.00 0.00 0.00 17.79 19.34 1wuu h ALA 294 CO -0.00 -0.74 0.64 1.25 0.00 0.00 0.00 179.25 180.41 1wuu h LEU 295 N -0.17 1.04 0.10 0.00 5.85 0.54 -2.03 115.31 120.64 1wuu h LEU 295 Ca 0.22 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1wuu h LEU 295 Cb 0.56 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1wuu h LEU 295 CO -0.72 0.68 -0.05 0.03 -0.34 0.00 0.00 178.44 178.05 1wuu h ARG 296 N 1.19 -0.13 -0.21 1.25 3.08 0.74 -2.56 114.38 117.74 1wuu h ARG 296 Ca 0.42 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.53 1wuu h ARG 296 Cb 0.11 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1wuu h ARG 296 CO -0.15 -0.01 0.36 0.00 -1.07 0.00 0.00 179.97 179.10 1wuu h ARG 297 N -0.22 0.00 0.00 0.04 3.08 0.51 -3.45 114.38 114.34 1wuu h ARG 297 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1wuu h ARG 297 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1wuu h ARG 297 CO 0.02 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 1wuu n GLY 298 N -1.36 0.23 3.16 0.04 0.00 -0.95 -4.99 105.19 101.32 1wuu n GLY 298 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1wuu n GLY 298 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wuu n ASP 299 N 0.00 2.72 0.13 1.61 4.64 -0.81 -4.75 116.55 120.08 1wuu n ASP 299 Ca 0.00 -2.70 0.08 0.00 -1.38 0.00 0.00 54.79 50.80 1wuu n ASP 299 Cb 0.00 -1.25 0.45 0.00 -1.04 0.00 0.00 41.12 39.28 1wuu n ASP 299 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 1wuu n TYR 300 N 8.45 0.56 -0.05 -0.67 0.53 -1.26 -2.79 117.16 121.92 1wuu n TYR 300 Ca 0.49 0.29 -0.03 0.00 -1.02 0.00 0.00 57.90 57.64 1wuu n TYR 300 Cb 0.41 -0.95 -0.02 0.00 -1.03 0.00 0.00 39.34 37.75 1wuu n TYR 300 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1wuu h ARG 301 N 0.00 -0.00 -0.77 -0.72 3.08 -1.92 -2.79 114.38 111.25 1wuu h ARG 301 Ca 0.00 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.11 1wuu h ARG 301 Cb 0.05 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.05 1wuu h ARG 301 CO 0.00 0.18 0.51 0.00 -1.07 0.00 0.00 179.97 179.58 1wuu h ALA 302 N -0.82 1.65 -0.06 0.04 0.00 -1.91 -1.52 119.26 116.64 1wuu h ALA 302 Ca -0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1wuu h ALA 302 Cb 0.18 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1wuu h ALA 302 CO 0.00 0.23 -0.18 0.35 0.00 0.00 0.00 179.25 179.65 1wuu h PHE 303 N 0.83 -0.52 0.00 0.00 3.57 -1.60 0.80 116.94 120.02 1wuu h PHE 303 Ca 0.33 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.85 1wuu h PHE 303 Cb 0.24 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 1wuu h PHE 303 CO -0.00 -0.17 -0.02 0.78 -2.23 0.00 0.00 178.31 176.66 1wuu h GLY 304 N -0.18 0.00 0.92 2.40 0.00 -1.37 -0.50 103.07 104.34 1wuu h GLY 304 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1wuu h GLY 304 CO -0.15 0.00 0.06 3.21 0.00 0.00 0.00 176.54 179.67 1wuu h ARG 305 N 0.00 0.59 -1.50 4.80 3.08 0.25 -1.48 114.38 120.12 1wuu h ARG 305 Ca -0.00 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.90 1wuu h ARG 305 Cb 0.05 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1wuu