#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1llq s VAL 3 N 0.00 4.25 0.72 -3.33 1.01 -0.48 -4.86 120.40 117.72 1llq s VAL 3 Ca 0.00 1.02 -0.12 0.00 0.00 0.00 0.00 61.98 62.88 1llq s VAL 3 Cb 0.00 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.82 1llq s VAL 3 CO 0.00 -0.67 1.10 0.00 0.00 0.00 0.00 175.10 175.52 1llq s ALA 4 N -2.64 2.36 0.09 5.51 0.00 -1.26 -1.03 121.76 124.79 1llq s ALA 4 Ca 0.60 0.37 0.31 0.00 0.00 0.00 0.00 51.96 53.25 1llq s ALA 4 Cb -0.12 -3.29 1.59 0.00 0.00 0.00 0.00 23.12 21.30 1llq s ALA 4 CO 0.37 -1.54 1.95 1.12 0.00 0.00 0.00 175.76 177.66 1llq h HIS 5 N -0.63 0.00 -0.49 0.00 -0.00 -1.88 -1.06 115.15 111.09 1llq h HIS 5 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.92 1llq h HIS 5 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.65 1llq h HIS 5 CO 0.57 0.00 0.00 -2.39 -0.00 0.00 0.00 177.93 176.11 1llq n HIS 6 N -2.64 0.64 -4.29 6.12 -0.00 -1.26 -4.94 115.22 108.85 1llq n HIS 6 Ca -0.01 -0.34 -0.29 0.00 -0.00 0.00 0.00 57.72 57.08 1llq n HIS 6 Cb 0.11 -0.00 -0.11 0.00 -0.00 0.00 0.00 29.99 29.99 1llq n HIS 6 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1llq s GLU 7 N -1.30 1.88 0.56 -1.40 2.02 -0.40 -5.13 118.70 114.92 1llq s GLU 7 Ca 0.41 -1.18 -0.06 0.00 0.02 0.00 0.00 54.97 54.16 1llq s GLU 7 Cb 0.23 -2.15 -0.01 0.00 0.10 0.00 0.00 34.13 32.30 1llq s GLU 7 CO 0.31 0.48 0.87 0.34 0.02 0.00 0.00 175.26 177.28 1llq s ASP 8 N -2.27 5.87 0.70 -0.19 -1.08 -1.26 -4.71 116.67 113.73 1llq s ASP 8 Ca 0.20 0.85 -0.12 0.00 -0.52 0.00 0.00 52.55 52.95 1llq s ASP 8 Cb -0.10 -1.96 0.02 0.00 -1.46 0.00 0.00 42.92 39.42 1llq s ASP 8 CO 0.12 -0.88 1.08 0.68 0.52 0.00 0.00 175.17 176.68 1llq s VAL 9 N -2.92 3.56 -0.24 1.11 -7.23 -1.26 -4.13 120.40 109.28 1llq s VAL 9 Ca 0.52 0.59 -0.06 0.00 -1.81 0.00 0.00 61.98 61.21 1llq s VAL 9 Cb -0.10 -3.15 0.01 0.00 0.56 0.00 0.00 36.38 33.70 1llq s VAL 9 CO 0.46 -0.59 0.14 0.00 -0.31 0.00 0.00 175.10 174.80 1llq n TYR 10 N -2.96 -0.32 -2.16 2.82 0.18 -1.26 -4.83 117.16 108.64 1llq n TYR 10 Ca 0.09 0.04 0.04 0.00 1.88 0.00 0.00 57.90 59.96 1llq n TYR 10 Cb 0.53 -0.58 0.08 0.00 -0.38 0.00 0.00 39.34 38.98 1llq n TYR 10 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 1llq n SER 11 N 0.19 1.17 -4.84 9.48 7.64 -1.26 -5.09 113.62 120.92 1llq n SER 11 Ca -0.03 -2.58 -0.35 0.00 1.01 0.00 0.00 58.87 56.92 1llq n SER 11 Cb 0.12 -0.36 -0.06 0.00 -1.01 0.00 0.00 64.21 62.90 1llq n SER 11 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1llq s HIS 12 N -1.01 3.60 -1.16 1.43 5.65 -1.26 -4.32 115.29 118.22 1llq s HIS 12 Ca 0.33 1.16 -0.00 0.00 0.25 0.00 0.00 55.06 56.79 1llq s HIS 12 Cb 0.35 -2.45 0.00 0.00 -1.18 0.00 0.00 32.58 29.31 1llq s HIS 12 CO -0.12 0.38 0.97 -1.71 -0.65 0.00 0.00 174.74 173.60 1llq n ASN 13 N 0.69 -2.25 -4.90 9.88 5.15 -1.26 -5.01 115.26 117.56 1llq n ASN 13 Ca -0.04 -0.59 -0.32 0.00 -0.60 0.00 0.00 54.58 53.03 1llq n ASN 13 Cb 0.52 -4.92 -0.05 0.00 -0.53 0.00 0.00 39.78 34.80 1llq n ASN 13 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1llq s LEU 14 N -6.21 4.33 0.75 1.20 1.43 -1.26 -5.08 118.68 113.83 1llq s LEU 14 Ca 0.03 0.49 -0.15 0.00 -1.03 0.00 0.00 54.13 53.47 1llq s LEU 14 Cb -0.01 -2.99 0.05 0.00 0.03 0.00 0.00 46.19 43.27 1llq s LEU 14 CO 0.70 0.16 1.21 -2.84 0.23 0.00 0.00 176.35 175.81 1llq s PRO 15 N -2.30 2.00 0.16 1.29 0.02 -1.26 -4.89 135.00 130.02 1llq s PRO 15 Ca 0.35 1.78 -0.32 0.00 0.02 0.00 0.00 61.00 62.82 1llq s PRO 15 Cb -0.13 -1.81 -0.12 0.00 0.02 0.00 0.00 34.50 32.46 1llq s PRO 15 CO 0.23 -1.95 1.75 -0.35 -0.33 0.00 0.00 177.00 176.35 1llq n PRO 16 N -2.87 2.69 -4.04 5.54 -0.04 -1.26 -4.97 135.00 130.05 1llq n PRO 16 Ca 0.14 0.97 -0.12 0.00 -0.04 0.00 0.00 63.50 64.44 1llq n PRO 16 Cb 0.50 -2.83 -0.12 0.00 -0.04 0.00 0.00 33.50 31.01 1llq n PRO 16 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1llq s MET 17 N 1.82 0.41 0.27 0.54 -1.94 -1.26 -5.08 119.30 114.05 1llq s MET 17 Ca 0.79 -0.55 -0.16 0.00 -1.71 0.00 0.00 55.69 54.06 1llq s MET 17 Cb -0.52 -0.18 -0.08 0.00 2.01 0.00 0.00 34.83 36.05 1llq s MET 17 CO 0.35 0.03 0.71 0.34 -0.01 0.00 0.00 175.02 176.44 1llq s ASP 18 N -1.14 6.86 0.06 3.03 2.15 -1.26 -4.75 116.67 121.62 1llq s ASP 18 Ca -0.08 1.28 -0.07 0.00 0.43 0.00 0.00 52.55 54.11 1llq s ASP 18 Cb -0.08 -2.37 0.04 0.00 -0.30 0.00 0.00 42.92 40.21 1llq s ASP 18 CO -0.00 -0.10 0.45 1.21 -0.17 0.00 0.00 175.17 176.57 1llq n GLU 19 N 0.09 -0.09 -0.14 4.34 4.07 -1.26 0.19 120.64 127.84 1llq n GLU 19 Ca 0.01 0.45 -0.08 0.00 -0.06 0.00 0.00 57.16 57.48 1llq n GLU 19 Cb 0.52 -0.66 0.07 0.00 -0.06 0.00 0.00 31.44 31.31 1llq n GLU 19 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1llq h LYS 20 N 0.00 0.91 -0.32 5.31 1.63 -2.00 -2.26 116.57 119.85 1llq h LYS 20 Ca 0.08 -0.32 -0.09 0.00 -0.85 0.00 0.00 60.65 59.47 1llq h LYS 20 Cb 0.15 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.70 1llq h LYS 20 CO -0.29 0.97 -0.18 0.93 -3.45 0.00 0.00 179.45 177.44 1llq h GLU 21 N 0.81 0.58 -0.28 1.90 5.08 0.18 -1.99 114.58 120.85 1llq h GLU 21 Ca 0.13 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1llq h GLU 21 Cb 0.64 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1llq h GLU 21 CO 0.04 0.73 -0.15 1.98 -1.00 0.00 0.00 179.01 180.61 1llq h MET 22 N 0.52 0.60 -0.06 2.33 4.05 -0.78 -2.19 114.93 119.40 1llq h MET 22 Ca 0.09 -0.27 0.02 0.00 -0.28 0.00 0.00 59.70 59.25 1llq h MET 22 Cb 0.60 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.37 1llq h MET 22 CO 0.04 0.85 -0.04 0.00 0.23 0.00 0.00 176.91 177.99 1llq h ALA 23 N 0.74 0.01 0.00 0.39 0.00 -1.11 -0.76 119.26 118.53 1llq h ALA 23 Ca 0.06 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1llq h ALA 23 Cb 0.68 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1llq h ALA 23 CO 0.04 -0.52 -0.16 1.25 0.00 0.00 0.00 179.25 179.87 1llq h LEU 24 N -0.05 0.00 -0.10 0.00 5.85 -1.38 -1.14 115.31 118.49 1llq h LEU 24 Ca 0.04 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.52 1llq h LEU 24 Cb 0.11 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.15 1llq h LEU 24 CO -0.09 0.16 -0.94 0.22 -0.34 0.00 0.00 178.44 177.45 1llq h TYR 25 N 0.00 0.91 -0.03 1.25 3.20 -0.70 -2.68 116.97 118.93 1llq h TYR 25 Ca -0.00 -0.47 -0.15 0.00 3.14 0.00 0.00 58.73 61.25 1llq h TYR 25 Cb 0.37 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 1llq h TYR 25 CO 0.00 1.30 -0.67 0.87 -1.64 0.00 0.00 178.16 178.02 1llq h LYS 26 N 0.38 0.13 -0.16 1.82 1.79 -0.63 -1.42 116.57 118.48 1llq h LYS 26 Ca -0.10 -0.10 -0.16 0.00 -2.18 0.00 0.00 60.65 58.11 1llq h LYS 26 Cb 1.58 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 32.25 1llq h LYS 26 CO 0.18 0.75 -0.58 1.25 -1.08 0.00 0.00 179.45 179.97 1llq h LEU 27 N 0.09 0.58 0.00 2.94 5.85 -1.24 -3.33 115.31 120.21 1llq h LEU 27 Ca -0.01 -0.32 -0.27 0.00 0.84 0.00 0.00 57.88 58.11 1llq h LEU 27 Cb 1.19 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 1llq h LEU 27 CO 0.10 1.03 -1.65 1.88 -0.34 0.00 0.00 178.44 179.46 1llq h TYR 28 N 0.39 0.00 -4.02 1.25 0.99 -1.45 -3.49 116.97 110.64 1llq h TYR 28 Ca 0.00 0.00 -0.55 0.00 2.00 0.00 0.00 58.73 60.18 1llq h TYR 28 Cb 1.13 0.00 0.14 0.00 1.00 0.00 0.00 36.73 38.99 1llq h TYR 28 CO 0.04 0.94 0.63 2.89 -0.00 0.00 0.00 178.16 182.67 1llq n ARG 29 N -3.03 1.84 -2.13 4.88 1.85 -0.54 -4.80 116.66 114.72 1llq n ARG 29 Ca -0.15 0.67 -0.41 0.00 -1.00 0.00 0.00 57.85 56.96 1llq n ARG 29 Cb 1.02 -2.60 -0.02 0.00 -1.05 0.00 0.00 32.46 29.81 1llq n ARG 29 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1llq s PRO 30 N -2.79 4.36 0.22 2.89 0.04 -1.26 -5.01 135.00 133.44 1llq s PRO 30 Ca 0.69 2.18 0.02 0.00 0.04 0.00 0.00 61.00 63.93 1llq s PRO 30 Cb -0.42 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 30.97 1llq s PRO 30 CO 0.51 -0.23 0.38 -1.21 0.04 0.00 0.00 177.00 176.50 1llq s GLU 31 N -1.14 3.47 0.47 4.56 0.41 -1.26 -5.08 118.70 120.14 1llq s GLU 31 Ca 0.52 -0.51 -0.22 0.00 -0.41 0.00 0.00 54.97 54.35 1llq s GLU 31 Cb -0.39 -2.86 -0.07 0.00 -1.78 0.00 0.00 34.13 29.03 1llq s GLU 31 CO 0.47 0.40 1.15 0.50 -0.49 0.00 0.00 175.26 177.29 1llq s ARG 32 N -3.63 3.73 -0.19 1.61 3.52 -1.26 -5.03 118.95 117.70 1llq s ARG 32 Ca 0.37 1.72 -0.01 0.00 -0.13 0.00 0.00 55.73 57.67 1llq s ARG 32 Cb -0.10 -2.35 0.05 0.00 -1.56 0.00 0.00 34.95 30.99 1llq s ARG 32 CO 0.30 -0.56 -0.02 0.08 -0.81 0.00 0.00 175.30 174.30 1llq s VAL 33 N -1.60 0.95 -0.10 7.11 1.01 -1.26 -5.12 120.40 121.38 1llq s VAL 33 Ca 0.65 -0.71 -0.22 0.00 0.00 0.00 0.00 61.98 61.69 1llq s VAL 33 Cb -0.27 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1llq s VAL 33 CO 0.32 -0.05 0.66 -0.89 0.00 0.00 0.00 175.10 175.15 1llq s THR 34 N 1.68 5.05 0.96 3.92 2.01 -1.26 -4.85 115.64 123.15 1llq s THR 34 Ca -0.01 1.34 -0.13 0.00 0.31 0.00 0.00 61.69 63.19 1llq s THR 34 Cb -0.17 -4.00 0.17 0.00 0.01 0.00 0.00 72.50 68.51 1llq s THR 34 CO -0.07 0.22 1.15 -2.16 -0.69 0.00 0.00 174.62 173.07 1llq s PRO 35 N 1.05 0.77 -0.01 4.92 0.04 -1.26 -5.01 135.00 135.49 1llq s PRO 35 Ca 0.34 0.18 0.12 0.00 0.04 0.00 0.00 61.00 61.68 1llq s PRO 35 Cb -0.17 -1.81 -0.17 0.00 0.04 0.00 0.00 34.50 32.40 1llq s PRO 35 CO 0.15 -2.43 0.32 1.63 0.04 0.00 0.00 177.00 176.71 1llq n LYS 36 N -3.91 1.15 -2.54 4.56 5.02 -1.26 -5.01 118.16 116.18 1llq n LYS 36 Ca 0.08 -0.08 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 1llq n LYS 36 Cb 0.59 -1.21 -0.03 0.00 -0.02 0.00 0.00 35.03 34.36 1llq n LYS 36 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1llq s LYS 37 N -2.61 3.87 0.22 1.97 1.02 -1.26 -5.09 119.74 117.87 1llq s LYS 37 Ca -0.02 0.77 -0.00 0.00 0.02 0.00 0.00 55.97 56.74 1llq s LYS 37 Cb 0.08 -2.22 -0.04 0.00 -0.52 0.00 0.00 37.83 35.12 1llq s LYS 37 CO 0.48 -0.20 0.13 1.03 -0.92 0.00 0.00 175.35 175.87 1llq s ARG 38 N -4.05 1.27 2.12 1.68 0.52 -1.26 -4.64 118.95 114.59 1llq s ARG 38 Ca 0.56 -1.68 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 1llq s ARG 38 Cb -0.10 0.15 0.00 0.00 0.52 0.00 0.00 34.95 35.52 1llq s ARG 38 CO 0.32 -0.38 0.00 0.43 0.02 0.00 0.00 175.30 175.69 1llq n SER 39 N -0.37 0.00 -0.22 0.23 7.64 -0.74 -2.16 113.62 117.99 1llq n SER 39 Ca 0.02 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.07 1llq n SER 39 Cb 0.66 0.00 0.50 0.00 -1.01 0.00 0.00 64.21 64.36 1llq n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1llq h ALA 40 N -0.39 2.15 -0.69 -0.43 0.00 -1.93 0.04 119.26 118.01 1llq h ALA 40 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1llq h ALA 40 Cb 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1llq h ALA 40 CO 0.00 -0.41 0.32 0.93 0.00 0.00 0.00 179.25 180.08 1llq h GLU 41 N 0.43 0.98 -0.12 0.00 5.08 -1.84 -0.72 114.58 118.39 1llq h GLU 41 Ca 0.44 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.55 1llq h GLU 41 Cb 1.05 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1llq h GLU 41 CO -0.16 0.77 -0.35 1.25 -1.00 0.00 0.00 179.01 179.51 1llq h LEU 42 N 0.98 0.52 -2.36 1.33 6.46 -0.71 -2.98 115.31 118.55 1llq h LEU 42 Ca 0.24 -0.59 0.01 0.00 -0.12 0.00 0.00 57.88 57.41 1llq h LEU 42 Cb 0.12 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 39.90 1llq h LEU 42 CO -0.03 1.03 0.04 -0.07 -0.62 0.00 0.00 178.44 178.79 1llq h LEU 43 N 0.05 0.00 -0.84 2.25 3.38 -1.08 -0.57 115.31 118.51 1llq h LEU 43 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1llq h LEU 43 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1llq h LEU 43 CO 0.08 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.90 1llq n LYS 44 N -3.95 1.55 -3.56 1.13 5.02 -0.30 -4.69 118.16 113.36 1llq n LYS 44 Ca -0.02 -0.83 -0.41 0.00 -2.02 0.00 0.00 58.31 55.03 1llq n LYS 44 Cb 0.13 -1.34 -0.09 0.00 -0.02 0.00 0.00 35.03 33.71 1llq n LYS 44 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1llq s GLU 45 N -1.82 2.63 0.39 1.97 0.41 -0.22 -4.97 118.70 117.10 1llq s GLU 45 Ca 0.29 -1.52 0.21 0.00 -0.41 0.00 0.00 54.97 53.54 1llq s GLU 45 Cb 0.15 -3.87 1.20 0.00 -1.78 0.00 0.00 34.13 29.83 1llq s GLU 45 CO 0.23 -1.03 1.69 -1.35 -0.49 0.00 0.00 175.26 174.31 1llq h PRO 46 N 8.47 0.27 0.00 0.39 0.11 -1.79 0.36 132.00 139.82 1llq h PRO 46 Ca -0.23 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1llq h PRO 46 Cb 1.08 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1llq h PRO 46 CO 0.80 0.18 0.00 0.54 -0.21 0.00 0.00 178.00 179.31 1llq n ARG 47 N -4.78 0.21 -0.03 1.05 1.74 -1.26 -0.78 116.66 112.82 1llq n ARG 47 Ca 0.31 0.32 -0.02 0.00 -0.77 0.00 0.00 57.85 57.69 1llq n ARG 47 Cb 1.09 -1.83 -0.05 0.00 -1.02 0.00 0.00 32.46 30.65 1llq n ARG 47 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1llq n LEU 48 N -2.21 0.00 -4.71 0.55 4.77 0.10 -4.90 117.00 110.61 1llq n LEU 48 Ca 0.04 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.60 1llq n LEU 48 Cb 0.31 0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 1llq n LEU 48 CO 0.24 0.14 1.11 0.21 -1.33 0.00 0.00 177.39 177.75 1llq s ASN 49 N -3.64 6.80 0.00 -1.43 2.47 0.27 -4.86 114.94 114.54 1llq s ASN 49 Ca -0.03 2.30 0.11 0.00 0.42 0.00 0.00 52.86 55.65 1llq s ASN 49 Cb 0.02 -2.58 -0.02 0.00 -1.45 0.00 0.00 41.25 37.22 1llq s ASN 49 CO 0.28 -0.70 0.61 0.29 -3.72 0.00 0.00 177.10 173.86 1llq n LYS 50 N 4.44 2.35 0.00 0.43 5.02 -1.26 -4.55 118.16 124.59 1llq n LYS 50 Ca 0.12 -0.50 0.00 0.00 -2.02 0.00 0.00 58.31 55.91 1llq n LYS 50 Cb 0.42 -1.08 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 1llq n LYS 50 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1llq n GLY 51 N 0.99 2.82 0.00 0.72 0.00 -1.26 -1.44 105.19 107.01 1llq n GLY 51 Ca 0.04 -0.34 0.07 0.00 0.00 0.00 0.00 46.02 45.79 1llq n GLY 51 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1llq n MET 52 N 13.69 0.29 0.11 1.61 2.81 -1.26 -2.21 117.12 132.16 1llq n MET 52 Ca 0.00 0.10 0.12 0.00 -1.81 0.00 0.00 57.70 56.11 1llq n MET 52 Cb 0.00 -1.50 0.46 0.00 -0.71 0.00 0.00 33.22 31.47 1llq n MET 52 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1llq n GLY 53 N -0.07 -1.31 3.71 3.03 0.00 -0.52 -1.67 105.19 108.36 1llq n GLY 53 Ca 0.08 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1llq n GLY 53 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1llq s PHE 54 N -3.25 3.24 0.95 1.61 2.99 -0.94 -4.72 117.98 117.87 1llq s PHE 54 Ca 0.06 0.99 -0.12 0.00 0.00 0.00 0.00 56.93 57.85 1llq s PHE 54 Cb 0.10 -3.65 0.16 0.00 0.00 0.00 0.00 43.02 39.63 1llq s PHE 54 CO 0.41 -2.25 1.10 -1.54 -0.00 0.00 0.00 175.22 172.94 1llq s SER 55 N 1.15 3.10 0.25 1.36 1.04 -1.26 -4.81 113.70 114.52 1llq s SER 55 Ca 0.64 1.18 -0.06 0.00 0.48 0.00 0.00 55.95 58.19 1llq s SER 55 Cb -0.36 -1.83 0.25 0.00 0.10 0.00 0.00 66.02 64.18 1llq s SER 55 CO 0.30 -2.83 1.91 0.25 0.98 0.00 0.00 173.24 173.85 1llq h LEU 56 N -1.69 1.15 -0.09 2.42 5.85 -1.96 -1.55 115.31 119.44 1llq h LEU 56 Ca -0.52 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.14 1llq h LEU 56 Cb 1.32 -0.29 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1llq h LEU 56 CO 0.58 0.85 -0.00 1.88 -0.34 0.00 0.00 178.44 181.41 1llq h TYR 57 N 1.35 0.17 -0.60 1.25 0.99 -1.99 -1.80 116.97 116.34 1llq h TYR 57 Ca 0.36 -0.03 0.09 0.00 2.00 0.00 0.00 58.73 61.15 1llq h TYR 57 Cb -0.12 -0.04 -0.07 0.00 1.00 0.00 0.00 36.73 37.49 1llq h TYR 57 CO 0.00 0.43 0.22 0.93 -0.00 0.00 0.00 178.16 179.74 1llq h GLU 58 N -0.14 0.38 -0.84 4.88 5.08 -1.89 0.21 114.58 122.27 1llq h GLU 58 Ca 0.02 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1llq h GLU 58 Cb 0.37 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1llq h GLU 58 CO 0.01 0.25 0.50 0.00 -1.00 0.00 0.00 179.01 178.77 1llq h ARG 59 N 0.39 1.13 -0.10 2.33 3.08 -1.08 0.11 114.38 120.25 1llq h ARG 59 Ca 0.30 -0.10 -0.17 0.00 0.07 0.00 0.00 59.98 60.07 1llq h ARG 59 Cb 0.37 -0.24 0.01 0.00 0.08 0.00 0.00 29.97 30.19 1llq h ARG 59 CO -0.31 0.80 -0.62 1.96 -1.07 0.00 0.00 179.97 180.73 1llq h GLN 60 N 1.15 0.59 0.19 0.04 4.20 -0.40 0.71 115.11 121.60 1llq h GLN 60 Ca 0.30 -0.51 -0.01 0.00 0.06 0.00 0.00 58.65 58.49 1llq h GLN 60 Cb -0.04 0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1llq h GLN 60 CO -0.06 1.13 -0.09 1.88 -0.67 0.00 0.00 178.83 181.02 1llq h TYR 61 N 0.22 -0.24 -0.05 2.96 0.99 -0.36 -3.07 116.97 117.44 1llq h TYR 61 Ca -0.05 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.67 1llq h TYR 61 Cb 1.27 0.08 0.00 0.00 1.00 0.00 0.00 36.73 39.08 1llq h TYR 61 CO 0.11 -0.03 0.00 1.28 -0.00 0.00 0.00 178.16 179.52 1llq n LEU 62 N -5.13 0.32 -1.95 3.88 4.77 0.35 -4.89 117.00 114.34 1llq n LEU 62 Ca -0.09 -0.15 -0.14 0.00 -0.03 0.00 0.00 56.01 55.60 1llq n LEU 62 Cb 0.18 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1llq n LEU 62 CO 0.34 0.07 -0.03 0.61 -1.33 0.00 0.00 177.39 177.05 1llq n GLY 63 N 0.74 -0.10 0.04 -0.72 0.00 -0.97 -1.79 105.19 102.38 1llq n GLY 63 Ca 0.09 -0.22 0.04 0.00 0.00 0.00 0.00 46.02 45.93 1llq n GLY 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llq n LEU 64 N -2.57 0.00 -4.61 0.99 4.77 0.23 -3.43 117.00 112.37 1llq n LEU 64 Ca -0.09 0.00 -0.52 0.00 -0.03 0.00 0.00 56.01 55.37 1llq n LEU 64 Cb 0.58 0.16 -0.06 0.00 -2.33 0.00 0.00 43.42 41.77 1llq n LEU 64 CO 0.29 0.16 0.99 1.57 -1.33 0.00 0.00 177.39 179.06 1llq n HIS 65 N -2.37 1.66 0.00 -1.77 -0.00 -0.10 -0.84 115.22 111.81 1llq n HIS 65 Ca -0.13 0.58 0.00 0.00 0.46 0.00 0.00 57.72 58.63 1llq n HIS 65 Cb 0.72 -2.37 0.00 0.00 -0.12 0.00 0.00 29.99 28.22 1llq n HIS 65 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1llq n GLY 66 N 2.84 2.16 0.06 1.57 0.00 -1.26 -4.85 105.19 105.71 1llq n GLY 66 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 1llq n GLY 66 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1llq h LEU 67 N 0.00 0.00 -9.19 0.99 3.38 -1.36 -3.46 115.31 105.66 1llq h LEU 67 Ca 0.00 -0.22 -0.62 0.00 0.09 0.00 0.00 57.88 57.14 1llq h LEU 67 Cb 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.60 1llq h LEU 67 CO 0.00 0.11 -0.77 -0.76 0.09 0.00 0.00 178.44 177.11 1llq s LEU 68 N -4.31 2.58 0.83 1.67 1.43 -1.26 -5.13 118.68 114.49 1llq s LEU 68 Ca 0.05 -1.00 -0.10 0.00 -1.03 0.00 0.00 54.13 52.05 1llq s LEU 68 Cb 0.13 -1.13 0.09 0.00 0.03 0.00 0.00 46.19 45.31 1llq s LEU 68 CO 0.75 0.05 1.11 -2.84 0.23 0.00 0.00 176.35 175.65 1llq s PRO 69 N -3.39 1.79 0.00 1.29 0.02 -1.26 -4.89 135.00 128.56 1llq s PRO 69 Ca 0.29 1.31 0.00 0.00 0.02 0.00 0.00 61.00 62.62 1llq s PRO 69 Cb -0.05 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.63 1llq s PRO 69 CO 0.14 -2.01 1.28 -0.35 -0.33 0.00 0.00 177.00 175.73 1llq n PRO 70 N -3.79 0.75 -4.40 5.54 -0.04 -1.26 -4.82 135.00 126.98 1llq n PRO 70 Ca 0.10 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.28 1llq n PRO 70 Cb 0.53 -1.12 -0.12 0.00 -0.04 0.00 0.00 33.50 32.74 1llq n PRO 70 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1llq s ALA 71 N 0.43 2.48 -0.11 0.55 0.00 -1.26 -5.13 121.76 118.72 1llq s ALA 71 Ca 0.00 -1.56 0.02 0.00 0.00 0.00 0.00 51.96 50.42 1llq s ALA 71 Cb 0.00 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1llq s ALA 71 CO 0.00 0.48 -0.18 -0.06 0.00 0.00 0.00 175.76 176.00 1llq s PHE 72 N -1.41 2.18 0.27 0.00 0.40 -1.26 -4.86 117.98 113.29 1llq s PHE 72 Ca 0.18 -1.02 0.11 0.00 -0.60 0.00 0.00 56.93 55.60 1llq s PHE 72 Cb -0.09 -1.53 -0.05 0.00 0.51 0.00 0.00 43.02 41.87 1llq s PHE 72 CO 0.08 -0.49 -0.10 -1.64 0.70 0.00 0.00 175.22 173.77 1llq s MET 73 N 0.84 1.98 0.41 0.44 -1.94 -0.67 -5.01 119.30 115.35 1llq s MET 73 Ca -0.09 -1.58 0.01 0.00 -1.71 0.00 0.00 55.69 52.32 1llq s MET 73 Cb -0.15 -1.97 -0.01 0.00 2.01 0.00 0.00 34.83 34.70 1llq s MET 73 CO 0.00 0.35 0.61 0.95 -0.01 0.00 0.00 175.02 176.92 1llq s THR 74 N -2.38 4.35 0.33 2.05 -4.23 -1.26 -4.21 115.64 110.28 1llq s THR 74 Ca 0.30 -0.54 0.05 0.00 -1.18 0.00 0.00 61.69 60.32 1llq s THR 74 Cb -0.06 -3.59 0.14 0.00 1.34 0.00 0.00 72.50 70.33 1llq s THR 74 CO 0.17 -0.38 1.84 -0.61 -0.54 0.00 0.00 174.62 175.10 1llq h GLN 75 N 0.56 0.48 -0.34 3.99 4.15 -1.98 -2.26 115.11 119.71 1llq h GLN 75 Ca -0.47 -0.12 -0.01 0.00 0.77 0.00 0.00 58.65 58.81 1llq h GLN 75 Cb 1.24 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.86 1llq h GLN 75 CO 0.58 0.57 0.16 1.49 -1.93 0.00 0.00 178.83 179.69 1llq h GLU 76 N 0.45 0.50 0.00 1.69 4.81 -1.99 0.12 114.58 120.16 1llq h GLU 76 Ca 0.09 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1llq h GLU 76 Cb 0.42 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 1llq h GLU 76 CO 0.02 0.46 -0.16 0.37 -0.73 0.00 0.00 179.01 178.97 1llq h GLN 77 N 0.41 0.00 0.11 1.92 4.15 -1.86 -0.78 115.11 119.06 1llq h GLN 77 Ca 0.12 0.00 -0.28 0.00 0.77 0.00 0.00 58.65 59.25 1llq h GLN 77 Cb 0.14 0.00 0.02 0.00 0.21 0.00 0.00 27.48 27.85 1llq h GLN 77 CO -0.01 0.16 -1.20 1.96 -1.93 0.00 0.00 178.83 177.80 1llq h GLN 78 N 0.00 0.50 -0.63 1.69 4.20 -0.93 -2.65 115.11 117.29 1llq h GLN 78 Ca -0.00 -0.68 -0.03 0.00 0.06 0.00 0.00 58.65 57.99 1llq h GLN 78 Cb 0.29 0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.28 1llq h GLN 78 CO 0.02 1.30 0.27 0.00 -0.67 0.00 0.00 178.83 179.75 1llq h ALA 79 N 0.43 0.81 -0.22 3.87 0.00 -0.50 -0.73 119.26 122.93 1llq h ALA 79 Ca -0.16 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.63 1llq h ALA 79 Cb 1.88 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 19.38 1llq h ALA 79 CO 0.22 0.41 -0.04 -0.92 0.00 0.00 0.00 179.25 178.92 1llq h TYR 80 N 0.87 -0.09 -0.67 0.00 3.20 -1.15 0.22 116.97 119.35 1llq h TYR 80 Ca 0.21 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 1llq h TYR 80 Cb 0.17 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1llq h TYR 80 CO 0.01 -0.08 0.38 0.00 -1.64 0.00 0.00 178.16 176.83 1llq h ARG 81 N 0.02 0.92 0.02 1.82 3.08 -1.13 -0.83 114.38 118.28 1llq h ARG 81 Ca 0.11 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1llq h ARG 81 Cb 0.15 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1llq h ARG 81 CO -0.21 0.67 -0.01 0.28 -1.07 0.00 0.00 179.97 179.63 1llq h VAL 82 N 0.94 1.28 -0.66 2.04 2.07 0.00 -2.82 116.25 119.10 1llq h VAL 82 Ca 0.24 -0.92 0.02 0.00 0.82 0.00 0.00 66.70 66.86 1llq h VAL 82 Cb 0.00 1.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1llq h VAL 82 CO -0.04 0.24 0.43 0.40 0.02 0.00 0.00 177.57 178.62 1llq h ILE 83 N -0.43 1.14 0.02 4.57 1.08 -0.34 -1.14 117.51 122.41 1llq h ILE 83 Ca -0.00 -0.29 -0.00 0.00 -0.39 0.00 0.00 64.86 64.17 1llq h ILE 83 Cb 0.41 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 34.37 1llq h ILE 83 CO 0.00 0.16 -0.01 0.74 -0.69 0.00 0.00 178.15 178.35 1llq h THR 84 N 0.85 1.03 -0.45 -0.27 2.02 -1.13 -1.61 112.91 113.36 1llq h THR 84 Ca 0.25 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.24 1llq h THR 84 Cb -0.05 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1llq h THR 84 CO -0.06 0.04 0.14 0.50 0.37 0.00 0.00 175.52 176.51 1llq h LYS 85 N -0.09 0.66 -0.03 6.66 3.64 -1.23 -2.46 116.57 123.72 1llq h LYS 85 Ca -0.00 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1llq h LYS 85 Cb 0.08 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1llq h LYS 85 CO 0.00 0.58 0.01 1.25 -2.27 0.00 0.00 179.45 179.02 1llq h LEU 86 N 0.65 0.05 -1.16 5.20 5.85 -0.88 -2.71 115.31 122.31 1llq h LEU 86 Ca 0.15 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1llq h LEU 86 Cb 0.20 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1llq h LEU 86 CO -0.01 0.22 0.00 0.03 -0.34 0.00 0.00 178.44 178.34 1llq h ARG 87 N -0.13 0.00 -0.01 1.25 3.08 -1.14 -2.31 114.38 115.12 1llq h ARG 87 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1llq h ARG 87 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1llq h ARG 87 CO -0.00 0.00 -0.20 0.39 -1.07 0.00 0.00 179.97 179.09 1llq n GLU 88 N -2.67 0.84 -2.22 0.04 1.02 -0.94 -4.90 120.64 111.80 1llq n GLU 88 Ca 0.01 -0.44 -0.38 0.00 -0.02 0.00 0.00 57.16 56.33 1llq n GLU 88 Cb 0.26 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.17 1llq n GLU 88 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1llq s GLN 89 N -2.46 3.94 0.28 3.49 -1.52 -0.87 -4.94 119.66 117.57 1llq s GLN 89 Ca 0.26 1.90 -0.01 0.00 -1.95 0.00 0.00 55.36 55.56 1llq s GLN 89 Cb 0.20 -2.62 0.45 0.00 -0.22 0.00 0.00 33.01 30.81 1llq s GLN 89 CO 0.50 -0.43 1.89 -1.35 -0.25 0.00 0.00 175.29 175.64 1llq h PRO 90 N 2.48 1.10 -3.75 2.91 0.11 -1.90 -3.46 132.00 129.48 1llq h PRO 90 Ca -0.49 -0.07 -0.20 0.00 0.11 0.00 0.00 66.00 65.35 1llq h PRO 90 Cb 1.24 -0.25 -0.05 0.00 0.11 0.00 0.00 31.00 32.05 1llq h PRO 90 CO 0.62 0.73 -0.03 0.54 -0.21 0.00 0.00 178.00 179.65 1llq s ASN 91 N -5.91 0.68 0.17 -2.05 2.20 -1.26 -5.05 114.94 103.71 1llq s ASN 91 Ca -0.12 -1.41 -0.10 0.00 -0.94 0.00 0.00 52.86 50.29 1llq s ASN 91 Cb 0.20 0.74 0.06 0.00 -2.00 0.00 0.00 41.25 40.25 1llq s ASN 91 CO 0.81 -1.46 1.65 0.44 -2.94 0.00 0.00 177.10 175.60 1llq h ASP 92 N 2.05 0.99 -0.80 3.54 3.32 -1.98 -2.29 116.42 121.26 1llq h ASP 92 Ca -0.30 -0.29 0.10 0.00 0.02 0.00 0.00 57.03 56.57 1llq h ASP 92 Cb 1.24 -0.26 -0.08 0.00 0.22 0.00 0.00 39.33 40.45 1llq h ASP 92 CO 0.39 1.03 0.43 -0.07 -1.72 0.00 0.00 179.24 179.31 1llq h LEU 93 N 0.91 0.59 -1.33 1.55 4.07 -1.97 0.77 115.31 119.90 1llq h LEU 93 Ca 0.17 0.06 -0.06 0.00 0.08 0.00 0.00 57.88 58.13 1llq h LEU 93 Cb 0.50 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.18 1llq h LEU 93 CO 0.02 0.32 -0.27 0.00 -1.08 0.00 0.00 178.44 177.43 1llq h ALA 94 N 1.47 1.17 0.02 1.53 0.00 -1.91 -1.43 119.26 120.10 1llq h ALA 94 Ca 0.40 -0.25 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 1llq h ALA 94 Cb 0.42 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1llq h ALA 94 CO -0.27 0.34 -0.92 0.00 0.00 0.00 0.00 179.25 178.40 1llq h ARG 95 N 0.00 0.13 0.07 0.00 3.08 0.37 -2.72 114.38 115.30 1llq h ARG 95 Ca -0.00 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 59.89 1llq h ARG 95 Cb 0.65 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1llq h ARG 95 CO 0.04 0.96 -0.03 -0.92 -1.07 0.00 0.00 179.97 178.94 1llq h TYR 96 N 0.06 -0.08 -0.90 3.04 3.20 0.13 -2.19 116.97 120.22 1llq h TYR 96 Ca -0.04 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.86 1llq h TYR 96 Cb 1.58 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 39.83 1llq h TYR 96 CO 0.02 0.13 0.59 0.82 -1.64 0.00 0.00 178.16 178.09 1llq h ILE 97 N -0.29 1.17 -0.18 1.81 1.08 -1.35 -0.96 117.51 118.79 1llq h ILE 97 Ca -0.01 -0.39 -0.13 0.00 -0.39 0.00 0.00 64.86 63.94 1llq h ILE 97 Cb 0.25 -0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 33.91 1llq h ILE 97 CO 0.02 0.21 -0.42 -0.61 -0.69 0.00 0.00 178.15 176.65 1llq h GLN 98 N 1.15 0.43 -0.16 2.37 4.15 -1.38 -2.23 115.11 119.45 1llq h GLN 98 Ca 0.35 -0.22 -0.18 0.00 0.77 0.00 0.00 58.65 59.37 1llq h GLN 98 Cb -0.02 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.67 1llq h GLN 98 CO -0.10 0.78 -0.65 -0.07 -1.93 0.00 0.00 178.83 176.86 1llq h LEU 99 N 0.36 0.68 -0.79 -2.39 4.07 -0.85 -2.00 115.31 114.39 1llq h LEU 99 Ca 0.03 -0.40 -0.09 0.00 0.08 0.00 0.00 57.88 57.50 1llq h LEU 99 Cb 0.89 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.41 1llq h LEU 99 CO 0.07 1.15 -0.04 -0.78 -1.08 0.00 0.00 178.44 177.76 1llq h ASP 100 N 0.43 0.85 -0.14 -0.43 3.58 -1.10 -0.35 116.42 119.26 1llq h ASP 100 Ca -0.02 -0.24 -0.13 0.00 0.42 0.00 0.00 57.03 57.07 1llq h ASP 100 Cb 1.23 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 42.04 1llq h ASP 100 CO 0.12 0.94 -0.35 1.23 -2.88 0.00 0.00 179.24 178.30 1llq h GLY 101 N 0.98 0.70 1.02 -0.78 0.00 -1.33 -2.75 103.07 100.92 1llq h GLY 101 Ca 0.14 -0.67 -0.09 0.00 0.00 0.00 0.00 47.33 46.72 1llq h GLY 101 CO 0.03 0.60 -0.04 -2.00 0.00 0.00 0.00 176.54 175.13 1llq h LEU 102 N 0.54 0.89 -1.47 3.11 5.85 -0.85 -1.73 115.31 121.66 1llq h LEU 102 Ca 0.06 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.46 1llq h LEU 102 Cb 0.86 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 1llq h LEU 102 CO 0.07 1.00 0.38 -0.61 -0.34 0.00 0.00 178.44 178.94 1llq h GLN 103 N 0.75 0.70 -0.01 1.25 4.15 -0.97 -0.57 115.11 120.41 1llq h GLN 103 Ca 0.13 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1llq h GLN 103 Cb 0.58 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.11 1llq h GLN 103 CO 0.03 0.46 -0.04 -0.25 -1.93 0.00 0.00 178.83 177.10 1llq n ASP 104 N -4.46 0.59 -0.06 -0.69 8.00 -0.95 -4.08 116.55 114.89 1llq n ASP 104 Ca 0.06 -0.97 -0.12 0.00 0.71 0.00 0.00 54.79 54.48 1llq n ASP 104 Cb 0.09 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.11 1llq n ASP 104 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1llq n ARG 105 N -0.66 0.29 -3.34 -1.24 0.63 -0.36 -4.50 116.66 107.49 1llq n ARG 105 Ca 0.19 0.10 -0.14 0.00 -0.92 0.00 0.00 57.85 57.08 1llq n ARG 105 Cb 0.24 -1.09 -0.07 0.00 0.45 0.00 0.00 32.46 31.99 1llq n ARG 105 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1llq s ASN 106 N -5.76 0.79 0.21 6.15 3.84 -0.40 -4.36 114.94 115.43 1llq s ASN 106 Ca -0.18 -1.27 -0.09 0.00 0.21 0.00 0.00 52.86 51.54 1llq s ASN 106 Cb 0.06 0.79 0.27 0.00 -0.55 0.00 0.00 41.25 41.82 1llq s ASN 106 CO 0.26 -0.27 1.80 -0.08 -2.79 0.00 0.00 177.10 176.02 1llq h GLU 107 N 7.29 0.65 -0.65 0.43 4.81 -1.10 -1.02 114.58 124.99 1llq h GLU 107 Ca 0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1llq h GLU 107 Cb 1.08 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.28 1llq h GLU 107 CO 0.21 0.43 0.37 0.87 -0.73 0.00 0.00 179.01 180.15 1llq h LYS 108 N 0.67 0.89 -0.59 1.92 1.79 -1.86 -2.26 116.57 117.13 1llq h LYS 108 Ca 0.31 -0.10 -0.10 0.00 -2.18 0.00 0.00 60.65 58.59 1llq h LYS 108 Cb 0.24 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.69 1llq h LYS 108 CO -0.21 0.66 -0.03 1.25 -1.08 0.00 0.00 179.45 180.04 1llq h LEU 109 N 0.88 1.04 -0.28 2.94 5.85 -1.72 -1.26 115.31 122.75 1llq h LEU 109 Ca 0.23 -0.31 0.05 0.00 0.84 0.00 0.00 57.88 58.69 1llq h LEU 109 Cb 0.02 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.72 1llq h LEU 109 CO -0.04 1.10 -0.01 0.15 -0.34 0.00 0.00 178.44 179.30 1llq h PHE 110 N 0.95 -0.04 0.00 1.25 3.57 -0.85 -0.62 116.94 121.21 1llq h PHE 110 Ca 0.16 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.57 1llq h PHE 110 Cb 0.59 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 1llq h PHE 110 CO 0.04 -0.06 -0.55 1.88 -2.23 0.00 0.00 178.31 177.39 1llq h TYR 111 N 0.07 0.00 -0.62 0.41 -1.99 -1.29 -1.41 116.97 112.15 1llq h TYR 111 Ca 0.14 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.82 1llq h TYR 111 Cb 0.18 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.89 1llq h TYR 111 CO -0.22 0.55 0.22 -0.09 -0.00 0.00 0.00 178.16 178.62 1llq h ARG 112 N 0.00 0.94 0.06 4.88 9.65 -0.59 0.03 114.38 129.34 1llq h ARG 112 Ca -0.01 -0.19 -0.00 0.00 -1.10 0.00 0.00 59.98 58.68 1llq h ARG 112 Cb 1.14 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.58 1llq h ARG 112 CO 0.07 0.82 -0.03 0.28 2.80 0.00 0.00 179.97 183.91 1llq h VAL 113 N 0.87 1.26 -0.59 0.20 2.07 -1.02 -2.34 116.25 116.71 1llq h VAL 113 Ca 0.20 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 1llq h VAL 113 Cb 0.25 2.03 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 1llq h VAL 113 CO -0.01 0.29 0.33 0.58 0.02 0.00 0.00 177.57 178.78 1llq h VAL 114 N -0.62 1.19 -0.04 2.57 2.07 -1.23 -2.51 116.25 117.68 1llq h VAL 114 Ca -0.01 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 1llq h VAL 114 Cb 0.54 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1llq h VAL 114 CO 0.01 0.20 -0.26 0.00 0.02 0.00 0.00 177.57 177.54 1llq h ASP 116 N 0.06 0.15 -1.78 0.00 3.32 -1.13 -3.34 116.42 113.69 1llq h ASP 116 Ca 0.01 -0.13 -0.57 0.00 0.02 0.00 0.00 57.03 56.36 1llq h ASP 116 Cb 0.50 -0.05 -0.42 0.00 0.22 0.00 0.00 39.33 39.59 1llq h ASP 116 CO 0.04 0.98 -0.75 1.41 -1.72 0.00 0.00 179.24 179.20 1llq n HIS 117 N -3.56 3.34 0.09 4.55 8.25 -0.97 -4.94 115.22 121.99 1llq n HIS 117 Ca -0.02 -3.44 -0.12 0.00 -0.26 0.00 0.00 57.72 53.87 1llq n HIS 117 Cb 0.85 -0.26 -0.06 0.00 1.12 0.00 0.00 29.99 31.64 1llq n HIS 117 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1llq h VAL 118 N 2.68 0.65 -0.32 1.59 3.04 -1.54 -0.23 116.25 122.11 1llq h VAL 118 Ca 0.20 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.91 1llq h VAL 118 Cb 0.79 0.65 -0.02 0.00 -2.01 0.00 0.00 31.29 30.71 1llq h VAL 118 CO 0.80 0.00 0.22 0.50 -1.01 0.00 0.00 177.57 178.08 1llq h LYS 119 N -0.30 0.36 0.22 4.17 3.64 -1.92 0.27 116.57 123.01 1llq h LYS 119 Ca 0.02 -0.02 -0.33 0.00 -1.27 0.00 0.00 60.65 59.06 1llq h LYS 119 Cb 0.31 -0.08 0.03 0.00 -0.41 0.00 0.00 32.23 32.08 1llq h LYS 119 CO -0.08 0.24 -1.47 1.49 -2.27 0.00 0.00 179.45 177.36 1llq h GLU 120 N 0.37 0.46 0.00 1.90 4.81 -1.89 -3.40 114.58 116.83 1llq h GLU 120 Ca 0.13 -0.78 -0.08 0.00 -0.13 0.00 0.00 59.36 58.50 1llq h GLU 120 Cb 0.06 0.29 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1llq h GLU 120 CO -0.03 1.37 -1.98 1.28 -0.73 0.00 0.00 179.01 178.92 1llq n LEU 121 N -3.65 0.09 -0.25 1.64 4.77 -0.12 -4.45 117.00 115.03 1llq n LEU 121 Ca -0.16 0.04 0.04 0.00 -0.03 0.00 0.00 56.01 55.90 1llq n LEU 121 Cb 1.08 0.09 0.18 0.00 -2.33 0.00 0.00 43.42 42.44 1llq n LEU 121 CO 0.58 0.09 1.02 -0.03 -1.33 0.00 0.00 177.39 177.71 1llq h MET 122 N 0.00 0.44 0.00 3.23 4.05 -0.67 0.34 114.93 122.32 1llq h MET 122 Ca -0.11 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.28 1llq h MET 122 Cb 1.26 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.96 1llq h MET 122 CO 0.01 0.29 0.00 -0.35 0.23 0.00 0.00 176.91 177.09 1llq n PRO 123 N -4.99 0.18 -0.11 0.39 -0.04 -1.26 -1.34 135.00 127.83 1llq n PRO 123 Ca 0.14 0.12 -0.22 0.00 -0.04 0.00 0.00 63.50 63.50 1llq n PRO 123 Cb 0.39 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.24 1llq n PRO 123 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1llq n ILE 124 N -1.37 1.53 -0.27 0.52 2.08 0.96 -2.18 119.36 120.63 1llq n ILE 124 Ca 0.08 -0.05 -0.05 0.00 0.56 0.00 0.00 62.75 63.29 1llq n ILE 124 Cb 0.19 -2.04 0.10 0.00 -0.75 0.00 0.00 39.64 37.13 1llq n ILE 124 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1llq h VAL 125 N -1.00 1.25 0.00 1.39 2.07 -0.76 -3.35 116.25 115.86 1llq h VAL 125 Ca -0.37 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1llq h VAL 125 Cb 1.30 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1llq h VAL 125 CO -0.22 0.32 0.00 0.00 0.02 0.00 0.00 177.57 177.69 1llq n TYR 126 N -4.29 0.00 0.00 1.57 9.36 -0.45 -4.60 117.16 118.76 1llq n TYR 126 Ca 0.07 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.29 1llq n TYR 126 Cb 0.17 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.88 1llq n TYR 126 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1llq n THR 127 N 0.00 0.00 -0.07 2.97 -1.04 -1.24 -2.01 114.28 112.88 1llq n THR 127 