h ARG 305 CO 0.00 0.65 0.00 1.28 -1.07 0.00 0.00 179.97 180.83 1wuu n LEU 306 N -4.58 0.94 0.00 3.04 4.77 0.25 -2.13 117.00 119.29 1wuu n LEU 306 Ca -0.01 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 1wuu n LEU 306 Cb 0.22 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1wuu n LEU 306 CO 0.38 0.16 0.00 0.52 -1.33 0.00 0.00 177.39 177.12 1wuu n VAL 308 N 0.77 0.00 -0.03 4.08 0.31 -0.56 -0.16 118.33 122.74 1wuu n VAL 308 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 1wuu n VAL 308 Cb 0.16 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.03 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 0.20 -0.41 5.55 5.08 -1.69 -2.35 114.58 120.96 1wuu h GLU 309 Ca 0.00 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1wuu h GLU 309 Cb 0.00 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.16 1wuu h GLU 309 CO 0.00 0.40 -0.40 1.03 -1.00 0.00 0.00 179.01 179.04 1wuu h SER 310 N -0.02 -1.37 -0.83 1.42 0.87 -0.84 -0.53 113.55 112.23 1wuu h SER 310 Ca 0.04 0.19 0.19 0.00 -1.23 0.00 0.00 61.79 60.98 1wuu h SER 310 Cb 0.29 0.58 -0.15 0.00 -0.44 0.00 0.00 62.40 62.68 1wuu h SER 310 CO 0.00 -0.25 -0.07 -0.74 -0.53 0.00 0.00 176.83 175.24 1wuu h HIS 311 N -0.20 -0.20 -0.11 2.24 -0.00 -1.77 0.21 115.15 115.32 1wuu h HIS 311 Ca 0.07 0.07 -0.11 0.00 -0.00 0.00 0.00 60.37 60.40 1wuu h HIS 311 Cb 0.38 0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 28.00 1wuu h HIS 311 CO -0.78 -0.32 -0.41 0.00 -0.00 0.00 0.00 177.93 176.42 1wuu h ARG 312 N 0.05 0.24 0.29 5.26 3.08 -0.65 -1.48 114.38 121.16 1wuu h ARG 312 Ca 0.45 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.38 1wuu h ARG 312 Cb 0.79 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1wuu h ARG 312 CO -0.79 0.61 -0.23 1.03 -1.07 0.00 0.00 179.97 179.52 1wuu h SER 313 N 0.20 -0.59 0.06 7.04 0.87 0.82 -0.47 113.55 121.48 1wuu h SER 313 Ca 0.02 0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1wuu h SER 313 Cb 0.81 0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 62.91 1wuu h SER 313 CO 0.06 -0.35 -0.47 -0.07 -0.53 0.00 0.00 176.83 175.47 1wuu h LEU 314 N -0.53 -1.43 -0.15 2.23 3.38 -0.95 0.11 115.31 117.97 1wuu h LEU 314 Ca -0.02 0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1wuu h LEU 314 Cb 0.46 0.54 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 1wuu h LEU 314 CO -0.01 -0.51 -0.30 -0.09 0.09 0.00 0.00 178.44 177.62 1wuu h ARG 315 N -0.66 -0.26 0.00 1.13 2.43 -1.05 1.98 114.38 117.95 1wuu h ARG 315 Ca 0.02 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1wuu h ARG 315 Cb 0.71 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1wuu h ARG 315 CO -0.31 -0.17 -0.06 -0.44 -1.51 0.00 0.00 179.97 177.48 1wuu h ASP 316 N -0.27 0.00 0.30 -3.80 3.32 -1.10 -3.26 116.42 111.61 1wuu h ASP 316 Ca 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1wuu h ASP 316 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1wuu h ASP 316 CO -0.28 0.26 -0.14 0.44 -1.72 0.00 0.00 179.24 177.79 1wuu h ASP 317 N -0.46 -0.34 -0.32 6.45 3.32 -1.04 -3.34 116.42 120.69 1wuu h ASP 317 