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.93 1llq n THR 127 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 1llq n THR 127 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1llq n PRO 128 N 0.00 1.38 -0.11 -2.82 -0.04 -1.23 -4.66 135.00 127.52 1llq n PRO 128 Ca 0.00 0.02 -0.03 0.00 -0.04 0.00 0.00 63.50 63.46 1llq n PRO 128 Cb 0.00 -1.36 0.21 0.00 -0.04 0.00 0.00 33.50 32.30 1llq n PRO 128 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1llq h THR 129 N 0.00 1.22 -0.83 0.52 2.02 -1.14 -3.17 112.91 111.53 1llq h THR 129 Ca -0.39 -0.82 0.07 0.00 0.77 0.00 0.00 66.41 66.05 1llq h THR 129 Cb 1.81 0.72 -0.06 0.00 -1.74 0.00 0.00 68.15 68.87 1llq h THR 129 CO -0.00 0.30 0.50 1.62 0.37 0.00 0.00 175.52 178.31 1llq h VAL 130 N 0.75 0.99 -0.30 3.16 3.04 -1.54 -0.09 116.25 122.26 1llq h VAL 130 Ca 0.16 -0.30 -0.10 0.00 -1.01 0.00 0.00 66.70 65.45 1llq h VAL 130 Cb 0.31 0.03 -0.01 0.00 -2.01 0.00 0.00 31.29 29.60 1llq h VAL 130 CO 0.00 0.16 -0.22 1.23 -1.01 0.00 0.00 177.57 177.74 1llq h GLY 131 N 0.89 0.61 1.14 3.17 0.00 -1.80 -2.17 103.07 104.91 1llq h GLY 131 Ca 0.37 -0.49 -0.14 0.00 0.00 0.00 0.00 47.33 47.08 1llq h GLY 131 CO -0.20 0.45 -0.25 -2.00 0.00 0.00 0.00 176.54 174.54 1llq h LEU 132 N 0.50 1.00 -0.87 3.11 5.85 -1.30 -2.50 115.31 121.10 1llq h LEU 132 Ca 0.08 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 1llq h LEU 132 Cb 0.65 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 1llq h LEU 132 CO 0.05 1.19 0.52 0.00 -0.34 0.00 0.00 178.44 179.86 1llq h ALA 133 N 0.88 1.12 -0.68 1.25 0.00 -0.77 0.18 119.26 121.23 1llq h ALA 133 Ca 0.10 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1llq h ALA 133 Cb 0.83 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1llq h ALA 133 CO 0.07 0.58 0.21 0.00 0.00 0.00 0.00 179.25 180.11 1llq h GLN 135 N 1.01 0.60 0.17 0.00 4.15 -1.09 -3.18 115.11 116.76 1llq h GLN 135 Ca 0.22 -0.42 -0.24 0.00 0.77 0.00 0.00 58.65 58.98 1llq h GLN 135 Cb 0.31 0.07 0.02 0.00 0.21 0.00 0.00 27.48 28.09 1llq h GLN 135 CO -0.01 1.04 -1.10 -0.91 -1.93 0.00 0.00 178.83 175.93 1llq h ASN 136 N 0.25 0.55 1.20 -0.69 -0.26 -0.95 -3.37 115.58 112.31 1llq h ASN 136 Ca -0.01 -0.93 -0.16 0.00 -0.56 0.00 0.00 56.30 54.64 1llq h ASN 136 Cb 1.07 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 38.12 1llq h ASN 136 CO 0.10 1.52 -0.77 -0.26 -1.06 0.00 0.00 177.43 176.95 1llq h PHE 137 N -0.22 0.00 0.00 1.19 0.05 -1.52 -3.49 116.94 112.95 1llq h PHE 137 Ca -0.20 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.59 1llq h PHE 137 Cb 1.80 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.75 1llq h PHE 137 CO 0.17 0.77 0.00 0.41 -0.18 0.00 0.00 178.31 179.48 1llq n GLY 138 N 1.26 1.10 3.69 -1.45 0.00 -1.20 -4.67 105.19 103.91 1llq n GLY 138 Ca 0.01 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 1llq n GLY 138 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1llq s TYR 139 N 0.00 3.25 -0.13 1.61 5.04 -1.26 -4.89 117.35 120.98 1llq s TYR 139 Ca 0.00 1.30 -0.04 0.00 -2.44 0.00 0.00 57.07 55.89 1llq s TYR 139 Cb 0.00 -3.37 -0.03 0.00 0.35 0.00 0.00 41.96 38.91 1llq s TYR 139 CO 0.00 -1.07 0.02 0.42 -1.34 0.00 0.00 175.55 173.58 1llq s ILE 140 N 2.22 4.40 -0.09 3.14 1.01 -1.26 -5.07 121.20 125.55 1llq s ILE 140 Ca 0.54 -0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.70 1llq s ILE 140 Cb -0.23 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 1llq s ILE 140 CO 0.21 0.54 1.38 -0.31 0.00 0.00 0.00 174.94 176.76 1llq s TYR 141 N -0.24 2.67 0.18 3.97 4.12 -1.26 -4.98 117.35 121.81 1llq s TYR 141 Ca 0.06 0.79 -0.24 0.00 0.02 0.00 0.00 57.07 57.70 1llq s TYR 141 Cb -0.12 -3.63 0.05 0.00 -1.52 0.00 0.00 41.96 36.74 1llq s TYR 141 CO 0.02 -2.35 0.88 -0.98 0.02 0.00 0.00 175.55 173.14 1llq s ARG 142 N 3.26 1.33 0.75 -0.62 1.70 -1.26 -5.01 118.95 119.10 1llq s ARG 142 Ca 0.61 -0.72 -0.12 0.00 -0.47 0.00 0.00 55.73 55.04 1llq s ARG 142 Cb -0.27 0.47 0.05 0.00 -0.57 0.00 0.00 34.95 34.62 1llq s ARG 142 CO 0.22 -0.61 1.10 0.15 -1.08 0.00 0.00 175.30 175.08 1llq s LYS 143 N -3.46 2.34 -0.54 3.89 1.02 -1.26 -4.87 119.74 116.86 1llq s LYS 143 Ca 0.11 1.24 -0.27 0.00 0.02 0.00 0.00 55.97 57.07 1llq s LYS 143 Cb -0.03 -1.90 -0.04 0.00 -0.52 0.00 0.00 37.83 35.35 1llq s LYS 143 CO 0.02 -1.59 2.04 -2.14 -0.92 0.00 0.00 175.35 172.76 1llq s PRO 144 N -4.70 2.54 -0.08 -1.68 0.02 -1.26 -4.75 135.00 125.09 1llq s PRO 144 Ca 0.63 0.97 0.12 0.00 0.02 0.00 0.00 61.00 62.74 1llq s PRO 144 Cb -0.18 -4.43 0.22 0.00 0.02 0.00 0.00 34.50 30.13 1llq s PRO 144 CO 0.53 -2.81 1.14 0.36 -0.33 0.00 0.00 177.00 175.88 1llq n LYS 145 N 9.05 2.12 -3.83 5.54 2.85 -1.26 -5.04 118.16 127.59 1llq n LYS 145 Ca 0.26 -2.22 -0.08 0.00 -1.05 0.00 0.00 58.31 55.22 1llq n LYS 145 Cb 0.52 -1.36 0.01 0.00 -0.65 0.00 0.00 35.03 33.55 1llq n LYS 145 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 1llq s GLY 146 N -2.04 0.18 -0.04 2.58 0.00 -1.26 -4.45 107.32 102.29 1llq s GLY 146 Ca 0.22 -0.56 0.04 0.00 0.00 0.00 0.00 44.72 44.42 1llq s GLY 146 CO 0.03 -0.16 -0.16 1.08 0.00 0.00 0.00 173.10 173.90 1llq s LEU 147 N -3.02 1.90 -0.22 0.66 1.43 -0.55 -5.01 118.68 113.87 1llq s LEU 147 Ca 0.14 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.83 1llq s LEU 147 Cb -0.05 -0.89 -0.05 0.00 0.03 0.00 0.00 46.19 45.23 1llq s LEU 147 CO 0.09 0.14 0.12 -0.31 0.23 0.00 0.00 176.35 176.63 1llq s TYR 148 N 0.04 3.27 -0.13 0.29 1.51 -1.26 -1.29 117.35 119.78 1llq s TYR 148 Ca -0.03 0.11 0.01 0.00 -1.01 0.00 0.00 57.07 56.15 1llq s TYR 148 Cb -0.11 -2.21 0.02 0.00 -0.11 0.00 0.00 41.96 39.55 1llq s TYR 148 CO 0.02 0.05 -0.14 0.42 -1.11 0.00 0.00 175.55 174.78 1llq s ILE 149 N 0.91 1.49 0.48 2.71 1.01 -0.81 -4.99 121.20 122.00 1llq s ILE 149 Ca 0.06 -0.61 0.07 0.00 0.00 0.00 0.00 60.65 60.17 1llq s ILE 149 Cb -0.13 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 40.95 1llq s ILE 149 CO 0.03 0.44 0.38 0.42 0.00 0.00 0.00 174.94 176.21 1llq s THR 150 N 1.25 2.17 -0.34 2.92 -4.23 -1.26 -1.19 115.64 114.96 1llq s THR 150 Ca -0.01 -1.44 0.23 0.00 -1.18 0.00 0.00 61.69 59.29 1llq s THR 150 Cb -0.14 -2.61 0.24 0.00 1.34 0.00 0.00 72.50 71.33 1llq s THR 150 CO -0.06 0.00 1.71 0.00 -0.54 0.00 0.00 174.62 175.73 1llq n ILE 151 N -1.62 0.90 1.27 2.99 0.13 -0.72 -1.13 119.36 121.17 1llq n ILE 151 Ca 0.01 0.44 0.13 0.00 -1.10 0.00 0.00 62.75 62.23 1llq n ILE 151 Cb 0.63 -1.41 0.36 0.00 -0.84 0.00 0.00 39.64 38.38 1llq n ILE 151 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 1llq n ASN 152 N -2.28 1.33 -1.64 9.51 3.02 -1.26 -3.72 115.26 120.22 1llq n ASN 152 Ca 0.01 -1.15 -0.16 0.00 -0.03 0.00 0.00 54.58 53.24 1llq n ASN 152 Cb 0.15 0.14 0.10 0.00 -0.61 0.00 0.00 39.78 39.55 1llq n ASN 152 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1llq n ASP 153 N -0.30 4.20 -3.85 6.41 8.00 -0.29 -4.97 116.55 125.76 1llq n ASP 153 Ca 0.14 -3.79 -0.42 0.00 0.71 0.00 0.00 54.79 51.43 1llq n ASP 153 Cb 0.37 -0.51 -0.02 0.00 -0.02 0.00 0.00 41.12 40.94 1llq n ASP 153 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1llq n ASN 154 N -0.89 3.50 -3.55 -2.24 2.85 -1.24 -4.03 115.26 109.65 1llq n ASN 154 Ca 0.40 -2.79 -0.13 0.00 -0.11 0.00 0.00 54.58 51.95 1llq n ASN 154 Cb 0.90 -1.50 -0.05 0.00 1.24 0.00 0.00 39.78 40.37 1llq n ASN 154 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1llq s SER 155 N 4.13 -0.47 0.25 1.20 1.04 -1.26 -4.97 113.70 113.62 1llq s SER 155 Ca 0.53 0.49 -0.03 0.00 0.48 0.00 0.00 55.95 57.42 1llq s SER 155 Cb 0.12 0.39 0.48 0.00 0.10 0.00 0.00 66.02 67.11 1llq s SER 155 CO 0.01 -0.46 1.77 0.58 0.98 0.00 0.00 173.24 176.12 1llq h VAL 156 N 2.68 0.76 -0.27 5.02 2.07 -1.88 -2.16 116.25 122.47 1llq h VAL 156 Ca -0.22 -0.21 -0.11 0.00 0.82 0.00 0.00 66.70 66.98 1llq h VAL 156 Cb 1.16 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1llq h VAL 156 CO 0.34 0.11 -0.27 0.28 0.02 0.00 0.00 177.57 178.05 1llq h SER 157 N 0.61 0.71 -0.62 0.57 0.02 -1.94 -0.91 113.55 111.99 1llq h SER 157 Ca 0.43 -0.47 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 1llq h SER 157 Cb 0.58 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 1llq h SER 157 CO -0.34 1.04 0.32 0.11 -1.14 0.00 0.00 176.83 176.82 1llq h LYS 158 N 0.39 0.90 -0.06 3.45 1.57 -1.75 -0.38 116.57 120.69 1llq h LYS 158 Ca 0.04 -0.11 -0.24 0.00 -1.87 0.00 0.00 60.65 58.47 1llq h LYS 158 Cb 0.84 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.99 1llq h LYS 158 CO 0.07 0.68 -0.91 0.82 -0.57 0.00 0.00 179.45 179.54 1llq h ILE 159 N 0.90 1.30 -0.66 1.86 2.04 -1.37 -2.73 117.51 118.85 1llq h ILE 159 Ca 0.23 -2.16 0.07 0.00 1.00 0.00 0.00 64.86 63.99 1llq h ILE 159 Cb 0.07 2.21 -0.06 0.00 -0.74 0.00 0.00 36.82 38.30 1llq h ILE 159 CO -0.03 0.67 0.35 0.22 0.00 0.00 0.00 178.15 179.36 1llq h TYR 160 N 0.43 0.64 -0.23 1.37 3.20 -0.64 0.12 116.97 121.85 1llq h TYR 160 Ca -0.09 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.75 1llq h TYR 160 Cb 1.55 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 1llq h TYR 160 CO 0.09 0.29 -0.11 1.96 -1.64 0.00 0.00 178.16 178.74 1llq h GLN 161 N 0.64 0.38 -0.22 1.82 1.08 -1.05 0.50 115.11 118.26 1llq h GLN 161 Ca 0.30 -0.09 -0.15 0.00 -1.45 0.00 0.00 58.65 57.26 1llq h GLN 161 Cb 0.22 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 1llq h GLN 161 CO -0.20 0.50 -0.45 0.82 -0.95 0.00 0.00 178.83 178.55 1llq h ILE 162 N 0.35 1.31 -0.25 2.54 2.04 -0.69 -2.84 117.51 119.98 1llq h ILE 162 Ca 0.07 -1.67 -0.05 0.00 1.00 0.00 0.00 64.86 64.21 1llq h ILE 162 Cb 0.42 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.29 1llq h ILE 162 CO 0.02 0.52 -0.08 -0.07 0.00 0.00 0.00 178.15 178.55 1llq h LEU 163 N 0.41 0.37 -1.06 1.44 3.38 -0.60 -1.30 115.31 117.95 1llq h LEU 163 Ca 0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1llq h LEU 163 Cb 1.05 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1llq h LEU 163 CO 0.10 0.50 0.00 0.28 0.09 0.00 0.00 178.44 179.41 1llq h SER 164 N 0.37 0.00 0.35 -0.43 0.02 -0.70 -1.74 113.55 111.42 1llq h SER 164 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1llq h SER 164 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1llq h SER 164 CO 0.02 0.00 -0.12 0.59 -1.14 0.00 0.00 176.83 176.18 1llq n ASN 165 N -2.42 0.52 -4.79 3.07 3.02 -0.49 -4.86 115.26 109.32 1llq n ASN 165 Ca 0.01 -0.60 -0.36 0.00 -0.03 0.00 0.00 54.58 53.60 1llq n ASN 165 Cb 0.20 -0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.27 1llq n ASN 165 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1llq s TRP 166 N -2.47 3.24 -1.41 3.10 -0.00 -0.66 -4.97 118.94 115.77 1llq s TRP 166 Ca 0.28 1.64 0.27 0.00 -0.00 0.00 0.00 56.10 58.29 1llq s TRP 166 Cb 0.20 -3.11 1.35 0.00 -0.00 0.00 0.00 33.47 31.91 1llq s TRP 166 CO 0.48 -0.62 1.91 -2.39 -0.00 0.00 0.00 176.95 176.33 1llq n HIS 167 N -0.19 0.00 -5.05 5.86 -0.00 -1.26 -4.78 115.22 109.79 1llq n HIS 167 Ca 0.06 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.50 1llq n HIS 167 Cb 0.50 -0.29 -0.16 0.00 -0.00 0.00 0.00 29.99 30.04 1llq n HIS 167 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1llq s GLU 168 N -2.59 1.73 -0.11 -1.40 0.41 -1.26 -5.03 118.70 110.46 1llq s GLU 168 Ca 0.25 -0.76 0.11 0.00 -0.41 0.00 0.00 54.97 54.16 1llq s GLU 168 Cb 0.18 -1.67 -0.24 0.00 -1.78 0.00 0.00 34.13 30.62 1llq s GLU 168 CO 0.41 0.46 0.42 -1.91 -0.49 0.00 0.00 175.26 174.15 1llq n GLU 169 N 2.56 0.66 -1.66 1.61 4.07 -1.26 -4.52 120.64 122.10 1llq n GLU 169 Ca -0.15 0.20 -0.34 0.00 -0.06 0.00 0.00 57.16 56.81 1llq n GLU 169 Cb 0.53 -1.70 -0.04 0.00 -0.06 0.00 0.00 31.44 30.17 1llq n GLU 169 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1llq n ASP 170 N -3.03 7.54 -4.72 4.31 2.03 -1.26 -4.93 116.55 116.49 1llq n ASP 170 Ca -0.25 -3.00 -0.41 0.00 0.52 0.00 0.00 54.79 51.65 1llq n ASP 170 Cb 1.08 -1.37 -0.04 0.00 -0.72 0.00 0.00 41.12 40.07 1llq n ASP 170 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1llq s VAL 171 N -0.65 4.25 0.00 5.18 1.01 -1.26 -4.21 120.40 124.72 1llq s VAL 171 Ca 0.59 1.78 0.00 0.00 0.00 0.00 0.00 61.98 64.35 1llq s VAL 171 Cb 0.24 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1llq s VAL 171 CO -0.11 0.23 0.00 0.54 0.00 0.00 0.00 175.10 175.76 1llq n ARG 172 N 3.10 3.11 -3.75 2.72 1.74 0.26 -4.90 116.66 118.94 1llq n ARG 172 Ca 0.05 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.96 1llq n ARG 172 Cb 0.48 -0.35 -0.17 0.00 -1.02 0.00 0.00 32.46 31.41 1llq n ARG 172 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1llq s ALA 173 N -0.54 0.16 -0.07 7.54 0.00 -0.35 -1.46 121.76 127.05 1llq s ALA 173 Ca 0.00 0.25 0.04 0.00 0.00 0.00 0.00 51.96 52.24 1llq s ALA 173 Cb 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1llq s ALA 173 CO 0.00 -0.24 -0.18 0.42 0.00 0.00 0.00 175.76 175.76 1llq s ILE 174 N 1.46 1.57 -0.21 0.00 1.01 0.30 -0.80 121.20 124.54 1llq s ILE 174 Ca -0.04 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 1llq s ILE 174 Cb -0.13 -1.37 0.00 0.00 0.01 0.00 0.00 42.46 40.98 1llq s ILE 174 CO -0.03 0.45 -0.10 -0.69 0.00 0.00 0.00 174.94 174.57 1llq s VAL 175 N 0.37 2.87 0.10 2.92 1.01 -1.09 -0.23 120.40 126.34 1llq s VAL 175 Ca -0.13 -0.67 0.10 0.00 0.00 0.00 0.00 61.98 61.28 1llq s VAL 175 Cb -0.15 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1llq s VAL 175 CO 0.05 0.46 -0.25 0.54 0.00 0.00 0.00 175.10 175.90 1llq s VAL 176 N 1.40 2.31 0.04 2.92 0.11 -0.23 -1.62 120.40 125.34 1llq s VAL 176 Ca 0.05 -1.58 -0.10 0.00 -2.93 0.00 0.00 61.98 57.43 1llq s VAL 176 Cb -0.14 -1.99 0.00 0.00 -1.53 0.00 0.00 36.38 32.73 1llq s VAL 176 CO -0.07 0.20 0.20 0.28 -3.33 0.00 0.00 175.10 172.38 1llq s THR 177 N -0.98 0.11 -1.56 5.04 -1.32 -0.97 -0.57 115.64 115.39 1llq s THR 177 Ca 0.14 -0.87 0.13 0.00 -1.21 0.00 0.00 61.69 59.88 1llq s THR 177 Cb -0.10 -0.90 0.14 0.00 -1.51 0.00 0.00 72.50 70.13 1llq s THR 177 CO 0.05 -0.48 0.97 -0.90 -2.21 0.00 0.00 174.62 172.05 1llq n ASP 178 N 0.71 2.24 -0.19 8.08 5.68 -1.26 -0.28 116.55 131.53 1llq n ASP 178 Ca -0.19 -1.61 -0.02 0.00 -0.50 0.00 0.00 54.79 52.46 1llq n ASP 178 Cb 0.59 -0.04 -0.01 0.00 -1.14 0.00 0.00 41.12 40.52 1llq n ASP 178 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1llq n GLY 179 N 0.73 0.40 0.22 6.12 0.00 -1.26 -4.71 105.19 106.70 1llq n GLY 179 Ca 0.09 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1llq n GLY 179 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1llq h GLU 180 N 0.29 0.58 -2.14 1.61 4.81 -1.81 -2.46 114.58 115.46 1llq h GLU 180 Ca -0.05 -0.34 -0.57 0.00 -0.13 0.00 0.00 59.36 58.27 1llq h GLU 180 Cb 0.69 0.03 -0.41 0.00 0.63 0.00 0.00 28.75 29.69 1llq h GLU 180 CO 0.07 0.94 -0.81 -2.13 -0.73 0.00 0.00 179.01 176.35 1llq n ARG 181 N -3.98 2.02 -2.11 1.92 0.63 -0.84 -1.40 116.66 112.89 1llq n ARG 181 Ca -0.03 -4.18 -0.42 0.00 -0.92 0.00 0.00 57.85 52.30 1llq n ARG 181 Cb 0.58 -1.92 -0.03 0.00 0.45 0.00 0.00 32.46 31.54 1llq n ARG 181 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1llq s ILE 182 N -2.56 3.31 -0.44 5.15 1.01 0.14 -4.47 121.20 123.35 1llq s ILE 182 Ca 0.41 0.84 -0.42 0.00 0.00 0.00 0.00 60.65 61.48 1llq s ILE 182 Cb 0.21 -3.54 -0.17 0.00 0.01 0.00 0.00 42.46 38.97 1llq s ILE 182 CO -0.07 0.03 2.03 -0.11 0.00 0.00 0.00 174.94 176.82 1llq n LEU 183 N 4.77 1.34 0.00 2.97 7.94 -1.26 -0.88 117.00 131.88 1llq n LEU 183 Ca 0.13 0.73 0.00 0.00 -1.11 0.00 0.00 56.01 55.76 1llq n LEU 183 Cb 0.42 -1.01 0.00 0.00 0.53 0.00 0.00 43.42 43.36 1llq n LEU 183 CO 0.60 -0.73 0.00 0.61 -1.11 0.00 0.00 177.39 176.76 1llq n GLY 184 N 6.40 1.24 0.00 -3.96 0.00 -1.26 -4.81 105.19 102.80 1llq n GLY 184 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1llq n GLY 184 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llq n LEU 185 N 0.00 0.00 0.00 0.99 4.77 -0.06 -5.12 117.00 117.58 1llq n LEU 185 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1llq n LEU 185 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1llq n LEU 185 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 1llq n GLY 186 N 1.27 0.95 3.50 -0.72 0.00 -0.47 -4.86 105.19 104.85 1llq n GLY 186 Ca 0.00 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.14 1llq n GLY 186 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1llq s ASP 187 N -4.00 6.30 -0.04 1.61 -1.08 -0.50 0.29 116.67 119.25 1llq s ASP 187 Ca 0.00 -0.52 0.11 0.00 -0.52 0.00 0.00 52.55 51.63 1llq s ASP 187 Cb 0.00 -2.34 0.33 0.00 -1.46 0.00 0.00 42.92 39.46 1llq s ASP 187 CO 0.00 -0.91 1.27 0.18 0.52 0.00 0.00 175.17 176.23 1llq n LEU 188 N 6.48 3.05 0.00 -1.34 4.77 -0.92 -4.61 117.00 124.42 1llq n LEU 188 Ca -0.02 -2.23 0.00 0.00 -0.03 0.00 0.00 56.01 53.73 1llq n LEU 188 Cb 0.47 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1llq n LEU 188 CO 0.56 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.93 1llq n GLY 189 N 0.21 1.93 0.18 -0.72 0.00 -1.24 -1.60 105.19 103.95 1llq n GLY 189 Ca 0.13 -0.33 0.11 0.00 0.00 0.00 0.00 46.02 45.93 1llq n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llq h ALA 190 N -0.41 1.08 0.00 4.61 0.00 -1.90 0.96 119.26 123.60 1llq h ALA 190 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1llq h ALA 190 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1llq h ALA 190 CO 0.00 -0.08 0.00 0.66 0.00 0.00 0.00 179.25 179.83 1llq n TYR 191 N -2.28 0.09 1.68 0.00 0.53 -0.63 -3.46 117.16 113.10 1llq n TYR 191 Ca -0.01 0.03 0.13 0.00 -1.02 0.00 0.00 57.90 57.02 1llq n TYR 191 Cb 0.14 -0.55 0.75 0.00 -1.03 0.00 0.00 39.34 38.65 1llq n TYR 191 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1llq n GLY 192 N 0.58 -0.84 0.34 2.72 0.00 0.33 -3.96 105.19 104.35 1llq n GLY 192 Ca 0.05 -0.16 0.20 0.00 0.00 0.00 0.00 46.02 46.11 1llq n GLY 192 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1llq h ILE 193 N 0.00 0.10 0.00 -0.61 6.09 -1.80 -2.07 117.51 119.22 1llq h ILE 193 Ca 0.00 0.00 -0.07 0.00 -1.37 0.00 0.00 64.86 63.42 1llq h ILE 193 Cb 0.00 0.88 -0.01 0.00 0.47 0.00 0.00 36.82 38.16 1llq h ILE 193 CO 0.00 0.00 -0.34 1.23 -3.07 0.00 0.00 178.15 175.97 1llq h GLY 194 N 0.00 0.00 1.01 8.18 0.00 -1.90 -3.14 103.07 107.21 1llq h GLY 194 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 1llq h GLY 194 CO -0.00 0.00 -0.31 -2.22 0.00 0.00 0.00 176.54 174.01 1llq h ILE 195 N 0.00 0.38 -0.55 2.60 1.08 -1.69 0.57 117.51 119.89 1llq h ILE 195 Ca -0.00 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.51 1llq h ILE 195 Cb 0.78 0.38 -0.04 0.00 -3.07 0.00 0.00 36.82 34.86 1llq h ILE 195 CO 0.04 0.00 0.31 -0.65 -0.69 0.00 0.00 178.15 177.16 1llq h PRO 196 N -0.85 0.58 -0.18 2.37 0.11 -1.73 0.15 132.00 132.44 1llq h PRO 196 Ca -0.09 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 66.04 1llq h PRO 196 Cb 0.66 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 31.58 1llq h PRO 196 CO 0.14 0.38 -0.14 0.28 -0.21 0.00 0.00 178.00 178.45 1llq h VAL 197 N 0.59 0.60 -0.73 3.15 2.07 -1.48 -0.00 116.25 120.45 1llq h VAL 197 Ca 0.23 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.74 1llq h VAL 197 Cb 0.10 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1llq h VAL 197 CO -0.14 0.00 0.39 1.23 0.02 0.00 0.00 177.57 179.08 1llq h GLY 198 N -0.15 1.09 0.97 2.17 0.00 -0.18 -1.57 103.07 105.41 1llq h GLY 198 Ca 0.11 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 1llq h GLY 198 CO -0.27 0.48 0.25 1.70 0.00 0.00 0.00 176.54 178.69 1llq h LYS 199 N 1.01 0.66 -0.24 4.80 1.63 -0.18 -2.37 116.57 121.87 1llq h LYS 199 Ca 0.26 -0.08 -0.07 0.00 -0.85 0.00 0.00 60.65 59.90 1llq h LYS 199 Cb 0.05 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.54 1llq h LYS 199 CO -0.04 0.54 -0.14 -0.07 -3.45 0.00 0.00 179.45 176.28 1llq h LEU 200 N 0.62 0.39 -1.11 5.20 -0.00 -0.80 -2.12 115.31 117.49 1llq h LEU 200 Ca 0.16 -0.10 0.02 0.00 -0.00 0.00 0.00 57.88 57.96 1llq h LEU 200 Cb 0.08 -0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 40.58 1llq h LEU 200 CO -0.02 0.56 0.60 0.00 -0.00 0.00 0.00 178.44 179.58 1llq h ALA 201 N 1.48 1.37 -0.01 1.53 0.00 -0.77 -1.14 119.26 121.72 1llq h ALA 201 Ca 0.07 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1llq h ALA 201 Cb 0.48 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1llq h ALA 201 CO 0.03 0.57 -0.67 -0.07 0.00 0.00 0.00 179.25 179.12 1llq h LEU 202 N 1.21 0.06 -0.48 0.00 3.38 -1.13 -1.02 115.31 117.34 1llq h LEU 202 Ca 0.34 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.36 1llq h LEU 202 Cb -0.10 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.56 1llq h LEU 202 CO -0.08 0.71 0.02 1.88 0.09 0.00 0.00 178.44 181.06 1llq h TYR 203 N 0.04 0.01 0.32 1.13 -1.99 -0.59 0.40 116.97 116.29 1llq h TYR 203 Ca -0.01 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 1llq h TYR 203 Cb 1.18 0.07 0.00 0.00 2.00 0.00 0.00 36.73 39.98 1llq h TYR 203 CO 0.01 -0.08 -0.15 0.28 -0.00 0.00 0.00 178.16 178.21 1llq h VAL 204 N 0.14 0.42 -0.34 -2.88 2.07 -1.29 0.00 116.25 114.38 1llq h VAL 204 Ca 0.24 -0.78 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1llq h VAL 204 Cb 0.35 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1llq h VAL 204 CO -0.38 0.10 0.15 0.00 0.02 0.00 0.00 177.57 177.46 1llq h ALA 205 N -0.69 0.41 0.05 1.67 0.00 -1.08 -0.74 119.26 118.88 1llq h ALA 205 Ca -0.04 0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.54 1llq h ALA 205 Cb 0.49 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 1llq h ALA 205 CO 0.07 -0.24 -2.09 1.28 0.00 0.00 0.00 179.25 178.28 1llq n LEU 206 N -4.98 1.86 -0.00 0.00 4.77 0.14 -4.53 117.00 114.26 1llq n LEU 206 Ca 0.01 0.16 -0.04 0.00 -0.03 0.00 0.00 56.01 56.10 1llq n LEU 206 Cb 0.10 -0.50 -0.12 0.00 -2.33 0.00 0.00 43.42 40.58 1llq n LEU 206 CO 0.29 0.70 -0.46 0.61 -1.33 0.00 0.00 177.39 177.20 1llq n GLY 207 N 1.90 -1.09 1.10 -0.72 0.00 -0.07 -2.91 105.19 103.40 1llq n GLY 207 Ca -0.31 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1llq n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llq n GLY 208 N 1.49 0.75 3.74 -0.02 0.00 -0.28 -4.70 105.19 106.16 1llq n GLY 208 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1llq n GLY 208 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1llq n VAL 209 N -2.20 2.26 -2.23 1.61 0.31 -1.11 0.27 118.33 117.24 1llq n VAL 209 Ca 0.00 -0.50 -0.41 0.00 -0.01 0.00 0.00 64.34 63.42 1llq n VAL 209 Cb 0.00 -1.76 -0.03 0.00 -0.91 0.00 0.00 33.84 31.15 1llq n VAL 209 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1llq s GLN 210 N -2.13 4.39 0.26 5.55 -1.52 -1.26 -4.19 119.66 120.77 1llq s GLN 210 Ca 0.57 2.04 -0.04 0.00 -1.95 0.00 0.00 55.36 55.98 1llq s GLN 210 Cb -0.50 -3.20 0.33 0.00 -0.22 0.00 0.00 33.01 29.42 1llq s GLN 210 CO 0.61 -0.24 1.91 -1.35 -0.25 0.00 0.00 175.29 175.96 1llq h PRO 211 N 5.39 1.24 0.00 2.91 0.11 -1.96 -2.49 132.00 137.20 1llq h PRO 211 Ca -0.45 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1llq h PRO 211 Cb 1.21 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1llq h PRO 211 CO 0.77 0.82 0.00 1.57 -0.21 0.00 0.00 178.00 180.95 1llq h LYS 212 N 1.28 0.00 0.00 1.05 2.10 -1.94 -1.66 116.57 117.39 1llq h LYS 212 Ca 0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 1llq h LYS 212 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1llq h LYS 212 CO -0.13 0.00 -0.03 0.91 -2.00 0.00 0.00 179.45 178.20 1llq n TRP 213 N -2.86 0.20 -3.19 0.07 8.01 -0.94 -4.52 117.44 114.21 1llq n TRP 213 Ca -0.01 0.06 -0.39 0.00 -1.31 0.00 0.00 57.50 55.84 1llq n TRP 213 Cb 0.13 -0.58 -0.06 0.00 -2.01 0.00 0.00 31.31 28.80 1llq n TRP 213 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1llq s LEU 215 N -0.46 0.96 0.12 0.00 2.96 0.02 -4.98 118.68 117.30 1llq s LEU 215 Ca 0.31 -0.95 -0.28 0.00 -0.22 0.00 0.00 54.13 52.99 1llq s LEU 215 Cb -0.19 -0.48 -0.06 0.00 0.50 0.00 0.00 46.19 45.95 1llq s LEU 215 CO 0.19 -0.36 0.89 -2.84 -1.32 0.00 0.00 176.35 172.91 1llq s PRO 216 N 1.95 4.66 0.01 0.98 0.02 -1.26 -2.66 135.00 138.70 1llq s PRO 216 Ca 0.03 1.34 0.01 0.00 0.02 0.00 0.00 61.00 62.39 1llq s PRO 216 Cb -0.17 -3.35 -0.01 0.00 0.02 0.00 0.00 34.50 30.99 1llq s PRO 216 CO -0.16 0.31 -0.03 0.08 -0.33 0.00 0.00 177.00 176.87 1llq s VAL 217 N -0.31 0.19 -0.09 3.83 1.01 -0.64 -1.49 120.40 122.90 1llq s VAL 217 Ca 0.43 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.88 1llq s VAL 217 Cb -0.23 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 35.92 1llq s VAL 217 CO 0.28 -0.23 -0.11 -0.22 0.00 0.00 0.00 175.10 174.82 1llq s LEU 218 N -0.80 1.51 -0.25 3.92 0.20 -0.41 -2.30 118.68 120.55 1llq s LEU 218 Ca -0.07 -0.34 -0.19 0.00 0.69 0.00 0.00 54.13 54.22 1llq s LEU 218 Cb -0.06 -0.91 -0.02 0.00 -0.43 0.00 0.00 46.19 44.78 1llq s LEU 218 CO -0.00 -0.03 0.58 -0.76 -0.29 0.00 0.00 176.35 175.85 1llq s LEU 219 N 1.12 4.07 -0.36 -0.68 1.43 0.62 -1.92 118.68 122.96 1llq s LEU 219 Ca -0.05 0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 53.61 1llq s LEU 219 Cb -0.14 -2.79 0.03 0.00 0.03 0.00 0.00 46.19 43.32 1llq s LEU 219 CO -0.02 -0.32 0.18 -0.62 0.23 0.00 0.00 176.35 175.80 1llq s ASP 220 N 1.43 5.60 0.00 2.29 2.15 -0.33 -4.35 116.67 123.47 1llq s ASP 220 Ca 0.25 -1.06 0.03 0.00 0.43 0.00 0.00 52.55 52.19 1llq s ASP 220 Cb -0.16 -1.97 0.08 0.00 -0.30 0.00 0.00 42.92 40.57 1llq s ASP 220 CO 0.09 -0.37 1.01 1.33 -0.17 0.00 0.00 175.17 177.06 1llq n VAL 221 N 4.94 0.88 0.00 1.11 0.24 -1.26 -1.75 118.33 122.48 1llq n VAL 221 Ca -0.12 -0.94 0.00 0.00 -2.04 0.00 0.00 64.34 61.24 1llq n VAL 221 Cb 0.45 0.57 0.00 0.00 -1.47 0.00 0.00 33.84 33.39 1llq n VAL 221 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1llq n GLY 222 N -0.17 -0.07 3.18 7.63 0.00 -1.26 -2.30 105.19 112.19 1llq n GLY 222 Ca 0.03 -2.29 -0.12 0.00 0.00 0.00 0.00 46.02 43.64 1llq n GLY 222 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1llq s THR 223 N -0.87 0.05 -2.11 2.61 -1.32 -0.04 -4.45 115.64 109.51 1llq s THR 223 Ca 0.00 -0.42 0.21 0.00 -1.21 0.00 0.00 61.69 60.27 1llq s THR 223 Cb 0.00 -0.50 0.42 0.00 -1.51 0.00 0.00 72.50 70.91 1llq s THR 223 CO 0.00 -0.23 1.36 0.59 -2.21 0.00 0.00 174.62 174.13 1llq n ASN 224 N 1.75 3.38 -4.56 8.08 3.02 -1.26 -3.71 115.26 121.96 1llq n ASN 224 Ca -0.20 -1.96 -0.40 0.00 -0.03 0.00 0.00 54.58 52.00 1llq n ASN 224 Cb 0.56 -0.27 -0.03 0.00 -0.61 0.00 0.00 39.78 39.43 1llq n ASN 224 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1llq s ASN 225 N -1.30 6.18 0.49 6.41 3.84 -1.26 -4.84 114.94 124.46 1llq s ASN 225 Ca 0.37 -0.92 0.26 0.00 0.21 0.00 0.00 52.86 52.78 1llq s ASN 225 Cb 0.21 -2.56 1.33 0.00 -0.55 0.00 0.00 41.25 39.68 1llq s ASN 225 CO 0.29 -1.80 1.89 0.24 -2.79 0.00 0.00 177.10 174.93 1llq h MET 226 N 10.35 0.14 -0.63 0.43 2.86 -1.96 -0.02 114.93 126.11 1llq h MET 226 Ca -0.01 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 1llq h MET 226 Cb 1.03 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.63 1llq h MET 226 CO 1.34 0.09 0.23 -0.44 1.06 0.00 0.00 176.91 179.20 1llq h ASP 227 N 0.14 0.88 -0.35 1.22 3.32 -1.97 0.02 116.42 119.68 1llq h ASP 227 Ca 0.42 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 57.22 1llq h ASP 227 Cb 1.42 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 1llq h ASP 227 CO -0.07 0.82 -0.02 -0.07 -1.72 0.00 0.00 179.24 178.19 1llq h LEU 228 N 0.88 0.63 -1.65 1.55 3.38 -1.38 0.12 115.31 118.83 1llq h LEU 228 Ca 0.21 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1llq h LEU 228 Cb 0.23 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1llq h LEU 228 CO -0.01 0.80 0.27 -0.07 0.09 0.00 0.00 178.44 179.52 1llq h LEU 229 N 0.44 0.40 0.00 1.67 3.38 -1.15 -0.78 115.31 119.27 1llq h LEU 229 Ca 0.10 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1llq h LEU 229 Cb 0.49 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1llq h LEU 229 CO 0.02 0.28 -0.45 0.59 0.09 0.00 0.00 178.44 178.98 1llq n ASN 230 N -4.48 0.47 -4.64 -0.43 3.02 -0.03 -4.83 115.26 104.34 1llq n ASN 230 Ca 0.04 -0.06 -0.43 0.00 -0.03 0.00 0.00 54.58 54.10 1llq n ASN 230 Cb 0.12 0.11 -0.03 0.00 -0.61 0.00 0.00 39.78 39.38 1llq n ASN 230 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1llq s ASP 231 N -3.25 6.89 0.19 6.41 -1.08 0.37 -4.91 116.67 121.28 1llq s ASP 231 Ca 0.11 1.01 0.16 0.00 -0.52 0.00 0.00 52.55 53.31 1llq s ASP 231 Cb 0.17 -2.51 0.78 0.00 -1.46 0.00 0.00 42.92 39.91 1llq s ASP 231 CO 0.68 -0.77 1.50 -0.81 0.52 0.00 0.00 175.17 176.29 1llq n PRO 232 N 6.58 0.10 -0.08 4.34 -0.04 -1.26 -1.96 135.00 142.68 1llq n PRO 232 Ca 0.10 0.49 0.12 0.00 -0.04 0.00 0.00 63.50 64.17 1llq n PRO 232 Cb 0.47 -1.77 0.22 0.00 -0.04 0.00 0.00 33.50 32.39 1llq n PRO 232 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1llq n PHE 233 N -1.97 0.22 -2.33 0.54 3.01 -1.26 -4.95 117.46 110.71 1llq n PHE 233 Ca 0.01 -0.11 -0.41 0.00 1.01 0.00 0.00 57.45 57.95 1llq n PHE 233 Cb 0.10 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.54 1llq n PHE 233 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 1llq s TYR 234 N -1.78 3.37 -0.35 1.38 6.04 -0.83 -4.77 117.35 120.42 1llq s TYR 234 Ca 0.34 1.50 0.16 0.00 0.04 0.00 0.00 57.07 59.10 1llq s TYR 234 Cb 0.21 -3.46 0.52 0.00 -1.04 0.00 0.00 41.96 38.19 1llq s TYR 234 CO 0.31 -1.21 1.43 0.44 -1.54 0.00 0.00 175.55 174.98 1llq n ILE 235 N 1.62 2.09 -3.39 3.14 -6.64 -1.26 -5.00 119.36 109.92 1llq n ILE 235 Ca 0.01 -1.67 -0.16 0.00 -1.77 0.00 0.00 62.75 59.16 1llq n ILE 235 Cb 0.44 -0.11 0.02 0.00 -1.44 0.00 0.00 39.64 38.55 1llq n ILE 235 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1llq n GLY 236 N -0.19 2.38 3.68 3.28 0.00 -1.26 -5.01 105.19 108.07 1llq n GLY 236 Ca 0.20 -2.23 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 1llq n GLY 236 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llq s LEU 237 N 0.00 4.39 -1.36 0.99 1.02 -1.26 -4.87 118.68 117.58 1llq s LEU 237 Ca 0.32 2.59 -0.12 0.00 0.02 0.00 0.00 54.13 56.95 1llq s LEU 237 Cb -0.03 -3.56 0.10 0.00 0.02 0.00 0.00 46.19 42.73 1llq s LEU 237 CO 0.21 -0.96 2.01 -1.14 0.02 0.00 0.00 176.35 176.49 1llq n ARG 238 N 6.09 3.24 -3.69 1.70 0.63 -1.26 -4.38 116.66 118.99 1llq n ARG 238 Ca 0.17 -3.10 -0.04 0.00 -0.92 0.00 0.00 57.85 53.96 1llq n ARG 238 Cb 0.40 -3.12 -0.01 0.00 0.45 0.00 0.00 32.46 30.17 1llq n ARG 238 CO 0.00 0.00 0.00 -3.38 -2.51 0.00 0.00 177.63 171.74 1llq s HIS 239 N 1.89 -0.16 0.93 -0.14 -3.43 -1.26 -5.08 115.29 108.04 1llq s HIS 239 Ca 0.44 -0.09 -0.13 0.00 -0.80 0.00 0.00 55.06 54.48 1llq s HIS 239 Cb 0.11 0.61 0.15 0.00 -1.43 0.00 0.00 32.58 32.02 1llq s HIS 239 CO -0.04 -0.70 1.14 0.15 -2.00 0.00 0.00 174.74 173.29 1llq s LYS 240 N -3.14 0.96 0.05 -0.38 1.02 -1.24 -0.86 119.74 116.14 1llq s LYS 240 Ca 0.11 0.26 -0.31 0.00 0.02 0.00 0.00 55.97 56.06 1llq s LYS 240 Cb -0.01 -1.82 -0.07 0.00 -0.52 0.00 0.00 37.83 35.41 1llq s LYS 240 CO -0.01 -2.32 1.55 1.03 -0.92 0.00 0.00 175.35 174.69 1llq s ARG 241 N -5.29 4.23 0.14 1.68 0.52 -1.26 -4.26 118.95 114.72 1llq s ARG 241 Ca 0.65 2.20 -0.30 0.00 -0.52 0.00 0.00 55.73 57.75 1llq s ARG 241 Cb -0.14 -3.54 -0.07 0.00 0.52 0.00 0.00 34.95 31.72 1llq s ARG 241 CO 0.54 -0.66 1.04 0.08 0.02 0.00 0.00 175.30 176.32 1llq s VAL 242 N 2.38 4.19 0.00 3.52 1.01 -0.97 -4.93 120.40 125.60 1llq s VAL 242 Ca 0.70 1.83 0.00 0.00 0.00 0.00 0.00 61.98 64.51 1llq s VAL 242 Cb -0.37 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 31.84 1llq s VAL 242 CO 0.30 0.29 0.18 0.54 0.00 0.00 0.00 175.10 176.41 1llq n ARG 243 N 2.67 -0.27 0.00 2.72 1.74 -1.26 -4.64 116.66 117.61 1llq n ARG 243 Ca 0.03 -0.18 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 1llq n ARG 243 Cb 0.48 -0.66 0.00 0.00 -1.02 0.00 0.00 32.46 31.26 1llq n ARG 243 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1llq n GLY 244 N -0.01 -2.42 0.21 -0.13 0.00 -1.26 -4.59 105.19 97.00 1llq n GLY 244 Ca 0.00 -1.02 0.09 0.00 0.00 0.00 0.00 46.02 45.09 1llq n GLY 244 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1llq h LYS 245 N 0.00 0.00 -0.69 1.61 1.57 -2.00 -3.10 116.57 113.96 1llq h LYS 245 Ca 0.00 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1llq h LYS 245 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1llq h LYS 245 CO 0.00 0.23 0.44 -0.44 -0.57 0.00 0.00 179.45 179.11 1llq h ASP 246 N 0.00 0.72 0.74 0.86 5.19 -1.97 0.20 116.42 122.17 1llq h ASP 246 Ca -0.00 -0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.37 1llq h ASP 246 Cb 0.85 -0.16 0.01 0.00 0.18 0.00 0.00 39.33 40.21 1llq h ASP 246 CO 0.03 0.51 -0.36 0.22 -3.12 0.00 0.00 179.24 176.52 1llq h TYR 247 N 0.86 -0.93 -0.47 4.55 3.20 -1.79 0.27 116.97 122.67 1llq h TYR 247 Ca 0.27 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.23 1llq h TYR 247 Cb -0.01 0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 1llq h TYR 247 CO -0.04 -0.56 0.33 -0.44 -1.64 0.00 0.00 178.16 175.81 1llq h ASP 248 N -1.17 0.10 -0.26 -2.11 5.19 -1.59 0.43 116.42 117.00 1llq h ASP 248 Ca -0.10 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.12 1llq h ASP 248 Cb 0.79 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.28 1llq h ASP 248 CO 0.17 0.06 -0.60 0.74 -3.12 0.00 0.00 179.24 176.49 1llq h THR 249 N 0.11 1.27 -0.67 0.35 2.02 -0.31 -1.82 112.91 113.87 1llq h THR 249 Ca 0.22 -1.78 -0.01 0.00 0.77 0.00 0.00 66.41 65.61 1llq h THR 249 Cb 0.73 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.81 1llq h THR 249 CO -0.02 0.58 0.39 0.25 0.37 0.00 0.00 175.52 177.08 1llq h LEU 250 N 0.65 0.81 -0.50 2.58 5.85 0.12 -0.38 115.31 124.44 1llq h LEU 250 Ca -0.00 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.55 1llq h LEU 250 Cb 1.21 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 1llq h LEU 250 CO 0.13 0.65 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.77 1llq h LEU 251 N 0.91 0.90 -0.73 2.25 -0.00 -1.19 0.58 115.31 118.04 1llq h LEU 251 Ca 0.24 -0.33 -0.07 0.00 -0.00 0.00 0.00 57.88 57.72 1llq h LEU 251 Cb 0.00 -0.24 -0.03 0.00 -0.00 0.00 0.00 40.66 40.39 1llq h LEU 251 CO -0.04 1.02 0.14 0.44 -0.00 0.00 0.00 178.44 180.00 1llq h ASP 252 N 0.77 1.06 -0.21 -0.43 3.32 -1.01 -1.21 116.42 118.71 1llq h ASP 252 Ca 0.14 -0.24 -0.11 0.00 0.02 0.00 0.00 57.03 56.84 1llq h ASP 252 Cb 0.58 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1llq h ASP 252 CO 0.03 1.03 -0.22 0.78 -1.72 0.00 0.00 179.24 179.14 1llq h ASN 253 N 1.05 0.67 -0.03 6.45 2.35 -0.90 -1.88 115.58 123.30 1llq h ASN 253 Ca 0.21 -0.23 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1llq h ASN 253 Cb 0.40 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 1llq h ASN 253 CO 0.01 0.89 0.02 0.15 -1.65 0.00 0.00 177.43 176.84 1llq h PHE 254 N 0.59 0.05 -0.84 1.19 3.57 -0.33 0.11 116.94 121.27 1llq h PHE 254 Ca 0.08 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1llq h PHE 254 Cb 