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1wuu h ASP 317 Cb 0.06 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1wuu h ASP 317 CO 0.00 -0.23 0.15 0.22 -1.72 0.00 0.00 179.24 177.66 1wuu h TYR 318 N -0.42 0.47 -3.71 4.55 3.20 -0.52 -3.38 116.97 117.16 1wuu h TYR 318 Ca -0.04 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.72 1wuu h TYR 318 Cb 0.31 -0.15 0.06 0.00 1.54 0.00 0.00 36.73 38.49 1wuu h TYR 318 CO 0.15 0.42 -0.28 0.39 -1.64 0.00 0.00 178.16 177.20 1wuu n GLU 319 N -4.75 -0.94 -0.23 1.82 1.02 0.67 -4.92 120.64 113.30 1wuu n GLU 319 Ca -0.01 0.28 0.01 0.00 -0.02 0.00 0.00 57.16 57.42 1wuu n GLU 319 Cb 0.11 -3.01 0.01 0.00 -0.02 0.00 0.00 31.44 28.52 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 -2.06 0.19 -2.76 2.62 0.24 -1.19 -5.02 118.33 110.36 1wuu n VAL 320 Ca -0.03 -0.22 -0.22 0.00 -2.04 0.00 0.00 64.34 61.83 1wuu n VAL 320 Cb 0.54 0.65 0.08 0.00 -1.47 0.00 0.00 33.84 33.65 1wuu n VAL 320 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1wuu s SER 321 N -0.72 4.76 -0.05 -1.34 0.15 -1.26 0.17 113.70 115.40 1wuu s SER 321 Ca 0.02 -0.49 -0.03 0.00 0.70 0.00 0.00 55.95 56.16 1wuu s SER 321 Cb 0.02 -0.04 0.03 0.00 -1.71 0.00 0.00 66.02 64.32 1wuu s SER 321 CO 0.00 -1.56 0.12 0.00 1.20 0.00 0.00 173.24 173.00 1wuu n PRO 323 N 3.81 -0.02 -0.14 0.00 -0.02 -1.26 0.33 135.00 137.71 1wuu n PRO 323 Ca -0.22 0.37 -0.11 0.00 -2.02 0.00 0.00 63.50 61.52 1wuu n PRO 323 Cb 0.54 -0.62 -0.01 0.00 -0.02 0.00 0.00 33.50 33.39 1wuu n PRO 323 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1wuu h GLU 324 N 0.00 0.82 0.19 -0.52 3.07 -1.98 -1.16 114.58 115.01 1wuu h GLU 324 Ca 0.18 -0.33 -0.01 0.00 -0.50 0.00 0.00 59.36 58.70 1wuu h GLU 324 Cb 0.41 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 1wuu h GLU 324 CO -0.22 0.96 -0.09 -0.07 -1.40 0.00 0.00 179.01 178.18 1wuu h LEU 325 N 0.64 -0.21 -0.38 1.33 3.38 0.52 -2.41 115.31 118.18 1wuu h LEU 325 Ca 0.10 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.11 1wuu h LEU 325 Cb 0.67 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.42 1wuu h LEU 325 CO 0.05 -0.12 0.04 0.44 0.09 0.00 0.00 178.44 178.93 1wuu h ASP 326 N -0.29 -0.08 -0.33 -0.43 3.32 -1.12 0.08 116.42 117.57 1wuu h ASP 326 Ca -0.03 0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.13 1wuu h ASP 326 Cb 0.22 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.85 1wuu h ASP 326 CO 0.04 -0.00 -0.30 -0.61 -1.72 0.00 0.00 179.24 176.65 1wuu h GLN 327 N 0.15 -0.12 -0.96 3.56 4.15 -1.06 -1.64 115.11 119.18 1wuu h GLN 327 Ca 0.19 0.01 0.25 0.00 0.77 0.00 0.00 58.65 59.87 1wuu h GLN 327 Cb 0.24 0.03 -0.13 0.00 0.21 0.00 0.00 27.48 27.83 1wuu h GLN 327 CO -0.28 -0.08 0.49 -0.07 -1.93 0.00 0.00 178.83 176.96 1wuu h LEU 328 N -0.13 0.46 0.34 -2.39 3.38 -0.89 0.42 115.31 116.49 1wuu h LEU 328 Ca 0.06 0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1wuu h LEU 328 Cb 0.27 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1wuu h LEU 328 CO -0.38 -0.01 -0.16 0.58 0.09 0.00 0.00 178.44 178.56 1wuu h VAL 329 N 0.42 0.00 -0.94 1.22 