0.70 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.38 1llq h PHE 254 CO 0.03 0.08 0.44 0.52 -2.23 0.00 0.00 178.31 177.16 1llq h MET 255 N -0.01 1.18 0.04 1.11 2.86 -1.16 -1.16 114.93 117.80 1llq h MET 255 Ca 0.01 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1llq h MET 255 Cb 0.05 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.49 1llq h MET 255 CO -0.00 0.88 -0.02 0.87 1.06 0.00 0.00 176.91 179.70 1llq h LYS 256 N 1.18 -0.05 -0.74 1.72 1.57 -1.00 -2.58 116.57 116.66 1llq h LYS 256 Ca 0.29 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.12 1llq h LYS 256 Cb 0.05 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.33 1llq h LYS 256 CO -0.04 0.18 0.46 0.00 -0.57 0.00 0.00 179.45 179.48 1llq h ALA 257 N 0.66 0.98 -0.53 3.86 0.00 -0.67 0.11 119.26 123.68 1llq h ALA 257 Ca -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1llq h ALA 257 Cb 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1llq h ALA 257 CO 0.01 0.22 0.19 0.00 0.00 0.00 0.00 179.25 179.68 1llq h THR 259 N 0.71 0.92 -0.26 0.00 1.35 -1.16 0.73 112.91 115.21 1llq h THR 259 Ca 0.17 -2.16 -0.18 0.00 -0.55 0.00 0.00 66.41 63.69 1llq h THR 259 Cb 0.22 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 1llq h THR 259 CO -0.01 0.50 -0.55 0.50 -0.25 0.00 0.00 175.52 175.71 1llq h LYS 260 N 0.00 0.82 -0.09 4.72 3.64 -0.65 0.25 116.57 125.26 1llq h LYS 260 Ca -0.01 -0.54 -0.08 0.00 -1.27 0.00 0.00 60.65 58.76 1llq h LYS 260 Cb 1.31 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.21 1llq h LYS 260 CO 0.07 1.17 -0.24 -0.22 -2.27 0.00 0.00 179.45 177.96 1llq h LYS 261 N 0.58 0.33 -0.00 1.90 1.63 -0.86 -3.38 116.57 116.76 1llq h LYS 261 Ca 0.00 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.58 1llq h LYS 261 Cb 1.16 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.82 1llq h LYS 261 CO 0.12 0.84 -0.23 0.66 -3.45 0.00 0.00 179.45 177.40 1llq n TYR 262 N -4.49 0.00 0.00 1.91 4.02 0.24 -5.07 117.16 113.77 1llq n TYR 262 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 1llq n TYR 262 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.76 1llq n TYR 262 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1llq n GLY 263 N 1.01 2.84 0.34 2.72 0.00 0.87 -4.68 105.19 108.30 1llq n GLY 263 Ca 0.02 -1.72 0.18 0.00 0.00 0.00 0.00 46.02 44.50 1llq n GLY 263 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1llq h GLN 264 N 0.00 0.00 0.00 1.61 5.75 -1.90 -0.80 115.11 119.77 1llq h GLN 264 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1llq h GLN 264 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1llq h GLN 264 CO 0.00 0.00 0.00 0.36 -2.65 0.00 0.00 178.83 176.54 1llq n LYS 265 N -3.45 0.00 -1.68 1.69 0.00 -1.26 -4.30 118.16 109.16 1llq n LYS 265 Ca 0.01 0.03 -0.47 0.00 -0.00 0.00 0.00 58.31 57.87 1llq n LYS 265 Cb 0.33 -1.50 -0.04 0.00 -0.00 0.00 0.00 35.03 33.81 1llq n LYS 265 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1llq n THR 266 N -1.50 0.37 -2.71 0.58 -1.04 -0.31 -4.87 114.28 104.80 1llq n THR 266 Ca 0.07 -0.07 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1llq n THR 266 Cb 0.32 -1.78 -0.03 0.00 -1.82 0.00 0.00 70.33 67.02 1llq n THR 266 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1llq s LEU 267 N 2.89 4.33 -0.23 -4.42 2.96 -0.53 -4.35 118.68 119.33 1llq s LEU 267 Ca 0.87 1.61 0.00 0.00 -0.22 0.00 0.00 54.13 56.39 1llq s LEU 267 Cb -0.67 -3.55 0.06 0.00 0.50 0.00 0.00 46.19 42.53 1llq s LEU 267 CO 0.46 -0.31 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.50 1llq s ILE 268 N 1.31 1.42 -0.19 6.68 1.01 -0.02 -0.53 121.20 130.87 1llq s ILE 268 Ca 0.51 -1.12 -0.05 0.00 0.00 0.00 0.00 60.65 59.99 1llq s ILE 268 Cb -0.20 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 1llq s ILE 268 CO 0.25 -0.09 -0.01 -1.58 0.00 0.00 0.00 174.94 173.51 1llq s GLN 269 N 1.45 3.64 0.07 2.79 -0.44 0.68 -2.69 119.66 125.17 1llq s GLN 269 Ca -0.05 -0.51 -0.22 0.00 -2.50 0.00 0.00 55.36 52.08 1llq s GLN 269 Cb -0.18 -3.03 -0.06 0.00 -1.64 0.00 0.00 33.01 28.09 1llq s GLN 269 CO -0.06 0.09 0.64 -0.06 0.50 0.00 0.00 175.29 176.39 1llq s PHE 270 N 0.79 3.79 0.01 1.67 0.40 -0.47 -1.06 117.98 123.11 1llq s PHE 270 Ca -0.00 1.35 0.01 0.00 -0.60 0.00 0.00 56.93 57.70 1llq s PHE 270 Cb -0.14 -2.62 -0.01 0.00 0.51 0.00 0.00 43.02 40.76 1llq s PHE 270 CO 0.02 0.48 -0.04 -2.00 0.70 0.00 0.00 175.22 174.38 1llq s GLU 271 N -0.77 0.31 -1.54 0.44 2.56 0.27 -3.70 118.70 116.27 1llq s GLU 271 Ca 0.32 -0.26 -0.09 0.00 0.00 0.00 0.00 54.97 54.94 1llq s GLU 271 Cb -0.20 -0.23 0.07 0.00 2.00 0.00 0.00 34.13 35.77 1llq s GLU 271 CO 0.21 0.06 0.58 -0.25 -0.56 0.00 0.00 175.26 175.30 1llq n ASP 272 N 2.64 -1.74 -4.93 -1.70 8.00 -1.26 -4.23 116.55 113.33 1llq n ASP 272 Ca -0.15 -1.01 -0.25 0.00 0.71 0.00 0.00 54.79 54.09 1llq n ASP 272 Cb 0.58 -2.91 -0.01 0.00 -0.02 0.00 0.00 41.12 38.76 1llq n ASP 272 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1llq s PHE 273 N -3.67 3.51 0.38 1.24 0.40 -1.26 -1.98 117.98 116.61 1llq s PHE 273 Ca 0.35 0.49 -0.27 0.00 -0.60 0.00 0.00 56.93 56.90 1llq s PHE 273 Cb -0.19 -2.01 -0.11 0.00 0.51 0.00 0.00 43.02 41.22 1llq s PHE 273 CO 0.91 0.04 1.40 0.00 0.70 0.00 0.00 175.22 178.27 1llq n ALA 274 N -1.75 1.88 -0.30 5.36 0.00 -1.26 -4.51 120.51 119.93 1llq n ALA 274 Ca -0.03 0.33 0.12 0.00 0.00 0.00 0.00 53.44 53.86 1llq n ALA 274 Cb 0.56 -2.35 0.27 0.00 0.00 0.00 0.00 19.45 17.93 1llq n ALA 274 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1llq h ASN 275 N 2.64 -0.19 -0.45 0.00 2.35 -1.96 0.10 115.58 118.07 1llq h ASN 275 Ca -0.49 0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1llq h ASN 275 Cb 1.26 0.34 -0.02 0.00 0.05 0.00 0.00 38.32 39.96 1llq h ASN 275 CO 0.63 -0.23 0.26 -0.65 -1.65 0.00 0.00 177.43 175.80 1llq h PRO 276 N 0.12 0.61 -0.38 0.81 0.11 -2.00 -1.23 132.00 130.05 1llq h PRO 276 Ca 0.55 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 66.47 1llq h PRO 276 Cb 1.11 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1llq h PRO 276 CO -0.73 0.46 -0.28 -0.91 -0.21 0.00 0.00 178.00 176.33 1llq h ASN 277 N 0.59 0.83 0.27 -2.05 2.35 -1.59 -0.54 115.58 115.45 1llq h ASN 277 Ca 0.16 -0.33 0.01 0.00 -0.55 0.00 0.00 56.30 55.59 1llq h ASN 277 Cb 0.01 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 1llq h ASN 277 CO -0.03 1.06 -0.36 0.00 -1.65 0.00 0.00 177.43 176.45 1llq h ALA 278 N 1.00 -0.71 0.01 -0.83 0.00 -0.52 0.96 119.26 119.17 1llq h ALA 278 Ca 0.08 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1llq h ALA 278 Cb 0.81 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1llq h ALA 278 CO 0.07 -0.95 -0.01 0.35 0.00 0.00 0.00 179.25 178.72 1llq h PHE 279 N -0.68 -0.01 -0.25 0.00 3.57 -1.19 -1.67 116.94 116.70 1llq h PHE 279 Ca -0.01 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.54 1llq h PHE 279 Cb 0.65 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 1llq h PHE 279 CO -0.24 0.18 -0.01 -0.09 -2.23 0.00 0.00 178.31 175.91 1llq h ARG 280 N -0.20 0.06 -0.53 1.11 2.43 -0.99 -0.50 114.38 115.77 1llq h ARG 280 Ca -0.00 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1llq h ARG 280 Cb 0.20 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1llq h ARG 280 CO 0.00 0.04 0.22 -0.07 -1.51 0.00 0.00 179.97 178.65 1llq h LEU 281 N 0.06 0.72 -0.07 3.80 3.38 -0.81 -0.97 115.31 121.42 1llq h LEU 281 Ca 0.12 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1llq h LEU 281 Cb 0.16 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1llq h LEU 281 CO -0.21 0.68 -0.02 0.25 0.09 0.00 0.00 178.44 179.24 1llq h LEU 282 N 0.71 -0.06 -1.57 1.67 5.85 -1.04 0.88 115.31 121.74 1llq h LEU 282 Ca 0.18 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.97 1llq h LEU 282 Cb 0.18 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1llq h LEU 282 CO -0.02 -0.02 0.36 -0.78 -0.34 0.00 0.00 178.44 177.64 1llq h ASP 283 N 0.00 0.47 0.44 1.25 1.82 -0.87 0.45 116.42 119.98 1llq h ASP 283 Ca 0.03 -0.00 -0.30 0.00 -0.39 0.00 0.00 57.03 56.37 1llq h ASP 283 Cb 0.05 -0.10 0.02 0.00 0.68 0.00 0.00 39.33 39.98 1llq h ASP 283 CO -0.07 0.31 -1.32 0.50 -1.61 0.00 0.00 179.24 177.05 1llq h LYS 284 N 0.53 0.41 0.00 0.28 3.64 -0.42 -3.39 116.57 117.63 1llq h LYS 284 Ca 0.23 -0.67 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1llq h LYS 284 Cb 0.23 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1llq h LYS 284 CO -0.06 1.31 -1.15 0.66 -2.27 0.00 0.00 179.45 177.94 1llq n TYR 285 N -3.63 0.00 -0.30 1.91 0.53 0.23 -4.61 117.16 111.29 1llq n TYR 285 Ca -0.12 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 56.89 1llq n TYR 285 Cb 1.05 -0.13 0.29 0.00 -1.03 0.00 0.00 39.34 39.51 1llq n TYR 285 CO 0.00 0.00 0.00 0.37 -1.02 0.00 0.00 176.86 176.21 1llq h GLN 286 N 0.00 0.14 -0.37 -0.72 4.15 -1.10 -1.04 115.11 116.16 1llq h GLN 286 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1llq h GLN 286 Cb 0.55 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.21 1llq h GLN 286 CO 0.00 0.09 0.00 -0.25 -1.93 0.00 0.00 178.83 176.74 1llq n ASP 287 N -5.30 3.55 -0.03 -0.69 8.00 -1.26 -4.40 116.55 116.43 1llq n ASP 287 Ca 0.21 -2.40 -0.00 0.00 0.71 0.00 0.00 54.79 53.31 1llq n ASP 287 Cb 0.70 -0.39 -0.07 0.00 -0.02 0.00 0.00 41.12 41.34 1llq n ASP 287 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1llq n LYS 288 N 0.30 1.64 -4.30 -1.24 4.81 -0.57 -5.06 118.16 113.74 1llq n LYS 288 Ca 0.17 -0.04 -0.18 0.00 -0.87 0.00 0.00 58.31 57.40 1llq n LYS 288 Cb 0.66 -1.21 -0.09 0.00 0.02 0.00 0.00 35.03 34.40 1llq n LYS 288 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1llq s TYR 289 N -2.38 1.57 -1.01 5.64 1.51 -0.50 -5.06 117.35 117.11 1llq s TYR 289 Ca -0.04 -1.46 -0.18 0.00 -1.01 0.00 0.00 57.07 54.38 1llq s TYR 289 Cb 0.04 -0.77 0.12 0.00 -0.11 0.00 0.00 41.96 41.25 1llq s TYR 289 CO 0.35 -0.64 1.26 0.99 -1.11 0.00 0.00 175.55 176.40 1llq s THR 290 N -3.66 4.65 0.07 -0.71 2.01 -1.22 -4.61 115.64 112.18 1llq s THR 290 Ca 0.37 -1.69 -0.04 0.00 0.31 0.00 0.00 61.69 60.65 1llq s THR 290 Cb 0.04 -4.86 -0.03 0.00 0.01 0.00 0.00 72.50 67.67 1llq s THR 290 CO 0.19 -1.61 0.06 -0.32 -0.69 0.00 0.00 174.62 172.25 1llq s MET 291 N 2.85 0.71 0.10 4.92 0.00 -1.26 -0.84 119.30 125.78 1llq s MET 291 Ca 0.37 -1.13 -0.26 0.00 0.00 0.00 0.00 55.69 54.67 1llq s MET 291 Cb -0.03 0.26 0.08 0.00 0.00 0.00 0.00 34.83 35.13 1llq s MET 291 CO -0.07 -0.18 0.97 -0.59 0.00 0.00 0.00 175.02 175.16 1llq s PHE 292 N -3.90 -0.17 -0.20 4.11 -0.12 -1.09 -4.43 117.98 112.17 1llq s PHE 292 Ca 0.07 -0.09 -0.01 0.00 -0.05 0.00 0.00 56.93 56.85 1llq s PHE 292 Cb 0.07 0.61 0.06 0.00 -0.63 0.00 0.00 43.02 43.12 1llq s PHE 292 CO -0.10 -0.72 -0.02 1.21 -0.05 0.00 0.00 175.22 175.54 1llq s ASN 293 N -2.84 3.29 0.15 1.98 3.84 -1.26 -1.36 114.94 118.74 1llq s ASN 293 Ca 0.11 -0.94 -0.16 0.00 0.21 0.00 0.00 52.86 52.08 1llq s ASN 293 Cb -0.01 -0.92 0.05 0.00 -0.55 0.00 0.00 41.25 39.83 1llq s ASN 293 CO -0.01 -0.25 1.76 -0.78 -2.79 0.00 0.00 177.10 175.04 1llq h ASP 294 N 8.09 0.19 -0.92 -4.21 3.58 -1.96 -1.19 116.42 120.01 1llq h ASP 294 Ca -0.19 0.03 0.21 0.00 0.42 0.00 0.00 57.03 57.50 1llq h ASP 294 Cb 1.10 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.08 1llq h ASP 294 CO 0.38 0.15 0.61 0.44 -2.88 0.00 0.00 179.24 177.94 1llq h ASP 295 N 0.31 0.40 0.00 2.28 3.32 -1.96 0.60 116.42 121.37 1llq h ASP 295 Ca 0.16 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1llq h ASP 295 Cb 0.11 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1llq h ASP 295 CO -0.14 0.15 -0.13 0.40 -1.72 0.00 0.00 179.24 177.80 1llq h ILE 296 N 0.39 0.00 0.06 0.35 2.04 -1.84 -3.35 117.51 115.16 1llq h ILE 296 Ca 0.48 -0.37 -0.26 0.00 1.00 0.00 0.00 64.86 65.70 1llq h ILE 296 Cb 1.22 0.00 0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1llq h ILE 296 CO -0.18 0.00 -1.11 1.56 0.00 0.00 0.00 178.15 178.42 1llq h GLN 297 N -0.37 0.51 -0.15 2.37 4.20 -1.23 -2.52 115.11 117.92 1llq h GLN 297 Ca 0.00 -0.63 -0.01 0.00 0.06 0.00 0.00 58.65 58.08 1llq h GLN 297 Cb 0.13 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1llq h GLN 297 CO 0.00 1.25 0.07 0.78 -0.67 0.00 0.00 178.83 180.26 1llq h GLY 298 N 0.84 0.23 0.41 3.46 0.00 0.05 0.48 103.07 108.53 1llq h GLY 298 Ca -0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1llq h GLY 298 CO 0.20 0.11 -0.37 -0.84 0.00 0.00 0.00 176.54 175.64 1llq h THR 299 N 0.12 0.00 -0.90 4.70 2.02 -1.31 -1.10 112.91 116.44 1llq h THR 299 Ca 0.05 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.46 1llq h THR 299 Cb 0.11 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.36 1llq h THR 299 CO -0.01 0.00 -0.01 0.00 0.37 0.00 0.00 175.52 175.88 1llq h ALA 300 N -1.19 0.97 -0.33 6.16 0.00 -1.37 -1.43 119.26 122.08 1llq h ALA 300 Ca -0.05 0.31 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1llq h ALA 300 Cb 0.65 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1llq h ALA 300 CO -0.02 -0.49 0.05 1.03 0.00 0.00 0.00 179.25 179.82 1llq h SER 301 N 0.05 0.53 -0.71 0.00 0.87 -0.53 -2.41 113.55 111.34 1llq h SER 301 Ca 0.52 -0.26 -0.07 0.00 -1.23 0.00 0.00 61.79 60.74 1llq h SER 301 Cb 0.98 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.77 1llq h SER 301 CO -0.83 0.66 0.18 0.58 -0.53 0.00 0.00 176.83 176.89 1llq h VAL 302 N 0.38 1.26 -0.34 2.23 2.07 -0.16 -1.73 116.25 119.96 1llq h VAL 302 Ca 0.10 -0.97 -0.07 0.00 0.82 0.00 0.00 66.70 66.58 1llq h VAL 302 Cb 0.36 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1llq h VAL 302 CO 0.01 0.37 -0.06 0.40 0.02 0.00 0.00 177.57 178.31 1llq h ILE 303 N 1.08 1.27 -0.56 4.57 1.08 -1.40 -1.81 117.51 121.74 1llq h ILE 303 Ca 0.22 -1.10 0.01 0.00 -0.39 0.00 0.00 64.86 63.60 1llq h ILE 303 Cb 0.37 1.29 -0.03 0.00 -3.07 0.00 0.00 36.82 35.38 1llq h ILE 303 CO 0.00 0.36 0.37 0.58 -0.69 0.00 0.00 178.15 178.77 1llq h VAL 304 N 0.44 1.15 -0.01 1.67 2.07 -1.29 0.22 116.25 120.49 1llq h VAL 304 Ca 0.09 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.28 1llq h VAL 304 Cb 0.55 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1llq h VAL 304 CO 0.03 0.14 -0.28 0.00 0.02 0.00 0.00 177.57 177.48 1llq h ALA 305 N 1.65 1.51 -0.24 1.67 0.00 -0.92 0.15 119.26 123.08 1llq h ALA 305 Ca 0.21 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1llq h ALA 305 Cb -0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1llq h ALA 305 CO -0.04 0.37 -0.22 0.78 0.00 0.00 0.00 179.25 180.14 1llq h GLY 306 N 0.87 0.63 0.86 0.00 0.00 0.22 -2.40 103.07 103.26 1llq h GLY 306 Ca 0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 1llq h GLY 306 CO 0.04 0.57 0.05 1.41 0.00 0.00 0.00 176.54 178.61 1llq h LEU 307 N 0.29 0.19 -0.73 3.11 3.38 -0.67 -1.64 115.31 119.22 1llq h LEU 307 Ca 0.04 -0.18 0.14 0.00 0.09 0.00 0.00 57.88 57.97 1llq h LEU 307 Cb 0.76 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 41.37 1llq h LEU 307 CO 0.06 0.31 0.28 -0.07 0.09 0.00 0.00 178.44 179.11 1llq h LEU 308 N 0.05 0.25 -1.30 1.67 3.38 -0.71 0.48 115.31 119.13 1llq h LEU 308 Ca 0.04 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1llq h LEU 308 Cb 0.19 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1llq h LEU 308 CO -0.00 0.10 0.10 0.74 0.09 0.00 0.00 178.44 179.47 1llq h THR 309 N 0.43 1.18 -0.31 0.22 2.02 -1.08 -1.57 112.91 113.79 1llq h THR 309 Ca 0.40 -0.62 -0.05 0.00 0.77 0.00 0.00 66.41 66.91 1llq h THR 309 Cb 0.60 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 1llq h THR 309 CO -0.40 0.23 -0.03 0.00 0.37 0.00 0.00 175.52 175.68 1llq h THR 311 N 0.47 0.63 0.00 0.00 2.02 -0.04 0.26 112.91 116.25 1llq h THR 311 Ca 0.10 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1llq h THR 311 Cb 0.36 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1llq h THR 311 CO 0.01 0.10 0.14 0.03 0.37 0.00 0.00 175.52 176.18 1llq h ARG 312 N 0.53 0.00 0.00 6.66 3.08 -1.52 -0.28 114.38 122.85 1llq h ARG 312 Ca 0.49 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.48 1llq h ARG 312 Cb 0.80 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 1llq h ARG 312 CO -0.43 0.00 -1.56 0.28 -1.07 0.00 0.00 179.97 177.20 1llq n VAL 313 N -2.72 0.26 0.48 2.04 0.31 0.80 -4.49 118.33 115.01 1llq n VAL 313 Ca -0.02 -0.31 0.12 0.00 -0.01 0.00 0.00 64.34 64.12 1llq n VAL 313 Cb 0.19 -0.12 0.23 0.00 -0.91 0.00 0.00 33.84 33.23 1llq n VAL 313 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1llq n THR 314 N -2.06 0.44 -1.99 2.52 -2.24 -0.48 -4.92 114.28 105.54 1llq n THR 314 Ca -0.07 -0.68 -0.02 0.00 -2.27 0.00 0.00 64.05 61.01 1llq n THR 314 Cb 0.48 0.92 -0.00 0.00 -2.10 0.00 0.00 70.33 69.63 1llq n THR 314 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1llq n LYS 315 N 1.32 -2.24 -4.87 -0.78 4.01 -0.16 -4.87 118.16 110.57 1llq n LYS 315 Ca 0.19 0.10 -0.30 0.00 -0.51 0.00 0.00 58.31 57.78 1llq n LYS 315 Cb 0.57 -4.44 -0.17 0.00 -0.51 0.00 0.00 35.03 30.48 1llq n LYS 315 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1llq s LYS 316 N -4.01 2.70 0.84 1.97 1.02 -1.24 -5.08 119.74 115.94 1llq s LYS 316 Ca 0.00 -0.75 -0.10 0.00 0.02 0.00 0.00 55.97 55.14 1llq s LYS 316 Cb 0.00 -2.13 0.10 0.00 -0.52 0.00 0.00 37.83 35.28 1llq s LYS 316 CO 0.00 0.07 1.12 -1.17 -0.92 0.00 0.00 175.35 174.45 1llq s LEU 317 N 0.61 2.95 0.40 3.17 2.96 -1.26 -4.56 118.68 122.93 1llq s LEU 317 Ca -0.14 1.98 0.08 0.00 -0.22 0.00 0.00 54.13 55.84 1llq s