2.07 -0.21 -2.01 116.25 116.81 1wuu h VAL 329 Ca 0.63 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 68.15 1wuu h VAL 329 Cb 1.27 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.91 1wuu h VAL 329 CO -0.54 0.00 -0.54 -0.33 0.02 0.00 0.00 177.57 176.18 1wuu h GLU 330 N -0.55 -0.04 -1.05 1.57 5.08 -0.80 3.00 114.58 121.80 1wuu h GLU 330 Ca -0.05 0.00 0.39 0.00 -1.00 0.00 0.00 59.36 58.71 1wuu h GLU 330 Cb 0.34 0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.44 1wuu h GLU 330 CO 0.08 -0.02 0.60 0.00 -1.00 0.00 0.00 179.01 178.66 1wuu h ALA 331 N 0.66 2.19 0.00 3.43 0.00 -0.16 -1.45 119.26 123.93 1wuu h ALA 331 Ca 0.20 0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 1wuu h ALA 331 Cb 0.47 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1wuu h ALA 331 CO -0.92 -0.90 -0.14 0.00 0.00 0.00 0.00 179.25 177.29 1wuu h ALA 332 N 1.89 0.03 -1.14 0.00 0.00 0.60 -3.28 119.26 117.37 1wuu h ALA 332 Ca 0.81 -0.57 0.32 0.00 0.00 0.00 0.00 54.91 55.47 1wuu h ALA 332 Cb 2.12 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.92 1wuu h ALA 332 CO -0.67 0.08 0.77 -0.07 0.00 0.00 0.00 179.25 179.36 1wuu h LEU 333 N -1.00 0.23 -1.56 0.00 3.38 0.39 0.89 115.31 117.65 1wuu h LEU 333 Ca -0.04 0.05 0.25 0.00 0.09 0.00 0.00 57.88 58.23 1wuu h LEU 333 Cb 1.02 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.71 1wuu h LEU 333 CO -0.02 0.02 0.65 0.00 0.09 0.00 0.00 178.44 179.19 1wuu h ALA 334 N 1.52 2.38 -2.59 1.53 0.00 -1.44 -3.41 119.26 117.25 1wuu h ALA 334 Ca 0.60 0.02 -0.49 0.00 0.00 0.00 0.00 54.91 55.05 1wuu h ALA 334 Cb 1.95 0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.77 1wuu h ALA 334 CO -0.18 -0.71 0.43 0.08 0.00 0.00 0.00 179.25 178.87 1wuu s VAL 335 N -5.35 3.61 -0.21 0.00 1.01 0.31 -4.97 120.40 114.80 1wuu s VAL 335 Ca -0.08 1.31 -0.25 0.00 0.00 0.00 0.00 61.98 62.96 1wuu s VAL 335 Cb 0.24 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 1wuu s VAL 335 CO 0.79 0.08 0.84 -2.84 0.00 0.00 0.00 175.10 173.97 1wuu s PRO 336 N -2.29 4.24 0.00 2.72 0.02 -1.26 -3.12 135.00 135.32 1wuu s PRO 336 Ca 0.55 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.57 1wuu s PRO 336 Cb -0.25 -3.61 0.00 0.00 0.02 0.00 0.00 34.50 30.66 1wuu s PRO 336 CO 0.31 -0.43 0.00 0.41 -0.33 0.00 0.00 177.00 176.97 1wuu n GLY 337 N 3.59 1.54 3.66 0.52 0.00 -1.26 -4.93 105.19 108.31 1wuu n GLY 337 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.53 3.76 -1.01 1.61 1.01 -1.18 -2.48 120.40 120.57 1wuu s VAL 338 Ca 0.00 0.93 0.28 0.00 0.00 0.00 0.00 61.98 63.19 1wuu s VAL 338 Cb 0.00 -3.60 0.19 0.00 0.00 0.00 0.00 36.38 32.97 1wuu s VAL 338 CO 0.00 -0.08 1.82 -1.22 0.00 0.00 0.00 175.10 175.62 1wuu n TYR 339 N 6.94 0.00 -3.58 5.22 4.02 0.31 -4.97 117.16 125.09 1wuu n TYR 339 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 1wuu n TYR 339 Cb 0.43 -0.44 0.00 0.00 -0.02 0.00 0.00 39.34 39.31 1wuu n TYR 339 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1wuu n GLY 340 N 1.50 -0.92 3.59 2.72 0.00 -1.20 -3.22 105.19 107.66 1wuu n GLY 340 Ca 0.07 -1.27 -0.04 0.00 