LEU 317 Cb -0.17 -4.54 0.85 0.00 0.50 0.00 0.00 46.19 42.84 1llq s LEU 317 CO 0.04 -2.51 2.01 0.58 -1.32 0.00 0.00 176.35 175.15 1llq h VAL 318 N -1.46 1.04 0.00 1.68 2.07 -1.96 -1.10 116.25 116.52 1llq h VAL 318 Ca -0.43 -0.21 -0.18 0.00 0.82 0.00 0.00 66.70 66.70 1llq h VAL 318 Cb 1.25 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 1llq h VAL 318 CO 0.47 0.11 -0.97 0.77 0.02 0.00 0.00 177.57 177.97 1llq h SER 319 N 0.60 0.00 -0.33 0.57 4.64 -1.91 -3.22 113.55 113.90 1llq h SER 319 Ca 0.23 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.40 1llq h SER 319 Cb 0.16 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.16 1llq h SER 319 CO -0.06 0.77 0.19 0.00 -0.87 0.00 0.00 176.83 176.86 1llq n GLN 320 N -3.21 1.66 -4.44 4.77 6.02 -0.44 -4.87 117.38 116.88 1llq n GLN 320 Ca -0.03 -1.10 -0.21 0.00 -0.01 0.00 0.00 57.00 55.65 1llq n GLN 320 Cb 0.87 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 30.52 1llq n GLN 320 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1llq s GLU 321 N -1.29 1.65 -0.06 -1.09 2.56 -1.06 -4.58 118.70 114.83 1llq s GLU 321 Ca 0.20 -1.93 0.01 0.00 0.00 0.00 0.00 54.97 53.26 1llq s GLU 321 Cb 0.17 -0.76 0.02 0.00 2.00 0.00 0.00 34.13 35.56 1llq s GLU 321 CO 0.04 -0.23 -0.05 0.15 -0.56 0.00 0.00 175.26 174.61 1llq s LYS 322 N -3.89 0.97 0.09 4.30 1.02 -1.26 -4.85 119.74 116.12 1llq s LYS 322 Ca 0.35 -0.13 0.07 0.00 0.02 0.00 0.00 55.97 56.28 1llq s LYS 322 Cb 0.08 -0.99 -0.04 0.00 -0.52 0.00 0.00 37.83 36.36 1llq s LYS 322 CO 0.15 -0.11 -0.14 0.71 -0.92 0.00 0.00 175.35 175.05 1llq s TYR 323 N 1.06 2.65 -0.20 3.18 1.51 0.18 -0.67 117.35 125.05 1llq s TYR 323 Ca -0.09 -0.20 -0.01 0.00 -1.01 0.00 0.00 57.07 55.76 1llq s TYR 323 Cb -0.14 -1.42 0.05 0.00 -0.11 0.00 0.00 41.96 40.34 1llq s TYR 323 CO -0.01 0.38 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.62 1llq s LEU 324 N -2.01 1.83 -0.28 -1.29 2.96 0.16 -0.83 118.68 119.23 1llq s LEU 324 Ca 0.19 -0.90 -0.16 0.00 -0.22 0.00 0.00 54.13 53.04 1llq s LEU 324 Cb -0.11 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.64 1llq s LEU 324 CO 0.11 -0.24 0.41 -0.36 -1.32 0.00 0.00 176.35 174.95 1llq s PHE 325 N 1.62 3.24 -0.55 5.38 0.40 0.12 -0.54 117.98 127.66 1llq s PHE 325 Ca -0.02 0.42 -0.19 0.00 -0.60 0.00 0.00 56.93 56.54 1llq s PHE 325 Cb -0.17 -2.63 0.08 0.00 0.51 0.00 0.00 43.02 40.81 1llq s PHE 325 CO -0.07 -0.27 0.66 0.12 0.70 0.00 0.00 175.22 176.36 1llq s PHE 326 N 2.14 3.03 0.00 0.36 5.36 0.33 -1.28 117.98 127.92 1llq s PHE 326 Ca 0.16 -0.77 0.00 0.00 -0.96 0.00 0.00 56.93 55.37 1llq s PHE 326 Cb -0.16 -3.78 0.00 0.00 -0.34 0.00 0.00 43.02 38.75 1llq s PHE 326 CO 0.10 -1.16 0.00 0.41 -1.46 0.00 0.00 175.22 173.11 1llq n GLY 327 N 5.23 3.03 2.53 13.12 0.00 0.35 -1.68 105.19 127.77 1llq n GLY 327 Ca -0.08 -1.30 -0.20 0.00 0.00 0.00 0.00 46.02 44.44 1llq n GLY 327 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llq n ALA 328 N 1.12 4.48 -1.33 4.61 0.00 -0.60 -4.57 120.51 124.22 1llq n ALA 328 Ca 0.00 -3.88 0.00 0.00 0.00 0.00 0.00 53.44 49.56 1llq n ALA 328 Cb 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1llq n ALA 328 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llq n GLY 329 N -0.36 1.02 0.30 0.00 0.00 -1.26 -4.57 105.19 100.32 1llq n GLY 329 Ca 0.29 -1.66 -0.05 0.00 0.00 0.00 0.00 46.02 44.60 1llq n GLY 329 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llq h ALA 330 N -1.67 0.94 0.42 4.61 0.00 -1.97 -2.28 119.26 119.32 1llq h ALA 330 Ca 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1llq h ALA 330 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1llq h ALA 330 CO 0.00 0.46 -0.20 0.00 0.00 0.00 0.00 179.25 179.51 1llq h ALA 331 N 1.20 -0.56 -0.19 0.00 0.00 -1.92 -2.35 119.26 115.45 1llq h ALA 331 Ca 0.26 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1llq h ALA 331 Cb 0.04 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1llq h ALA 331 CO -0.04 -0.70 0.04 0.77 0.00 0.00 0.00 179.25 179.32 1llq h SER 332 N -0.78 0.30 -0.75 0.00 0.02 -1.81 -1.88 113.55 108.64 1llq h SER 332 Ca -0.06 -0.25 0.07 0.00 -0.84 0.00 0.00 61.79 60.71 1llq h SER 332 Cb 0.53 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.93 1llq h SER 332 CO 0.09 0.47 0.43 0.74 -1.14 0.00 0.00 176.83 177.43 1llq h THR 333 N 0.11 0.96 -0.28 -2.27 2.02 -1.51 0.21 112.91 112.16 1llq h THR 333 Ca 0.06 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 1llq h THR 333 Cb 0.29 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 1llq h THR 333 CO 0.00 0.14 0.11 1.23 0.37 0.00 0.00 175.52 177.37 1llq h GLY 334 N 0.77 0.44 0.99 2.16 0.00 -1.26 -1.84 103.07 104.34 1llq h GLY 334 Ca 0.34 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.41 1llq h GLY 334 CO -0.20 0.23 0.29 -2.22 0.00 0.00 0.00 176.54 174.64 1llq h ILE 335 N 0.30 1.21 0.11 2.60 2.04 -0.76 -1.64 117.51 121.36 1llq h ILE 335 Ca 0.09 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.38 1llq h ILE 335 Cb 0.18 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1llq h ILE 335 CO -0.01 0.24 -0.30 0.00 0.00 0.00 0.00 178.15 178.08 1llq h ALA 336 N 1.12 -0.50 -0.38 1.87 0.00 -0.40 0.26 119.26 121.22 1llq h ALA 336 Ca 0.21 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1llq h ALA 336 Cb 0.11 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1llq h ALA 336 CO -0.03 -0.84 0.25 0.93 0.00 0.00 0.00 179.25 179.57 1llq h GLU 337 N -0.51 0.45 -0.12 0.00 5.08 -1.18 0.99 114.58 119.29 1llq h GLU 337 Ca 0.03 -0.03 -0.20 0.00 -1.00 0.00 0.00 59.36 58.17 1llq h GLU 337 Cb 0.55 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1llq h GLU 337 CO -0.19 0.29 -0.73 0.52 -1.00 0.00 0.00 179.01 177.91 1llq h MET 338 N 0.46 0.57 -0.19 2.33 2.86 -0.55 -2.01 114.93 118.40 1llq h MET 338 Ca 0.15 -0.46 -0.02 0.00 -2.06 0.00 0.00 59.70 57.31 1llq h MET 338 Cb 0.03 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1llq h MET 338 CO -0.03 1.08 0.02 0.82 1.06 0.00 0.00 176.91 179.86 1llq h ILE 339 N 0.39 1.23 0.07 -1.22 2.04 0.70 -2.10 117.51 118.63 1llq h ILE 339 Ca -0.04 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.07 1llq h ILE 339 Cb 1.33 1.38 -0.05 0.00 -0.74 0.00 0.00 36.82 38.74 1llq h ILE 339 CO 0.14 0.23 -0.51 0.58 0.00 0.00 0.00 178.15 178.59 1llq h VAL 340 N 0.10 0.03 -1.12 1.67 2.07 -0.83 0.14 116.25 118.32 1llq h VAL 340 Ca 0.06 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.89 1llq h VAL 340 Cb 0.33 0.03 -0.08 0.00 -1.52 0.00 0.00 31.29 30.06 1llq h VAL 340 CO 0.01 0.00 0.75 -0.74 0.02 0.00 0.00 177.57 177.61 1llq h HIS 341 N -0.70 0.41 -0.25 1.57 -0.00 -1.29 0.53 115.15 115.42 1llq h HIS 341 Ca 0.01 0.01 -0.20 0.00 -0.00 0.00 0.00 60.37 60.20 1llq h HIS 341 Cb 0.73 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 28.03 1llq h HIS 341 CO -0.46 0.01 -0.62 0.37 -0.00 0.00 0.00 177.93 177.23 1llq h GLN 342 N 0.22 0.84 -0.32 5.26 5.75 -0.11 -2.77 115.11 123.98 1llq h GLN 342 Ca 0.60 -0.58 -0.01 0.00 -0.15 0.00 0.00 58.65 58.51 1llq h GLN 342 Cb 1.88 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 30.50 1llq h GLN 342 CO -0.20 1.20 0.15 0.52 -2.65 0.00 0.00 178.83 177.85 1llq h MET 343 N 0.62 0.47 -0.58 1.69 2.86 0.21 -2.80 114.93 117.40 1llq h MET 343 Ca -0.01 -0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.61 1llq h MET 343 Cb 1.23 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.76 1llq h MET 343 CO 0.13 0.44 0.31 1.96 1.06 0.00 0.00 176.91 180.81 1llq h GLN 344 N 0.39 0.58 0.00 1.72 4.20 -1.25 0.76 115.11 121.50 1llq h GLN 344 Ca 0.11 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1llq h GLN 344 Cb 0.13 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1llq h GLN 344 CO -0.01 0.38 0.00 0.09 -0.67 0.00 0.00 178.83 178.62 1llq n ASN 345 N -4.83 0.00 -0.60 1.46 3.02 -1.05 -1.70 115.26 111.56 1llq n ASN 345 Ca 0.06 -0.64 0.07 0.00 -0.03 0.00 0.00 54.58 54.04 1llq n ASN 345 Cb 0.15 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 39.41 1llq n ASN 345 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1llq n GLU 346 N -0.81 1.43 0.00 3.52 1.02 0.25 -4.98 120.64 121.08 1llq n GLU 346 Ca 0.07 -1.55 0.00 0.00 -0.02 0.00 0.00 57.16 55.66 1llq n GLU 346 Cb 0.03 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1llq n GLU 346 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1llq n GLY 347 N 0.74 2.34 3.97 0.62 0.00 -0.69 -5.10 105.19 107.08 1llq n GLY 347 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 1llq n GLY 347 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1llq s ILE 348 N -2.18 2.08 0.44 -0.61 1.01 -1.22 -5.03 121.20 115.68 1llq s ILE 348 Ca 0.00 -0.42 0.08 0.00 0.00 0.00 0.00 60.65 60.31 1llq s ILE 348 Cb 0.00 -2.66 -0.01 0.00 0.01 0.00 0.00 42.46 39.80 1llq s ILE 348 CO 0.00 0.00 0.43 -0.94 0.00 0.00 0.00 174.94 174.43 1llq s SER 349 N -4.79 5.08 0.00 3.58 1.04 -1.26 -4.32 113.70 113.03 1llq s SER 349 Ca 0.69 -0.76 0.03 0.00 0.48 0.00 0.00 55.95 56.38 1llq s SER 349 Cb -0.05 -0.44 0.15 0.00 0.10 0.00 0.00 66.02 65.78 1llq s SER 349 CO 0.47 -0.75 0.62 2.29 0.98 0.00 0.00 173.24 176.86 1llq n LYS 350 N -1.64 0.48 -0.03 4.02 2.85 -1.26 -2.95 118.16 119.64 1llq n LYS 350 Ca 0.04 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.28 1llq n LYS 350 Cb 0.62 -1.08 -0.01 0.00 -0.65 0.00 0.00 35.03 33.91 1llq n LYS 350 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1llq n GLU 351 N -0.58 0.16 -0.22 -1.58 1.02 -1.26 -3.43 120.64 114.74 1llq n GLU 351 Ca 0.02 0.30 0.06 0.00 -0.02 0.00 0.00 57.16 57.52 1llq n GLU 351 Cb 0.01 -1.03 0.32 0.00 -0.02 0.00 0.00 31.44 30.72 1llq n GLU 351 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1llq h GLU 352 N -0.34 0.80 0.01 3.49 5.08 -1.96 -0.97 114.58 120.68 1llq h GLU 352 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1llq h GLU 352 Cb 0.20 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1llq h GLU 352 CO 0.00 0.53 -0.02 0.00 -1.00 0.00 0.00 179.01 178.52 1llq h ALA 353 N 1.58 -0.60 -0.01 3.43 0.00 -1.73 -1.38 119.26 120.54 1llq h ALA 353 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1llq h ALA 353 Cb 0.28 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1llq h ALA 353 CO -0.12 -0.61 0.02 0.00 0.00 0.00 0.00 179.25 178.54 1llq n ASN 355 N -3.94 0.00 -0.78 0.00 4.05 -0.38 -2.86 115.26 111.35 1llq n ASN 355 Ca -0.03 -0.89 0.07 0.00 0.45 0.00 0.00 54.58 54.19 1llq n ASN 355 Cb 0.10 -0.03 0.16 0.00 1.23 0.00 0.00 39.78 41.24 1llq n ASN 355 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1llq n ARG 356 N -1.03 2.31 -4.43 1.20 1.74 0.23 -4.93 116.66 111.74 1llq n ARG 356 Ca 0.22 -1.98 -0.31 0.00 -0.77 0.00 0.00 57.85 55.01 1llq n ARG 356 Cb 0.12 -1.34 -0.17 0.00 -1.02 0.00 0.00 32.46 30.06 1llq n ARG 356 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1llq s ILE 357 N -1.07 1.75 -0.23 0.55 1.01 -1.13 -0.65 121.20 121.43 1llq s ILE 357 Ca 0.27 -0.78 -0.02 0.00 0.00 0.00 0.00 60.65 60.12 1llq s ILE 357 Cb 0.15 -1.59 0.01 0.00 0.01 0.00 0.00 42.46 41.05 1llq s ILE 357 CO 0.20 0.49 -0.08 -0.31 0.00 0.00 0.00 174.94 175.25 1llq s TYR 358 N 1.04 2.98 -0.02 3.97 1.51 -0.01 -4.88 117.35 121.94 1llq s TYR 358 Ca -0.04 -1.38 -0.01 0.00 -1.01 0.00 0.00 57.07 54.63 1llq s TYR 358 Cb -0.15 -2.05 -0.04 0.00 -0.11 0.00 0.00 41.96 39.62 1llq s TYR 358 CO -0.04 -0.69 0.08 -0.51 -1.11 0.00 0.00 175.55 173.28 1llq s LEU 359 N 1.37 3.93 0.00 -1.29 1.43 -1.26 0.16 118.68 123.01 1llq s LEU 359 Ca 0.03 0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 1llq s LEU 359 Cb -0.15 -2.23 -0.00 0.00 0.03 0.00 0.00 46.19 43.84 1llq s LEU 359 CO -0.06 0.29 -0.03 -0.04 0.23 0.00 0.00 176.35 176.74 1llq s MET 360 N -1.60 0.27 0.00 1.70 -1.94 -0.40 -2.21 119.30 115.12 1llq s MET 360 Ca 0.21 -0.17 0.00 0.00 -1.71 0.00 0.00 55.69 54.02 1llq s MET 360 Cb -0.12 -0.23 0.00 0.00 2.01 0.00 0.00 34.83 36.49 1llq s MET 360 CO 0.12 0.06 0.00 -0.40 -0.01 0.00 0.00 175.02 174.79 1llq n ASP 361 N 2.85 0.54 0.14 3.03 5.75 -0.91 0.13 116.55 128.09 1llq n ASP 361 Ca -0.14 0.00 -0.01 0.00 -0.01 0.00 0.00 54.79 54.64 1llq n ASP 361 Cb 0.58 0.00 0.21 0.00 -1.03 0.00 0.00 41.12 40.88 1llq n ASP 361 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1llq h ILE 362 N 0.00 1.40 -1.80 2.12 2.10 -1.99 -3.23 117.51 116.11 1llq h ILE 362 Ca 0.00 -1.94 -0.75 0.00 1.08 0.00 0.00 64.86 63.25 1llq h ILE 362 Cb 0.00 2.04 -0.22 0.00 -1.09 0.00 0.00 36.82 37.55 1llq h ILE 362 CO 0.00 0.55 1.31 0.47 -1.08 0.00 0.00 178.15 179.40 1llq n ASP 363 N -3.87 7.47 -0.32 2.19 8.00 -1.26 -5.02 116.55 123.75 1llq n ASP 363 Ca -0.01 -3.53 0.00 0.00 0.71 0.00 0.00 54.79 51.96 1llq n ASP 363 Cb 0.57 -1.20 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 1llq n ASP 363 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1llq n GLY 364 N 0.39 0.33 3.26 0.44 0.00 -1.22 -4.84 105.19 103.55 1llq n GLY 364 Ca 0.52 -0.87 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 1llq n GLY 364 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1llq n LEU 365 N 0.00 -1.57 -4.21 0.99 7.94 -0.91 -2.14 117.00 117.11 1llq n LEU 365 Ca 0.00 -0.38 -0.41 0.00 -1.11 0.00 0.00 56.01 54.10 1llq n LEU 365 Cb 0.00 -1.01 -0.07 0.00 0.53 0.00 0.00 43.42 42.87 1llq n LEU 365 CO 0.00 -3.57 0.11 -0.69 -1.11 0.00 0.00 177.39 172.13 1llq s VAL 366 N -2.22 4.41 -0.13 1.96 1.01 -0.94 -4.73 120.40 119.77 1llq s VAL 366 Ca 0.59 -2.32 -0.08 0.00 0.00 0.00 0.00 61.98 60.16 1llq s VAL 366 Cb -0.15 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1llq s VAL 366 CO 0.58 -0.87 0.16 0.42 0.00 0.00 0.00 175.10 175.38 1llq s THR 367 N 0.62 5.45 -0.19 3.92 -4.23 -1.26 -1.02 115.64 118.94 1llq s THR 367 Ca 0.12 0.25 0.12 0.00 -1.18 0.00 0.00 61.69 61.00 1llq s THR 367 Cb -0.20 -3.44 0.12 0.00 1.34 0.00 0.00 72.50 70.31 1llq s THR 367 CO -0.04 0.57 1.27 0.29 -0.54 0.00 0.00 174.62 176.17 1llq n LYS 368 N 2.39 0.08 0.00 3.99 5.02 -0.51 -0.28 118.16 128.85 1llq n LYS 368 Ca -0.18 0.53 0.07 0.00 -2.02 0.00 0.00 58.31 56.71 1llq n LYS 368 Cb 0.54 -1.96 0.40 0.00 -0.02 0.00 0.00 35.03 33.99 1llq n LYS 368 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1llq n ASN 369 N -1.93 0.00 -4.42 4.39 3.02 -1.26 -4.90 115.26 110.15 1llq n ASN 369 Ca -0.01 -1.53 -0.32 0.00 -0.03 0.00 0.00 54.58 52.69 1llq n ASN 369 Cb 0.22 0.00 0.16 0.00 -0.61 0.00 0.00 39.78 39.55 1llq n ASN 369 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1llq n ARG 370 N -0.72 -0.88 -4.04 3.52 5.12 0.61 -5.06 116.66 115.22 1llq n ARG 370 Ca 0.10 -0.22 -0.19 0.00 -1.93 0.00 0.00 57.85 55.61 1llq n ARG 370 Cb 0.05 -1.93 -0.16 0.00 -1.16 0.00 0.00 32.46 29.26 1llq n ARG 370 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1llq s LYS 371 N -3.82 0.60 -0.85 5.56 1.02 -1.26 -4.90 119.74 116.09 1llq s LYS 371 Ca 0.59 -0.01 -0.04 0.00 0.02 0.00 0.00 55.97 56.53 1llq s LYS 371 Cb -0.19 -0.71 -0.01 0.00 -0.52 0.00 0.00 37.83 36.39 1llq s LYS 371 CO 0.65 -0.12 0.72 0.39 -0.92 0.00 0.00 175.35 176.07 1llq n GLU 372 N 4.19 -1.45 -3.78 1.68 1.02 -1.26 -5.02 120.64 116.01 1llq n GLU 372 Ca -0.24 1.11 -0.23 0.00 -0.02 0.00 0.00 57.16 57.78 1llq n GLU 372 Cb 0.51 -4.74 -0.03 0.00 -0.02 0.00 0.00 31.44 27.15 1llq n GLU 372 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1llq s MET 373 N -4.03 2.37 0.09 3.49 0.23 -1.26 -5.10 119.30 115.09 1llq s MET 373 Ca 0.12 -1.76 -0.29 0.00 -1.03 0.00 0.00 55.69 52.73 1llq s MET 373 Cb -0.03 -2.20 -0.05 0.00 -1.53 0.00 0.00 34.83 31.01 1llq s MET 373 CO 0.80 -0.32 0.94 1.21 -2.03 0.00 0.00 175.02 175.62 1llq s ASN 374 N -4.13 7.45 0.31 -1.18 3.84 -1.26 -4.95 114.94 115.01 1llq s ASN 374 Ca 0.42 1.74 0.06 0.00 0.21 0.00 0.00 52.86 55.29 1llq s ASN 374 Cb -0.01 -2.57 0.73 0.00 -0.55 0.00 0.00 41.25 38.85 1llq s ASN 374 CO 0.25 -0.08 1.79 -0.65 -2.79 0.00 0.00 177.10 175.61 1llq h PRO 375 N 5.76 0.75 -0.37 0.43 0.11 -2.01 -0.61 132.00 136.06 1llq h PRO 375 Ca -0.43 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 1llq h PRO 375 Cb 1.21 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1llq h PRO 375 CO 0.72 0.50 -0.14 0.00 -0.21 0.00 0.00 178.00 178.87 1llq h ARG 376 N 0.78 0.67 0.09 1.05 3.08 -2.03 -3.19 114.38 114.83 1llq h ARG 376 Ca 0.57 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.39 1llq h ARG 376 Cb 0.86 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1llq h ARG 376 CO -0.36 0.78 -0.04 0.45 -1.07 0.00 0.00 179.97 179.73 1llq h HIS 377 N 0.61 -0.12 -0.31 3.04 3.86 -1.52 -3.34 115.15 117.36 1llq h HIS 377 Ca 0.10 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.34 1llq h HIS 377 Cb 0.59 0.04 -0.04 0.00 1.06 0.00 0.00 27.41 29.06 1llq h HIS 377 CO 0.03 0.12 -0.19 0.28 0.86 0.00 0.00 177.93 179.03 1llq n VAL 378 N -5.04 -0.21 0.00 2.45 0.31 -0.90 0.15 118.33 115.08 1llq n VAL 378 Ca -0.08 0.77 0.00 0.00 -0.01 0.00 0.00 64.34 65.02 1llq n VAL 378 Cb 0.16 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 32.14 1llq n VAL 378 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1llq n GLN 379 N -4.36 0.00 -0.00 5.55 10.64 -1.25 -0.57 117.38 127.38 1llq n GLN 379 Ca 0.01 0.36 0.04 0.00 -1.83 0.00 0.00 57.00 55.58 1llq n GLN 379 Cb 0.08 -1.54 -0.06 0.00 -0.86 0.00 0.00 30.24 27.87 1llq n GLN 379 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1llq n PHE 380 N -1.35 0.00 -1.69 2.61 3.01 0.39 -4.82 117.46 115.61 1llq n PHE 380 Ca 0.00 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 