0.00 0.00 0.00 46.02 44.78 1wuu n GLY 340 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wuu s SER 341 N -4.00 -0.14 0.00 1.61 0.01 -1.26 -3.58 113.70 106.33 1wuu s SER 341 Ca 0.00 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.24 1wuu s SER 341 Cb 0.00 0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.40 1wuu s SER 341 CO 0.00 -0.27 0.00 -2.11 0.41 0.00 0.00 173.24 171.27 1wuu n ARG 342 N -0.15 0.00 -3.51 12.44 1.85 -1.13 -3.60 116.66 122.56 1wuu n ARG 342 Ca -0.01 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.72 1wuu n ARG 342 Cb 0.59 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.96 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 -0.81 0.48 115.64 125.31 1wuu s THR 344 Ca 0.00 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 1wuu s THR 344 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 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 0.28 -1.65 0.39 6.08 0.00 -1.25 -4.24 105.19 104.80 1wuu n GLY 345 Ca -0.13 -1.46 0.18 0.00 0.00 0.00 0.00 46.02 44.60 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 0.75 0.00 -0.02 0.00 -1.96 -3.46 103.07 98.38 1wuu h GLY 346 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1wuu h GLY 346 CO 0.00 0.03 0.00 0.61 0.00 0.00 0.00 176.54 177.18 1wuu n GLY 347 N -1.53 0.42 2.57 4.60 0.00 -1.26 -4.94 105.19 105.05 1wuu n GLY 347 Ca 0.17 -2.10 -0.14 0.00 0.00 0.00 0.00 46.02 43.94 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 0.05 -1.32 0.00 1.61 0.99 0.44 -4.80 117.46 114.43 1wuu n PHE 348 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 57.45 57.83 1wuu n PHE 348 Cb 0.00 -3.24 0.00 0.00 -1.00 0.00 0.00 39.48 35.24 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 -1.27 0.78 7.00 1.37 0.00 -1.26 -3.53 105.19 108.28 1wuu n GLY 349 Ca -0.06 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.11 3.96 -0.02 0.00 0.33 -4.91 105.19 104.43 1wuu n GLY 350 Ca 0.00 -0.99 -0.22 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.34 1.98 -0.12 0.00 -4.23 0.31 -1.92 115.64 109.32 1wuu s THR 352 Ca 0.43 -1.87 -0.00 0.00 -1.18 0.00 0.00 61.69 59.06 1wuu s THR 352 Cb -0.10 -2.85 0.02 0.00 1.34 0.00 0.00 72.50 70.92 1wuu s THR 352 CO 0.35 0.00 -0.08 0.54 -0.54 0.00 0.00 174.62 174.89 1wuu s VAL 353 N -2.70 1.09 -0.24 2.29 0.11 0.18 -1.47 120.40 119.66 1wuu s VAL 353 Ca 0.33 -0.33 -0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1wuu s VAL 353 Cb 0.06 -1.10 0.02 0.00 -1.53 0.00 0.00 36.38 33.84 1wuu s VAL 353 CO 0.18 0.38 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.38 1wuu s THR 354 N 1.68 2.96 -0.27 5.04 2.01 0.88 -2.83 115.64 125.12 1wuu s THR 354 Ca 0.05 -0.93 -0.18 0.00 0.31 0.00 0.00 61.69 60.94 1wuu s THR 354 Cb -0.13 -2.