58.02 1llq n PHE 380 Cb 0.04 -0.05 -0.03 0.00 -0.01 0.00 0.00 39.48 39.43 1llq n PHE 380 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1llq n ALA 381 N -1.37 1.58 -2.86 4.37 0.00 0.26 -4.67 120.51 117.82 1llq n ALA 381 Ca 0.01 0.41 -0.32 0.00 0.00 0.00 0.00 53.44 53.54 1llq n ALA 381 Cb 0.17 -2.35 -0.04 0.00 0.00 0.00 0.00 19.45 17.22 1llq n ALA 381 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1llq s LYS 382 N -0.03 3.48 -0.45 0.00 -0.14 -0.18 -4.72 119.74 117.70 1llq s LYS 382 Ca 0.70 -0.31 -0.04 0.00 -1.36 0.00 0.00 55.97 54.96 1llq s LYS 382 Cb -0.62 -3.04 0.06 0.00 -1.68 0.00 0.00 37.83 32.56 1llq s LYS 382 CO 0.46 0.62 2.76 -3.47 -0.76 0.00 0.00 175.35 174.96 1llq n ASP 383 N 0.57 6.46 -4.60 2.83 2.03 -1.26 -1.42 116.55 121.17 1llq n ASP 383 Ca -0.07 -3.20 -0.30 0.00 0.52 0.00 0.00 54.79 51.74 1llq n ASP 383 Cb 0.52 -1.23 -0.08 0.00 -0.72 0.00 0.00 41.12 39.60 1llq n ASP 383 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1llq s MET 384 N -1.70 2.08 0.82 -0.67 0.23 -1.26 -5.02 119.30 113.78 1llq s MET 384 Ca 0.58 -2.29 -0.13 0.00 -1.03 0.00 0.00 55.69 52.82 1llq s MET 384 Cb 0.38 -1.33 0.06 0.00 -1.53 0.00 0.00 34.83 32.42 1llq s MET 384 CO -0.22 -0.33 1.01 -0.35 -2.03 0.00 0.00 175.02 173.10 1llq n PRO 385 N -1.12 0.11 -3.07 3.16 -0.04 -1.26 -4.81 135.00 127.97 1llq n PRO 385 Ca -0.14 0.11 -0.44 0.00 -0.04 0.00 0.00 63.50 62.99 1llq n PRO 385 Cb 0.67 -2.28 -0.05 0.00 -0.04 0.00 0.00 33.50 31.79 1llq n PRO 385 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1llq s GLU 386 N -3.89 3.15 0.42 0.54 8.01 -1.26 -4.93 118.70 120.74 1llq s GLU 386 Ca 0.70 -0.83 0.07 0.00 0.01 0.00 0.00 54.97 54.92 1llq s GLU 386 Cb -0.29 -4.12 -0.07 0.00 -4.31 0.00 0.00 34.13 25.34 1llq s GLU 386 CO 0.54 -1.37 0.07 -0.08 0.01 0.00 0.00 175.26 174.43 1llq s THR 387 N 3.00 2.05 0.00 3.63 -1.32 -1.26 -5.03 115.64 116.72 1llq s THR 387 Ca 0.18 -1.90 0.00 0.00 -1.21 0.00 0.00 61.69 58.76 1llq s THR 387 Cb -0.18 -2.95 0.00 0.00 -1.51 0.00 0.00 72.50 67.86 1llq s THR 387 CO 0.12 0.00 0.00 0.41 -2.21 0.00 0.00 174.62 172.94 1llq n THR 388 N -1.08 0.00 -2.85 5.08 -1.04 -1.26 -2.15 114.28 110.98 1llq n THR 388 Ca -0.04 -0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.56 1llq n THR 388 Cb 0.66 0.27 -0.05 0.00 -1.82 0.00 0.00 70.33 69.39 1llq n THR 388 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1llq s SER 389 N -1.06 7.39 0.12 8.00 0.15 -1.26 -4.85 113.70 122.19 1llq s SER 389 Ca 0.00 1.66 -0.16 0.00 0.70 0.00 0.00 55.95 58.15 1llq s SER 389 Cb 0.00 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1llq s SER 389 CO 0.00 0.02 1.60 0.40 1.20 0.00 0.00 173.24 176.46 1llq h ILE 390 N 3.91 1.24 -0.82 6.45 2.04 -1.96 -2.74 117.51 125.61 1llq h ILE 390 Ca -0.44 -0.84 0.14 0.00 1.00 0.00 0.00 64.86 64.72 1llq h ILE 390 Cb 1.21 1.06 -0.09 0.00 -0.74 0.00 0.00 36.82 38.26 1llq h ILE 390 CO 0.70 0.29 0.42 -0.07 0.00 0.00 0.00 178.15 179.49 1llq h LEU 391 N 0.47 0.51 -0.89 1.44 3.38 -1.94 0.69 115.31 118.98 1llq h LEU 391 Ca 0.11 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1llq h LEU 391 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1llq h LEU 391 CO 0.01 0.23 0.00 -0.62 0.09 0.00 0.00 178.44 178.15 1llq n GLU 392 N -4.87 0.19 -0.12 1.13 1.02 -1.05 -0.71 120.64 116.23 1llq n GLU 392 Ca 0.16 0.48 -0.18 0.00 -0.02 0.00 0.00 57.16 57.60 1llq n GLU 392 Cb 0.40 -1.90 -0.12 0.00 -0.02 0.00 0.00 31.44 29.80 1llq n GLU 392 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1llq n VAL 393 N -2.26 1.50 -0.05 2.62 0.31 0.12 -3.39 118.33 117.18 1llq n VAL 393 Ca 0.01 -0.59 -0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1llq n VAL 393 Cb 0.19 -1.38 0.29 0.00 -0.91 0.00 0.00 33.84 32.02 1llq n VAL 393 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1llq h ILE 394 N 0.00 1.19 0.00 2.52 2.04 0.43 -1.96 117.51 121.73 1llq h ILE 394 Ca -0.57 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 64.57 1llq h ILE 394 Cb 1.93 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.76 1llq h ILE 394 CO -0.07 0.25 -0.23 -0.09 0.00 0.00 0.00 178.15 178.01 1llq h ARG 395 N 0.62 0.00 0.00 2.37 9.65 -1.10 -1.77 114.38 124.15 1llq h ARG 395 Ca 0.14 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 1llq h ARG 395 Cb 0.23 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.81 1llq h ARG 395 CO -0.00 0.23 -0.13 0.00 2.80 0.00 0.00 179.97 182.86 1llq h ALA 396 N 1.77 0.00 -0.03 2.80 0.00 -1.41 -3.38 119.26 119.01 1llq h ALA 396 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1llq h ALA 396 Cb 1.17 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1llq h ALA 396 CO 0.03 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.41 1llq n ALA 397 N -2.96 2.53 -3.13 0.00 0.00 -0.80 -4.99 120.51 111.15 1llq n ALA 397 Ca -0.02 -0.55 -0.12 0.00 0.00 0.00 0.00 53.44 52.75 1llq n ALA 397 Cb 0.07 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1llq n ALA 397 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1llq n ARG 398 N 0.67 -0.70 -1.92 0.00 1.74 -0.66 -4.86 116.66 110.92 1llq n ARG 398 Ca 0.17 0.30 -0.33 0.00 -0.77 0.00 0.00 57.85 57.22 1llq n ARG 398 Cb 0.46 -0.98 0.03 0.00 -1.02 0.00 0.00 32.46 30.94 1llq n ARG 398 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1llq s PRO 399 N -3.50 3.07 0.12 5.56 0.04 -1.26 -4.96 135.00 134.08 1llq s PRO 399 Ca 0.01 1.33 0.25 0.00 0.04 0.00 0.00 61.00 62.62 1llq s PRO 399 Cb -0.01 -1.99 0.45 0.00 0.04 0.00 0.00 34.50 33.00 1llq s PRO 399 CO 0.41 -1.02 1.41 0.41 0.04 0.00 0.00 177.00 178.25 1llq n GLY 400 N -0.67 -1.45 2.90 0.56 0.00 0.15 -4.86 105.19 101.83 1llq n GLY 400 Ca 0.10 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 1llq n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llq s ALA 401 N -3.14 -0.11 -0.18 4.61 0.00 -0.90 -2.10 121.76 119.95 1llq s ALA 401 Ca 0.08 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1llq s ALA 401 Cb 0.14 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.13 1llq s ALA 401 CO 0.69 -0.05 -0.17 -1.17 0.00 0.00 0.00 175.76 175.07 1llq s LEU 402 N 0.27 2.29 -0.17 0.00 2.96 0.16 -0.67 118.68 123.52 1llq s LEU 402 Ca -0.02 -0.58 0.01 0.00 -0.22 0.00 0.00 54.13 53.32 1llq s LEU 402 Cb -0.03 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.15 1llq s LEU 402 CO -0.01 0.02 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.22 1llq s ILE 403 N 1.20 1.97 -0.25 6.68 1.01 0.30 -0.94 121.20 131.17 1llq s ILE 403 Ca 0.02 -0.88 -0.10 0.00 0.00 0.00 0.00 60.65 59.68 1llq s ILE 403 Cb -0.14 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.50 1llq s ILE 403 CO -0.08 0.53 0.16 -0.83 0.00 0.00 0.00 174.94 174.71 1llq s GLY 404 N 1.31 1.95 -0.42 6.18 0.00 0.43 -0.51 107.32 116.26 1llq s GLY 404 Ca 0.05 -0.96 0.07 0.00 0.00 0.00 0.00 44.72 43.87 1llq s GLY 404 CO -0.12 0.47 0.56 0.00 0.00 0.00 0.00 173.10 174.01 1llq n ALA 405 N 4.55 1.47 -3.63 3.20 0.00 -0.68 0.41 120.51 125.83 1llq n ALA 405 Ca -0.15 -2.76 -0.05 0.00 0.00 0.00 0.00 53.44 50.48 1llq n ALA 405 Cb 0.52 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.96 1llq n ALA 405 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1llq s SER 406 N -0.81 -0.93 0.00 0.00 1.04 -1.25 -4.40 113.70 107.35 1llq s SER 406 Ca 0.34 1.43 0.00 0.00 0.48 0.00 0.00 55.95 58.19 1llq s SER 406 Cb 0.14 1.57 0.00 0.00 0.10 0.00 0.00 66.02 67.82 1llq s SER 406 CO -0.15 -0.22 0.00 0.41 0.98 0.00 0.00 173.24 174.26 1llq n THR 407 N 4.50 0.00 -1.66 2.02 -1.04 -1.26 -4.64 114.28 112.20 1llq n THR 407 Ca -0.18 0.00 -0.65 0.00 -2.04 0.00 0.00 64.05 61.18 1llq n THR 407 Cb 0.57 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.98 1llq n THR 407 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1llq n VAL 408 N -3.62 0.04 -2.83 12.58 0.24 -1.26 -4.78 118.33 118.70 1llq n VAL 408 Ca 0.00 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.34 61.96 1llq n VAL 408 Cb 0.00 -0.59 -0.07 0.00 -1.47 0.00 0.00 33.84 31.71 1llq n VAL 408 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1llq s ARG 409 N 3.58 4.17 -1.36 7.34 3.52 -1.25 -3.87 118.95 131.07 1llq s ARG 409 Ca 1.07 1.04 -0.15 0.00 -0.13 0.00 0.00 55.73 57.55 1llq s ARG 409 Cb -1.45 -2.21 0.14 0.00 -1.56 0.00 0.00 34.95 29.87 1llq s ARG 409 CO 0.77 -0.03 0.49 0.41 -0.81 0.00 0.00 175.30 176.14 1llq n GLY 410 N -0.69 -0.45 0.21 8.12 0.00 -0.61 -4.79 105.19 106.98 1llq n GLY 410 Ca 0.06 0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.23 1llq n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llq h ALA 411 N 0.93 1.11 -2.58 4.61 0.00 -0.62 -3.35 119.26 119.35 1llq h ALA 411 Ca -0.44 -0.26 -0.77 0.00 0.00 0.00 0.00 54.91 53.44 1llq h ALA 411 Cb 1.29 -0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.79 1llq h ALA 411 CO 0.62 0.36 0.32 -0.06 0.00 0.00 0.00 179.25 180.50 1llq s PHE 412 N -3.81 3.66 0.73 0.00 2.99 0.52 -4.99 117.98 117.08 1llq s PHE 412 Ca -0.01 -1.93 -0.10 0.00 0.00 0.00 0.00 56.93 54.89 1llq s PHE 412 Cb 0.12 -3.94 0.05 0.00 0.00 0.00 0.00 43.02 39.25 1llq s PHE 412 CO 0.66 -1.11 1.09 0.54 -0.00 0.00 0.00 175.22 176.40 1llq s ASN 413 N 2.42 4.98 0.32 1.36 2.20 -1.26 -4.64 114.94 120.33 1llq s ASN 413 Ca 0.23 0.82 0.10 0.00 -0.94 0.00 0.00 52.86 53.07 1llq s ASN 413 Cb -0.09 -1.50 0.94 0.00 -2.00 0.00 0.00 41.25 38.61 1llq s ASN 413 CO -0.09 -1.57 1.68 -0.08 -2.94 0.00 0.00 177.10 174.10 1llq h GLU 414 N -0.74 0.36 -0.32 3.55 4.81 -1.96 0.39 114.58 120.68 1llq h GLU 414 Ca -0.45 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 58.69 1llq h GLU 414 Cb 1.29 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.58 1llq h GLU 414 CO 0.64 0.24 -0.08 0.93 -0.73 0.00 0.00 179.01 180.01 1llq h GLU 415 N 0.37 0.52 -0.05 1.92 5.08 -1.97 0.26 114.58 120.71 1llq h GLU 415 Ca 0.66 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.87 1llq h GLU 415 Cb 1.41 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.59 1llq h GLU 415 CO -0.58 0.60 -0.04 0.28 -1.00 0.00 0.00 179.01 178.28 1llq h VAL 416 N 0.49 1.35 -0.14 3.13 2.07 -0.60 -2.46 116.25 120.08 1llq h VAL 416 Ca 0.10 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.47 1llq h VAL 416 Cb 0.44 1.99 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1llq h VAL 416 CO 0.02 0.30 -0.03 0.40 0.02 0.00 0.00 177.57 178.29 1llq h ILE 417 N -0.30 1.28 -0.90 4.57 2.04 -1.17 -2.88 117.51 120.15 1llq h ILE 417 Ca 0.01 -0.95 0.15 0.00 1.00 0.00 0.00 64.86 65.07 1llq h ILE 417 Cb 0.50 1.62 -0.07 0.00 -0.74 0.00 0.00 36.82 38.13 1llq h ILE 417 CO 0.01 0.28 0.58 0.03 0.00 0.00 0.00 178.15 179.05 1llq h ARG 418 N -0.02 0.65 0.00 2.37 2.47 -0.53 0.18 114.38 119.49 1llq h ARG 418 Ca 0.04 -0.04 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 1llq h ARG 418 Cb 0.44 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.60 1llq h ARG 418 CO 0.01 0.43 -0.33 0.00 0.56 0.00 0.00 179.97 180.64 1llq h ALA 419 N 1.60 1.19 0.06 0.04 0.00 -1.28 -2.01 119.26 118.86 1llq h ALA 419 Ca 0.46 -0.30 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1llq h ALA 419 Cb 0.78 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.53 1llq h ALA 419 CO -0.21 0.42 -0.59 0.52 0.00 0.00 0.00 179.25 179.38 1llq h MET 420 N 0.00 0.30 0.00 0.00 2.86 -0.50 -2.67 114.93 114.92 1llq h MET 420 Ca -0.00 -0.40 -0.01 0.00 -2.06 0.00 0.00 59.70 57.23 1llq h MET 420 Cb 0.71 0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.50 1llq h MET 420 CO 0.04 1.12 -0.04 0.00 1.06 0.00 0.00 176.91 179.10 1llq h ALA 421 N 0.19 1.88 -0.05 6.32 0.00 -1.13 0.22 119.26 126.69 1llq h ALA 421 Ca -0.09 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.58 1llq h ALA 421 Cb 1.37 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.17 1llq h ALA 421 CO 0.11 0.05 -0.78 0.93 0.00 0.00 0.00 179.25 179.56 1llq h GLU 422 N 0.00 0.62 0.00 0.00 5.08 -1.38 -3.30 114.58 115.60 1llq h GLU 422 Ca -0.00 -0.60 -0.03 0.00 -1.00 0.00 0.00 59.36 57.73 1llq h GLU 422 Cb 0.07 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1llq h GLU 422 CO 0.00 1.21 -0.35 0.82 -1.00 0.00 0.00 179.01 179.70 1llq h ILE 423 N 0.25 0.18 -3.62 3.13 2.04 -1.05 -3.46 117.51 114.98 1llq h ILE 423 Ca -0.08 -1.27 -0.41 0.00 1.00 0.00 0.00 64.86 64.10 1llq h ILE 423 Cb 1.45 1.99 -0.32 0.00 -0.74 0.00 0.00 36.82 39.19 1llq h ILE 423 CO 0.16 0.10 -0.78 0.20 0.00 0.00 0.00 178.15 177.84 1llq s ASN 424 N -6.08 0.99 0.24 1.72 0.01 0.72 -5.02 114.94 107.51 1llq s ASN 424 Ca 0.05 -0.15 -0.05 0.00 -0.71 0.00 0.00 52.86 52.00 1llq s ASN 424 Cb 0.06 -0.38 0.40 0.00 0.41 0.00 0.00 41.25 41.75 1llq s ASN 424 CO 0.71 -0.00 1.78 -0.33 -1.51 0.00 0.00 177.10 177.76 1llq h GLU 425 N 6.79 0.64 -2.49 -0.60 5.08 -1.85 -3.27 114.58 118.88 1llq h GLU 425 Ca -0.35 -0.04 -0.59 0.00 -1.00 0.00 0.00 59.36 57.37 1llq h GLU 425 Cb 1.16 -0.15 -0.39 0.00 0.50 0.00 0.00 28.75 29.88 1llq h GLU 425 CO 0.48 0.43 -0.91 1.03 -1.00 0.00 0.00 179.01 179.04 1llq s ARG 426 N -6.03 1.11 0.40 2.33 1.81 -1.26 -4.81 118.95 112.50 1llq s ARG 426 Ca -0.12 -2.24 -0.26 0.00 -1.72 0.00 0.00 55.73 51.38 1llq s ARG 426 Cb 0.19 -1.71 -0.09 0.00 -0.45 0.00 0.00 34.95 32.89 1llq s ARG 426 CO 0.77 -1.36 1.30 -1.25 -0.68 0.00 0.00 175.30 174.09 1llq s PRO 427 N -0.10 4.01 -0.35 3.54 0.04 -1.23 -4.64 135.00 136.27 1llq s PRO 427 Ca 0.31 2.16 -0.18 0.00 0.04 0.00 0.00 61.00 63.33 1llq s PRO 427 Cb 0.01 -2.79 -0.00 0.00 0.04 0.00 0.00 34.50 31.75 1llq s PRO 427 CO -0.18 -0.46 0.51 0.42 0.04 0.00 0.00 177.00 177.33 1llq s ILE 428 N -1.25 5.02 -0.23 0.56 1.01 -0.89 -1.03 121.20 124.38 1llq s ILE 428 Ca 0.56 0.34 0.02 0.00 0.00 0.00 0.00 60.65 61.57 1llq s ILE 428 Cb -0.38 -3.96 0.05 0.00 0.01 0.00 0.00 42.46 38.17 1llq s ILE 428 CO 0.49 -0.21 -0.12 -0.63 0.00 0.00 0.00 174.94 174.47 1llq s ILE 429 N 2.39 2.01 -0.19 2.92 1.01 0.10 0.39 121.20 129.83 1llq s ILE 429 Ca 0.19 -1.37 -0.00 0.00 0.00 0.00 0.00 60.65 59.46 1llq s ILE 429 Cb -0.15 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.26 1llq s ILE 429 CO 0.13 0.10 -0.17 -0.36 0.00 0.00 0.00 174.94 174.65 1llq s PHE 430 N 1.21 2.82 -0.57 3.97 0.40 -0.12 -2.71 117.98 122.98 1llq s PHE 430 Ca -0.05 -1.48 -0.03 0.00 -0.60 0.00 0.00 56.93 54.77 1llq s PHE 430 Cb -0.18 -1.96 0.15 0.00 0.51 0.00 0.00 43.02 41.54 1llq s PHE 430 CO -0.07 -0.75 0.38 0.00 0.70 0.00 0.00 175.22 175.49 1llq s ALA 431 N 1.32 3.48 0.12 5.36 0.00 -0.72 0.16 121.76 131.47 1llq s ALA 431 Ca 0.05 -3.09 0.07 0.00 0.00 0.00 0.00 51.96 48.99 1llq s ALA 431 Cb -0.13 -2.60 -0.21 0.00 0.00 0.00 0.00 23.12 20.18 1llq s ALA 431 CO -0.11 -2.03 1.28 -0.07 0.00 0.00 0.00 175.76 174.83 1llq h LEU 432 N 7.27 0.00 -9.14 0.00 4.07 -0.31 -2.74 115.31 114.47 1llq h LEU 432 Ca -0.04 -0.00 -0.74 0.00 0.08 0.00 0.00 57.88 57.17 1llq h LEU 432 Cb 0.97 -0.00 0.05 0.00 1.08 0.00 0.00 40.66 42.76 1llq h LEU 432 CO 0.71 1.00 0.32 -1.20 -1.08 0.00 0.00 178.44 178.20 1llq n SER 433 N -3.35 0.97 -4.58 -0.43 7.64 -1.22 -3.35 113.62 109.31 1llq n SER 433 Ca -0.00 1.14 -0.29 0.00 1.01 0.00 0.00 58.87 60.73 1llq n SER 433 Cb 0.94 -1.06 -0.10 0.00 -1.01 0.00 0.00 64.21 62.98 1llq n SER 433 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1llq s ASN 434 N 0.53 4.37 0.53 6.43 0.01 -1.26 -3.80 114.94 121.74 1llq s ASN 434 Ca 0.89 -0.45 0.00 0.00 -0.71 0.00 0.00 52.86 52.59 1llq s ASN 434 Cb -1.11 -0.81 0.00 0.00 0.41 0.00 0.00 41.25 39.74 1llq s ASN 434 CO 0.53 0.15 0.00 -2.65 -1.51 0.00 0.00 177.10 173.62 1llq n PRO 435 N 0.45 0.60 -0.24 -0.60 -0.02 -1.26 -4.80 135.00 129.13 1llq n PRO 435 Ca -0.12 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.41 1llq n PRO 435 Cb 0.53 0.00 0.17 0.00 -0.02 0.00 0.00 33.50 34.18 1llq n PRO 435 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1llq h THR 436 N -0.53 0.50 0.00 3.45 1.35 -1.91 0.29 112.91 116.07 1llq h THR 436 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1llq h THR 436 Cb 0.00 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 66.66 1llq h THR 436 CO 0.00 0.04 0.00 -1.54 -0.25 0.00 0.00 175.52 173.77 1llq n SER 437 N -5.18 0.01 0.00 5.36 3.41 -1.26 -0.27 113.62 115.69 1llq n SER 437 Ca 0.13 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1llq n SER 437 Cb 0.45 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1llq n SER 437 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1llq n LYS 438 N -0.34 0.00 -2.09 4.33 5.02 0.08 -4.83 118.16 120.33 1llq n LYS 438 Ca 0.00 -0.42 -0.42 0.00 -2.02 0.00 0.00 58.31 55.45 1llq n LYS 438 Cb 0.00 -0.43 -0.03 0.00 -0.02 0.00 0.00 35.03 34.55 1llq n LYS 438 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1llq s ALA 439 N 0.00 3.64 0.47 7.82 0.00 0.63 -3.91 121.76 130.42 1llq s ALA 439 Ca 0.00 1.22 0.35 0.00 0.00 0.00 0.00 51.96 53.52 1llq s ALA 439 Cb 0.00 -3.56 1.50 0.00 0.00 0.00 0.00 23.12 21.06 1llq s ALA 439 CO 0.00 -0.67 1.63 0.93 0.00 0.00 0.00 175.76 177.66 1llq h GLU 440 N 6.42 0.07 -1.27 0.00 3.07 -1.83 -1.63 114.58 119.39 1llq h GLU 440 Ca -0.43 -0.00 0.16 0.00 -0.50 0.00 0.00 59.36 58.58 1llq h GLU 440 Cb 1.21 -0.01 -0.28 0.00 -0.84 0.00 0.00 28.75 28.82 1llq h GLU 440 CO 0.86 0.04 0.75 0.00 -1.40 0.00 0.00 179.01 179.26 1llq n THR 442 N 1.27 0.00 0.00 0.00 -2.24 -1.26 -4.78 114.28 107.27 1llq n THR 442 Ca -0.08 -0.57 -0.19 0.00 -2.27 0.00 0.00 64.05 60.94 1llq n THR 442 Cb 0.57 -1.38 -0.14 0.00 -2.10 0.00 0.00 70.33 67.29 1llq n THR 442 