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.89 1wuu s THR 354 CO -0.09 0.24 0.53 -0.22 -0.69 0.00 0.00 174.62 174.40 1wuu s LEU 355 N 1.35 4.07 0.34 4.42 2.96 -1.23 0.29 118.68 130.89 1wuu s LEU 355 Ca 0.01 0.51 -0.10 0.00 -0.22 0.00 0.00 54.13 54.33 1wuu s LEU 355 Cb -0.16 -2.69 0.02 0.00 0.50 0.00 0.00 46.19 43.86 1wuu s LEU 355 CO -0.04 -0.32 0.61 -1.48 -1.32 0.00 0.00 176.35 173.80 1wuu s LEU 356 N 2.36 0.46 -0.18 -0.68 -0.00 -0.18 0.11 118.68 120.57 1wuu s LEU 356 Ca 0.22 -1.23 -0.29 0.00 -0.00 0.00 0.00 54.13 52.83 1wuu s LEU 356 Cb -0.16 2.11 -0.01 0.00 -0.00 0.00 0.00 46.19 48.13 1wuu s LEU 356 CO 0.09 -1.43 1.27 -1.61 -0.00 0.00 0.00 176.35 174.67 1wuu s GLU 357 N -2.96 4.20 0.00 1.48 2.02 -1.04 0.21 118.70 122.62 1wuu s GLU 357 Ca 0.22 1.62 0.00 0.00 0.02 0.00 0.00 54.97 56.83 1wuu s GLU 357 Cb -0.03 -3.78 0.00 0.00 0.10 0.00 0.00 34.13 30.43 1wuu s GLU 357 CO 0.15 -0.75 0.48 0.00 0.02 0.00 0.00 175.26 175.16 1wuu n ALA 358 N 6.71 0.00 -0.54 5.21 0.00 -0.13 0.20 120.51 131.97 1wuu n ALA 358 Ca 0.14 0.00 0.41 0.00 0.00 0.00 0.00 53.44 53.99 1wuu n ALA 358 Cb 0.45 0.24 0.65 0.00 0.00 0.00 0.00 19.45 20.78 1wuu n ALA 358 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1wuu n SER 359 N -2.01 0.04 0.10 0.00 3.41 -1.26 0.56 113.62 114.46 1wuu n SER 359 Ca 0.00 0.89 0.11 0.00 -0.26 0.00 0.00 58.87 59.62 1wuu n SER 359 Cb 0.00 -0.44 0.45 0.00 -0.26 0.00 0.00 64.21 63.96 1wuu n SER 359 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wuu n ALA 360 N -2.70 1.81 -0.57 7.33 0.00 0.54 -4.50 120.51 122.42 1wuu n ALA 360 Ca 0.36 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1wuu n ALA 360 Cb 1.57 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 19.63 1wuu n ALA 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wuu n ALA 361 N -1.72 -0.03 -0.06 0.00 0.00 0.19 -1.49 120.51 117.42 1wuu n ALA 361 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.39 1wuu n ALA 361 Cb 0.26 0.31 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 1wuu n ALA 361 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1wuu h PRO 362 N 0.00 -0.28 -0.60 0.00 0.13 -1.83 0.19 132.00 129.62 1wuu h PRO 362 Ca 0.00 0.02 0.12 0.00 -0.87 0.00 0.00 66.00 65.27 1wuu h PRO 362 Cb 0.00 0.06 -0.11 0.00 0.13 0.00 0.00 31.00 31.08 1wuu h PRO 362 CO 0.00 -0.19 -0.14 1.25 -0.23 0.00 0.00 178.00 178.69 1wuu h HIS 363 N -0.29 -0.30 0.00 1.56 -0.00 -1.84 0.16 115.15 114.45 1wuu h HIS 363 Ca 0.14 0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.56 1wuu h HIS 363 Cb 0.51 0.22 0.00 0.00 -0.00 0.00 0.00 27.41 28.14 1wuu h HIS 363 CO -0.44 -0.25 0.00 0.00 -0.00 0.00 0.00 177.93 177.24 1wuu n ALA 364 N -2.99 0.59 0.00 5.26 0.00 0.67 -1.10 120.51 122.95 1wuu n ALA 364 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1wuu n ALA 364 Cb 0.31 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 19.23 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 0.37 0.00 0.32 0.00 1.74 0.57 -1.74 116.66 117.92 1wuu n ARG 366 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 1wuu n ARG 366 Cb 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.34 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 -1.37 -0.77 -1.55 2.76 -1.36 -2.09 115.15 110.77 1wuu h HIS 367 Ca 0.00 0.01 0.16 0.00 -2.20 0.00 0.00 60.37 58.34 1wuu h HIS 367 Cb 0.00 0.52 -0.11 0.00 1.55 0.00 0.00 27.41 29.38 1wuu h HIS 367 CO 0.00 -0.68 0.26 0.82 -1.30 0.00 0.00 177.93 177.03 1wuu h ILE 368 N -1.04 0.56 0.00 6.26 2.04 -1.57 -0.16 117.51 123.60 1wuu h ILE 368 Ca -0.07 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1wuu h ILE 368 Cb 0.89 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1wuu h ILE 368 CO -0.03 0.06 0.00 1.67 0.00 0.00 0.00 178.15 179.85 1wuu n GLN 369 N -5.08 0.00 -0.15 2.37 -0.06 -1.14 -1.70 117.38 111.62 1wuu n GLN 369 Ca 0.15 0.26 -0.01 0.00 -2.00 0.00 0.00 57.00 55.39 1wuu n GLN 369 Cb 0.47 -1.20 0.00 0.00 -4.06 0.00 0.00 30.24 25.46 1wuu n GLN 369 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 1wuu n GLU 370 N -1.17 -0.11 -0.27 3.69 1.02 -0.80 0.36 120.64 123.35 1wuu n GLU 370 Ca 0.00 0.59 0.03 0.00 -0.02 0.00 0.00 57.16 57.75 1wuu n GLU 370 Cb 0.00 -0.87 0.14 0.00 -0.02 0.00 0.00 31.44 30.69 1wuu n GLU 370 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1wuu n HIS 371 N -4.54 0.65 -3.80 -0.32 8.25 -0.10 -4.72 115.22 110.64 1wuu n HIS 371 Ca 0.03 -0.24 -0.37 0.00 -0.26 0.00 0.00 57.72 56.89 1wuu n HIS 371 Cb 0.14 -0.19 -0.13 0.00 1.12 0.00 0.00 29.99 30.93 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 -1.63 3.21 -1.19 4.41 5.04 1.12 -4.79 117.35 123.52 1wuu s TYR 372 Ca 0.19 -1.40 -0.20 0.00 -2.44 0.00 0.00 57.07 53.22 1wuu s TYR 372 Cb 0.13 -2.22 -0.03 0.00 0.35 0.00 0.00 41.96 40.19 1wuu s TYR 372 CO 0.07 -0.71 1.91 0.41 -1.34 0.00 0.00 175.55 175.90 1wuu n GLY 373 N 4.78 2.32 0.00 8.97 0.00 -1.26 -4.68 105.19 115.33 1wuu n GLY 373 Ca -0.13 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 5.17 -1.76 3.27 -0.02 0.00 -1.26 -5.07 105.19 105.53 1wuu n GLY 374 Ca 0.48 -1.49 -0.44 0.00 0.00 0.00 0.00 46.02 44.57 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 -1.84 4.97 0.58 2.61 2.01 -1.26 -5.00 115.64 117.70 1wuu s THR 375 Ca 0.00 -2.02 -0.16 0.00 0.31 0.00 0.00 61.69 59.82 1wuu s THR 375 Cb 0.00 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.30 1wuu s THR 375 CO 0.00 -0.90 1.04 0.00 -0.69 0.00 0.00 174.62 174.07 1wuu s ALA 376 N 0.92 2.82 -0.01 7.40 0.00 -1.26 -4.47 121.76 127.15 1wuu s ALA 376 Ca 0.10 0.33 0.07 0.00 0.00 0.00 0.00 51.96 52.46 1wuu s ALA 376 Cb -0.22 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1wuu s ALA 376 CO -0.02 -0.69 -0.23 0.99 0.00 0.00 0.00 175.76 175.80 1wuu s THR 377 N -2.52 2.30 -0.03 0.00 2.01 0.01 -4.94 115.64 112.46 1wuu s THR 377 Ca 0.62 -1.11 0.07 0.00 0.31 0.00 0.00 61.69 61.58 1wuu s THR 377 Cb -0.14 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.50 1wuu s THR 377 CO 0.36 0.51 -0.24 -0.36 -0.69 0.00 0.00 174.62 174.21 1wuu s PHE 378 N -0.70 2.16 -0.03 4.92 0.40 -1.26 -0.02 117.98 123.46 1wuu s PHE 378 Ca 0.11 -0.48 0.03 0.00 -0.60 0.00 0.00 56.93 55.99 1wuu s PHE 378 Cb -0.10 -1.40 0.00 0.00 0.51 0.00 0.00 43.02 42.03 1wuu s PHE 378 CO 0.00 -0.08 -0.10 0.71 0.70 0.00 0.00 175.22 176.45 1wuu s TYR 379 N -0.43 1.06 -0.68 0.36 1.51 -0.81 -0.08 117.35 118.28 1wuu s TYR 379 Ca 0.06 -0.27 -0.03 0.00 -1.01 0.00 0.00 57.07 55.82 1wuu s TYR 379 Cb -0.10 -0.74 0.17 0.00 -0.11 0.00 0.00 41.96 41.18 1wuu s TYR 379 CO 0.00 -0.10 0.52 -0.51 -1.11 0.00 0.00 175.55 174.34 1wuu s LEU 380 N 0.14 5.37 0.64 -1.29 1.43 -1.26 -2.05 118.68 121.66 1wuu s LEU 380 Ca -0.03 -3.01 -0.15 0.00 -1.03 0.00 0.00 54.13 49.91 1wuu s LEU 380 Cb -0.09 -1.88 -0.01 0.00 0.03 0.00 0.00 46.19 44.24 1wuu s LEU 380 CO 0.01 -0.34 1.09 -0.55 0.23 0.00 0.00 176.35 176.78 1wuu s SER 381 N 0.59 5.35 -0.05 2.29 0.15 -0.99 -4.97 113.70 116.06 1wuu s SER 381 Ca 0.19 1.93 -0.02 0.00 0.70 0.00 0.00 55.95 58.75 1wuu s SER 381 Cb -0.17 -2.54 0.04 0.00 -1.71 0.00 0.00 66.02 61.63 1wuu s SER 381 CO -0.05 -1.47 0.10 -1.10 1.20 0.00 0.00 173.24 171.93 1wuu s GLN 382 N -4.12 0.04 0.14 5.44 -1.52 -1.26 -4.10 119.66 114.29 1wuu s GLN 382 Ca 0.66 0.31 -0.31 0.00 -1.95 0.00 0.00 55.36 54.06 1wuu s GLN 382 Cb -0.19 -0.20 -0.10 0.00 -0.22 0.00 0.00 33.01 32.30 1wuu s GLN 382 CO 0.40 -0.17 1.59 0.00 -0.25 0.00 0.00 175.29 176.87 1wuu s ALA 383 N 1.14 3.75 0.24 6.09 0.00 -1.26 -4.30 121.76 127.41 1wuu s ALA 383 Ca -0.09 1.32 0.02 0.00 0.00 0.00 0.00 51.96 53.21 1wuu s ALA 383 Cb -0.12 -3.64 0.02 0.00 0.00 0.00 0.00 23.12 19.38 1wuu s ALA 383 CO -0.05 -0.87 0.17 0.00 0.00 0.00 0.00 175.76 175.01 1wuu n ALA 384 N 4.43 0.36 -1.95 0.00 0.00 -0.61 -0.05 120.51 122.69 1wuu n ALA 384 Ca 0.14 -0.97 -0.23 0.00 0.00 0.00 0.00 53.44 52.38 1wuu n ALA 384 Cb 0.39 0.40 0.05 0.00 0.00 0.00 0.00 19.45 20.30 1wuu n ALA 384 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wuu s ASP 385 N -2.40 5.05 0.60 0.00 1.01 -1.26 -2.06 116.67 117.60 1wuu s ASP 385 Ca 0.13 0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.61 1wuu s ASP 385 Cb -0.01 -0.98 0.00 0.00 1.01 0.00 0.00 42.92 42.94 1wuu s ASP 385 CO 0.08 -1.37 0.00 0.61 0.21 0.00 0.00 175.17 174.70 1wuu n GLY 386 N -2.63 -0.69 3.66 0.21 0.00 -0.95 -4.70 105.19 100.10 1wuu n GLY 386 Ca 0.08 -1.70 -0.45 0.00 0.00 0.00 0.00 46.02 43.95 1wuu n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wuu n ALA 387 N -3.00 0.86 -2.28 4.61 0.00 -0.30 -4.75 120.51 115.64 1wuu n ALA 387 Ca 0.00 0.41 -0.09 0.00 0.00 0.00 0.00 53.44 53.76 1wuu n ALA 387 Cb 0.00 -2.23 -0.09 0.00 0.00 0.00 0.00 19.45 17.13 1wuu n ALA 387 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1wuu s LYS 388 N -0.75 0.87 -0.13 0.00 -2.85 0.73 -4.98 119.74 112.63 1wuu s LYS 388 Ca 0.66 -1.28 -0.16 0.00 -1.00 0.00 0.00 55.97 54.19 1wuu s LYS 388 Cb -0.66 0.27 -0.04 0.00 -2.06 0.00 0.00 37.83 35.34 1wuu s LYS 388 CO 0.53 -0.25 0.40 0.08 0.10 0.00 0.00 175.35 176.20 1wuu s VAL 389 N -3.98 5.23 -0.24 1.79 1.01 -1.26 -0.87 120.40 122.08 1wuu s VAL 389 Ca 0.16 0.78 -0.05 0.00 0.00 0.00 0.00 61.98 62.87 1wuu s VAL 389 Cb 0.07 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 1wuu s VAL 389 CO -0.03 0.37 0.01 -0.76 0.00 0.00 0.00 175.10 174.69 1wuu s LEU 390 N 0.44 3.17 -0.30 3.92 1.43 -0.08 -4.96 118.68 122.30 1wuu s LEU 390 Ca 0.22 -0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 52.66 1wuu s LEU 390 Cb -0.14 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.27 1wuu s LEU 390 CO 0.08 -0.04 1.25 0.00 0.23 0.00 0.00 176.35 177.87