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llq h ALA 443 N -2.25 0.03 -0.96 6.98 0.00 -1.98 -2.27 119.26 118.80 1llq h ALA 443 Ca -0.34 -0.80 0.21 0.00 0.00 0.00 0.00 54.91 53.98 1llq h ALA 443 Cb 0.98 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.92 1llq h ALA 443 CO 0.23 0.45 0.62 1.49 0.00 0.00 0.00 179.25 182.03 1llq h GLU 444 N -0.54 0.49 0.15 0.00 4.81 -1.94 0.24 114.58 117.80 1llq h GLU 444 Ca -0.17 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.02 1llq h GLU 444 Cb 1.51 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.78 1llq h GLU 444 CO 0.06 0.33 -0.07 0.93 -0.73 0.00 0.00 179.01 179.53 1llq h GLU 445 N 0.51 -0.19 -0.47 1.92 5.08 -1.94 -1.28 114.58 118.20 1llq h GLU 445 Ca 0.52 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.98 1llq h GLU 445 Cb 1.16 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 1llq h GLU 445 CO -0.25 0.26 0.05 0.00 -1.00 0.00 0.00 179.01 178.06 1llq h ALA 446 N -0.16 0.49 -0.14 3.43 0.00 -0.57 -0.05 119.26 122.26 1llq h ALA 446 Ca -0.02 0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 1llq h ALA 446 Cb 0.54 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1llq h ALA 446 CO 0.03 -0.35 -0.50 1.88 0.00 0.00 0.00 179.25 180.32 1llq h TYR 447 N 0.17 0.77 0.35 0.00 0.99 -0.68 -3.25 116.97 115.32 1llq h TYR 447 Ca 0.24 -0.32 -0.02 0.00 2.00 0.00 0.00 58.73 60.63 1llq h TYR 447 Cb 0.33 -0.13 0.00 0.00 1.00 0.00 0.00 36.73 37.94 1llq h TYR 447 CO -0.26 1.10 -0.17 1.15 -0.00 0.00 0.00 178.16 179.98 1llq h THR 448 N 0.22 0.00 0.00 -2.88 2.02 -0.92 0.54 112.91 111.89 1llq h THR 448 Ca -0.02 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1llq h THR 448 Cb 1.13 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1llq h THR 448 CO 0.10 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.48 1llq n PHE 449 N -3.39 0.00 0.00 3.16 0.99 -0.06 -0.72 117.46 117.44 1llq n PHE 449 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.39 1llq n PHE 449 Cb 0.19 -0.01 0.00 0.00 -1.00 0.00 0.00 39.48 38.65 1llq n PHE 449 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 1llq n THR 450 N 0.34 0.00 -2.18 4.37 -1.04 -1.07 -3.61 114.28 111.08 1llq n THR 450 Ca 0.00 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.98 1llq n THR 450 Cb 0.04 0.03 0.01 0.00 -1.82 0.00 0.00 70.33 68.59 1llq n THR 450 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1llq n ASN 451 N -0.34 -2.07 -1.83 8.00 2.85 0.12 -3.69 115.26 118.30 1llq n ASN 451 Ca 0.00 -0.10 -0.13 0.00 -0.11 0.00 0.00 54.58 54.25 1llq n ASN 451 Cb 0.02 -1.22 -0.03 0.00 1.24 0.00 0.00 39.78 39.78 1llq n ASN 451 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1llq n GLY 452 N -1.06 0.46 0.71 8.20 0.00 0.14 -4.79 105.19 108.85 1llq n GLY 452 Ca -0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.06 1llq n GLY 452 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llq n ALA 453 N -0.72 2.43 -2.56 4.61 0.00 -1.24 -4.99 120.51 118.03 1llq n ALA 453 Ca -0.14 -0.76 -0.34 0.00 0.00 0.00 0.00 53.44 52.21 1llq n ALA 453 Cb 0.50 -0.57 -0.05 0.00 0.00 0.00 0.00 19.45 19.33 1llq n ALA 453 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1llq s ALA 454 N -1.27 3.71 -0.49 0.00 0.00 -1.26 -3.86 121.76 118.58 1llq s ALA 454 Ca 0.22 -0.39 -0.14 0.00 0.00 0.00 0.00 51.96 51.65 1llq s ALA 454 Cb 0.14 -2.28 0.10 0.00 0.00 0.00 0.00 23.12 21.08 1llq s ALA 454 CO 0.21 0.57 0.41 -0.51 0.00 0.00 0.00 175.76 176.44 1llq s LEU 455 N -2.23 5.77 0.17 0.00 1.43 -0.20 -4.94 118.68 118.68 1llq s LEU 455 Ca 0.37 -1.57 0.10 0.00 -1.03 0.00 0.00 54.13 52.00 1llq s LEU 455 Cb -0.13 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1llq s LEU 455 CO 0.20 -0.71 -0.19 -0.47 0.23 0.00 0.00 176.35 175.41 1llq s TYR 456 N 1.57 2.45 0.17 0.29 5.04 -1.26 -0.72 117.35 124.88 1llq s TYR 456 Ca 0.04 -0.30 -0.22 0.00 -2.44 0.00 0.00 57.07 54.14 1llq s TYR 456 Cb -0.26 -1.24 0.06 0.00 0.35 0.00 0.00 41.96 40.87 1llq s TYR 456 CO 0.04 0.46 0.59 0.00 -1.34 0.00 0.00 175.55 175.31 1llq s ALA 457 N -1.50 -1.53 0.32 3.97 0.00 -1.10 -4.26 121.76 117.66 1llq s ALA 457 Ca 0.21 0.40 -0.01 0.00 0.00 0.00 0.00 51.96 52.55 1llq s ALA 457 Cb -0.09 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.90 1llq s ALA 457 CO 0.11 -0.78 0.39 -1.54 0.00 0.00 0.00 175.76 173.95 1llq s SER 458 N -2.77 0.91 0.08 0.00 1.04 -1.03 -1.76 113.70 110.17 1llq s SER 458 Ca 0.02 -1.49 0.10 0.00 0.48 0.00 0.00 55.95 55.06 1llq s SER 458 Cb -0.01 0.60 -0.19 0.00 0.10 0.00 0.00 66.02 66.52 1llq s SER 458 CO -0.12 -1.18 1.07 1.23 0.98 0.00 0.00 173.24 175.22 1llq h GLY 459 N 2.18 0.00 -3.87 7.32 0.00 -1.48 -0.16 103.07 107.07 1llq h GLY 459 Ca -0.28 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.39 1llq h GLY 459 CO 0.39 0.00 -0.76 -0.56 0.00 0.00 0.00 176.54 175.61 1llq s SER 460 N -6.43 4.09 0.45 0.19 0.01 -1.26 -4.62 113.70 106.13 1llq s SER 460 Ca -0.01 -0.55 -0.25 0.00 1.31 0.00 0.00 55.95 56.46 1llq s SER 460 Cb 0.09 -0.65 -0.08 0.00 0.21 0.00 0.00 66.02 65.59 1llq s SER 460 CO 0.81 0.15 1.34 -2.16 0.41 0.00 0.00 173.24 173.79 1llq s PRO 461 N -2.41 3.70 -0.03 12.44 0.04 -1.26 -4.89 135.00 142.58 1llq s PRO 461 Ca 0.21 2.22 0.01 0.00 0.04 0.00 0.00 61.00 63.48 1llq s PRO 461 Cb -0.10 -2.60 0.01 0.00 0.04 0.00 0.00 34.50 31.86 1llq s PRO 461 CO 0.13 -0.73 -0.06 -0.06 0.04 0.00 0.00 177.00 176.32 1llq s PHE 462 N -1.28 0.75 0.95 0.56 0.40 -1.26 -4.90 117.98 113.19 1llq s PHE 462 Ca 0.62 -0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.63 1llq s PHE 462 Cb -0.39 -0.61 0.06 0.00 0.51 0.00 0.00 43.02 42.58 1llq s PHE 462 CO 0.50 -0.14 0.53 -0.35 0.70 0.00 0.00 175.22 176.45 1llq n PRO 463 N 3.71 -0.33 -2.10 0.24 -0.04 -1.26 -4.72 135.00 130.49 1llq n PRO 463 Ca -0.22 -0.05 -0.41 0.00 -0.04 0.00 0.00 63.50 62.78 1llq n PRO 463 Cb 0.53 -1.94 -0.02 0.00 -0.04 0.00 0.00 33.50 32.02 1llq n PRO 463 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1llq s ASN 464 N -2.12 6.76 -0.17 3.54 0.01 -1.26 -4.80 114.94 116.90 1llq s ASN 464 Ca 0.58 2.67 0.01 0.00 -0.71 0.00 0.00 52.86 55.42 1llq s ASN 464 Cb -0.21 -2.64 0.01 0.00 0.41 0.00 0.00 41.25 38.81 1llq s ASN 464 CO 0.66 -0.56 -0.17 0.12 -1.51 0.00 0.00 177.10 175.64 1llq s PHE 465 N -0.93 2.77 -0.20 2.20 5.36 -0.10 -4.93 117.98 122.15 1llq s PHE 465 Ca 0.51 -1.32 -0.12 0.00 -0.96 0.00 0.00 56.93 55.03 1llq s PHE 465 Cb -0.40 -1.91 -0.05 0.00 -0.34 0.00 0.00 43.02 40.33 1llq s PHE 465 CO 0.51 -0.64 0.22 -1.21 -1.46 0.00 0.00 175.22 172.64 1llq s GLU 466 N 1.06 4.17 -0.20 10.12 2.02 -1.26 -0.34 118.70 134.27 1llq s GLU 466 Ca -0.01 -0.10 -0.05 0.00 0.02 0.00 0.00 54.97 54.84 1llq s GLU 466 Cb -0.14 -3.47 0.07 0.00 0.10 0.00 0.00 34.13 30.68 1llq s GLU 466 CO -0.06 0.17 0.09 -1.17 0.02 0.00 0.00 175.26 174.31 1llq s LEU 467 N 0.72 0.48 -0.73 1.80 2.96 0.03 -4.87 118.68 119.09 1llq s LEU 467 Ca 0.11 -0.76 -0.05 0.00 -0.22 0.00 0.00 54.13 53.21 1llq s LEU 467 Cb -0.13 -0.30 0.01 0.00 0.50 0.00 0.00 46.19 46.27 1llq s LEU 467 CO 0.03 -0.36 0.60 0.59 -1.32 0.00 0.00 176.35 175.88 1llq n ASN 468 N 5.25 -4.29 0.00 3.68 3.02 -1.26 -3.17 115.26 118.49 1llq n ASN 468 Ca -0.07 -0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.21 1llq n ASN 468 Cb 0.47 -2.88 0.00 0.00 -0.61 0.00 0.00 39.78 36.76 1llq n ASN 468 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1llq n GLY 469 N -1.29 2.64 3.74 7.41 0.00 -1.26 -5.00 105.19 111.43 1llq n GLY 469 Ca -0.00 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1llq n GLY 469 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1llq s HIS 470 N -1.05 3.74 0.23 1.61 3.76 -1.19 -5.06 115.29 117.33 1llq s HIS 470 Ca 0.00 1.55 -0.05 0.00 -0.15 0.00 0.00 55.06 56.41 1llq s HIS 470 Cb 0.00 -2.89 -0.06 0.00 1.11 0.00 0.00 32.58 30.74 1llq s HIS 470 CO 0.00 0.23 0.49 0.99 -0.85 0.00 0.00 174.74 175.59 1llq s THR 471 N 0.08 5.07 -0.01 1.30 2.01 -1.26 -0.79 115.64 122.04 1llq s THR 471 Ca 0.41 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.52 1llq s THR 471 Cb -0.21 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.61 1llq s THR 471 CO 0.25 -0.16 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.60 1llq s TYR 472 N -1.90 0.92 -0.50 4.92 1.51 0.54 -4.75 117.35 118.09 1llq s TYR 472 Ca 0.43 -0.17 0.05 0.00 -1.01 0.00 0.00 57.07 56.37 1llq s TYR 472 Cb -0.11 -0.59 0.20 0.00 -0.11 0.00 0.00 41.96 41.35 1llq s TYR 472 CO 0.27 -0.02 0.47 1.63 -1.11 0.00 0.00 175.55 176.79 1llq n LYS 473 N 2.83 0.98 -1.73 -0.62 5.02 -0.70 -0.92 118.16 123.01 1llq n LYS 473 Ca -0.14 -3.67 -0.41 0.00 -2.02 0.00 0.00 58.31 52.08 1llq n LYS 473 Cb 0.56 -1.77 0.01 0.00 -0.02 0.00 0.00 35.03 33.82 1llq n LYS 473 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1llq n PRO 474 N 2.04 2.16 -3.30 1.97 -0.04 -1.26 -3.77 135.00 132.79 1llq n PRO 474 Ca 0.26 0.76 -0.18 0.00 -0.04 0.00 0.00 63.50 64.30 1llq n PRO 474 Cb 0.46 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 1llq n PRO 474 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1llq s GLY 475 N -0.44 1.74 -0.00 0.55 0.00 -1.26 -4.77 107.32 103.13 1llq s GLY 475 Ca 0.60 -1.55 0.03 0.00 0.00 0.00 0.00 44.72 43.80 1llq s GLY 475 CO 0.59 -1.42 -0.04 1.20 0.00 0.00 0.00 173.10 173.42 1llq s GLN 476 N -4.24 2.63 -1.28 2.90 -0.21 -1.26 -2.48 119.66 115.73 1llq s GLN 476 Ca 0.49 -0.68 -0.07 0.00 0.02 0.00 0.00 55.36 55.12 1llq s GLN 476 Cb -0.10 -2.56 0.16 0.00 1.00 0.00 0.00 33.01 31.51 1llq s GLN 476 CO 0.32 0.61 2.11 0.41 -2.12 0.00 0.00 175.29 176.62 1llq n GLY 477 N 1.52 5.08 3.68 3.09 0.00 -0.07 -4.92 105.19 113.57 1llq n GLY 477 Ca -0.15 -2.13 -0.43 0.00 0.00 0.00 0.00 46.02 43.31 1llq n GLY 477 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1llq s ASN 478 N 0.36 7.11 0.61 1.61 3.84 -1.26 -4.86 114.94 122.35 1llq s ASN 478 Ca 0.46 1.66 0.29 0.00 0.21 0.00 0.00 52.86 55.48 1llq s ASN 478 Cb 0.14 -2.55 1.56 0.00 -0.55 0.00 0.00 41.25 39.85 1llq s ASN 478 CO -0.05 -0.57 1.94 0.78 -2.79 0.00 0.00 177.10 176.42 1llq h ASN 479 N 7.43 0.00 0.00 -4.21 4.21 -1.93 -1.86 115.58 119.22 1llq h ASN 479 Ca -0.30 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.21 1llq h ASN 479 Cb 1.14 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.34 1llq h ASN 479 CO 0.89 0.00 0.01 0.00 -1.29 0.00 0.00 177.43 177.04 1llq n ALA 480 N -2.20 1.02 0.27 -0.83 0.00 -1.26 -1.09 120.51 116.42 1llq n ALA 480 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.60 1llq n ALA 480 Cb 0.52 -0.98 0.16 0.00 0.00 0.00 0.00 19.45 19.15 1llq n ALA 480 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1llq h TYR 481 N 0.00 0.00 0.00 0.00 -1.99 -1.75 -3.40 116.97 109.83 1llq h TYR 481 Ca 0.00 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.62 1llq h TYR 481 Cb 0.02 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.73 1llq h TYR 481 CO 0.00 0.00 -1.18 -0.89 -0.00 0.00 0.00 178.16 176.09 1llq n ILE 482 N -2.83 0.73 0.13 -2.88 2.08 -0.25 -4.75 119.36 111.59 1llq n ILE 482 Ca 0.03 -0.00 0.08 0.00 0.56 0.00 0.00 62.75 63.42 1llq n ILE 482 Cb 0.52 -1.68 0.56 0.00 -0.75 0.00 0.00 39.64 38.29 1llq n ILE 482 CO 0.00 0.00 0.00 2.19 0.56 0.00 0.00 176.55 179.30 1llq h PHE 483 N -0.33 0.20 -0.26 1.39 -5.15 -1.76 -0.88 116.94 110.16 1llq h PHE 483 Ca -0.17 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.60 1llq h PHE 483 Cb 0.96 -0.07 -0.01 0.00 0.22 0.00 0.00 35.95 37.05 1llq h PHE 483 CO -0.06 0.12 0.14 -1.35 -2.00 0.00 0.00 178.31 175.16 1llq h PRO 484 N 0.22 0.36 -0.10 6.09 0.11 -1.84 -0.42 132.00 136.42 1llq h PRO 484 Ca 0.09 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.09 1llq h PRO 484 Cb 0.08 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.12 1llq h PRO 484 CO -0.02 0.33 -0.20 0.78 -0.21 0.00 0.00 178.00 178.69 1llq h GLY 485 N 0.30 0.35 0.52 -0.55 0.00 -1.76 -0.37 103.07 101.56 1llq h GLY 485 Ca 0.09 -0.41 0.11 0.00 0.00 0.00 0.00 47.33 47.13 1llq h GLY 485 CO -0.01 0.36 0.63 -2.08 0.00 0.00 0.00 176.54 175.44 1llq h VAL 486 N -0.12 0.94 -0.07 4.60 2.07 -1.13 0.31 116.25 122.85 1llq h VAL 486 Ca 0.00 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1llq h VAL 486 Cb 0.78 -0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1llq h VAL 486 CO 0.04 0.18 -0.03 0.00 0.02 0.00 0.00 177.57 177.79 1llq h ALA 487 N 1.53 0.10 -0.35 1.67 0.00 -0.97 -1.47 119.26 119.77 1llq h ALA 487 Ca 0.48 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.23 1llq h ALA 487 Cb 0.45 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1llq h ALA 487 CO -0.25 -0.16 -0.01 1.25 0.00 0.00 0.00 179.25 180.09 1llq h LEU 488 N -0.21 -0.16 -0.56 0.00 5.85 -0.25 -1.13 115.31 118.85 1llq h LEU 488 Ca 0.02 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 1llq h LEU 488 Cb 0.45 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1llq h LEU 488 CO 0.01 -0.04 0.12 1.23 -0.34 0.00 0.00 178.44 179.41 1llq h GLY 489 N 0.09 0.98 0.93 3.75 0.00 -0.97 -1.60 103.07 106.26 1llq h GLY 489 Ca 0.17 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 1llq h GLY 489 CO -0.30 0.59 0.14 -0.84 0.00 0.00 0.00 176.54 176.14 1llq h THR 490 N 0.81 1.17 0.69 4.70 2.02 -0.88 -2.71 112.91 118.71 1llq h THR 490 Ca 0.17 -0.50 -0.03 0.00 0.77 0.00 0.00 66.41 66.82 1llq h THR 490 Cb 0.38 0.90 0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1llq h THR 490 CO 0.01 0.18 -0.33 0.40 0.37 0.00 0.00 175.52 176.14 1llq h ILE 491 N 0.38 0.06 -0.63 3.11 2.04 -1.16 -1.10 117.51 120.21 1llq h ILE 491 Ca 0.11 -0.31 0.14 0.00 1.00 0.00 0.00 64.86 65.79 1llq h ILE 491 Cb 0.15 0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.28 1llq h ILE 491 CO -0.01 0.01 0.43 -0.07 0.00 0.00 0.00 178.15 178.51 1llq h LEU 492 N -1.21 0.24 -2.35 1.44 3.38 -1.35 -2.11 115.31 113.34 1llq h LEU 492 Ca -0.09 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1llq h LEU 492 Cb 0.72 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1llq h LEU 492 CO 0.15 0.13 0.00 0.49 0.09 0.00 0.00 178.44 179.31 1llq n PHE 493 N -4.44 0.38 -3.83 1.13 3.01 -1.02 -4.86 117.46 107.82 1llq n PHE 493 Ca 0.11 -0.31 -0.24 0.00 1.01 0.00 0.00 57.45 58.03 1llq n PHE 493 Cb 0.51 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 1llq n PHE 493 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1llq n GLN 494 N 0.84 -3.98 -2.04 -1.08 6.02 -0.49 -1.97 117.38 114.68 1llq n GLN 494 Ca 0.13 0.50 -0.42 0.00 -0.01 0.00 0.00 57.00 57.20 1llq n GLN 494 Cb 0.44 -4.82 -0.03 0.00 1.02 0.00 0.00 30.24 26.85 1llq n GLN 494 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1llq s ILE 495 N -3.82 3.27 0.12 5.09 1.01 -0.78 -1.46 121.20 124.64 1llq s ILE 495 Ca 0.01 0.72 -0.20 0.00 0.00 0.00 0.00 60.65 61.17 1llq s ILE 495 Cb -0.00 -3.46 -0.06 0.00 0.01 0.00 0.00 42.46 38.95 1llq s ILE 495 CO 0.85 0.00 1.73 0.03 0.00 0.00 0.00 174.94 177.55 1llq h ARG 496 N 8.03 0.06 -3.83 2.79 3.08 -1.56 -3.45 114.38 119.50 1llq h ARG 496 Ca -0.41 -0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.45 1llq h ARG 496 Cb 1.19 -0.01 -0.23 0.00 0.08 0.00 0.00 29.97 30.99 1llq h ARG 496 CO 0.92 0.04 -0.68 -1.01 -1.07 0.00 0.00 179.97 178.17 1llq s HIS 497 N -6.19 0.14 -0.26 3.04 3.76 -1.26 -3.42 115.29 111.10 1llq s HIS 497 Ca -0.13 -0.29 -0.09 0.00 -0.15 0.00 0.00 55.06 54.40 1llq s HIS 497 Cb 0.09 -0.11 -0.04 0.00 1.11 0.00 0.00 32.58 33.64 1llq s HIS 497 CO 0.68 -0.13 0.13 0.08 -0.85 0.00 0.00 174.74 174.65 1llq s VAL 498 N -0.92 4.83 0.48 -0.90 1.01 -1.26 -5.04 120.40 118.60 1llq s VAL 498 Ca -0.10 0.00 0.02 0.00 0.00 0.00 0.00 61.98 61.90 1llq s VAL 498 Cb -0.06 -3.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 1llq s VAL 498 CO -0.00 0.31 0.06 1.51 0.00 0.00 0.00 175.10 176.98 1llq s ASP 499 N 1.55 3.65 0.24 3.32 1.47 -1.26 -4.95 116.67 120.70 1llq s ASP 499 Ca 0.06 -1.71 -0.07 0.00 1.18 0.00 0.00 52.55 52.01 1llq s ASP 499 Cb -0.15 0.64 0.42 0.00 -0.34 0.00 0.00 42.92 43.49 1llq s ASP 499 CO 0.07 -0.94 1.66 0.78 0.68 0.00 0.00 175.17 177.41 1llq h ASN 500 N 1.47 -0.22 -0.91 2.11 4.21 -1.99 -0.70 115.58 119.55 1llq h ASN 500 Ca -0.40 0.17 0.18 0.00 1.21 0.00 0.00 56.30 57.46 1llq h ASN 500 Cb 1.31 0.28 -0.10 0.00 -1.12 0.00 0.00 38.32 38.68 1llq h ASN 500 CO 0.65 -0.12 0.49 0.44 -1.29 0.00 0.00 177.43 177.60 1llq h ASP 501 N 0.15 0.58 -0.23 5.81 3.32 -1.99 0.58 116.42 124.64 1llq h ASP 501 Ca 0.40 0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.42 1llq h ASP 501 Cb 0.69 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 1llq h ASP 501 CO -0.59 0.19 -0.39 -0.07 -1.72 0.00 0.00 179.24 176.67 1llq h LEU 502 N 0.63 0.75 -0.76 1.55 3.38 -1.53 -1.28 115.31 118.04 1llq h LEU 502 Ca 0.52 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1llq h LEU 502 Cb 0.82 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1llq h LEU 502 CO -0.40 1.13 0.34 -0.26 0.09 0.00 0.00 178.44 179.34 1llq h PHE 503 N 0.39 1.13 -0.66 1.13 -1.00 -1.07 0.20 116.94 117.07 1llq h PHE 503 Ca 0.02 -0.07 -0.00 0.00 2.81 0.00 0.00 57.97 60.73 1llq h PHE 503 Cb 0.99 -0.34 -0.03 0.00 3.61 0.00 0.00 35.95 40.17 1llq h PHE 503 CO 0.08 0.84 0.40 -0.07 -1.61 0.00 0.00 178.31 177.95 1llq h LEU 504 N 1.09 0.79 -1.02 1.54 4.07 -0.87 0.35 115.31 121.24 1llq h LEU 504 Ca 0.26 -0.06 -0.01 0.00 0.08 0.00 0.00 57.88 58.15 1llq h LEU 504 Cb 0.16 -0.20 -0.04 0.00 1.08 0.00 0.00 40.66 41.66 1llq h LEU 504 CO -0.03 0.61 0.49 0.25 -1.08 0.00 0.00 178.44 178.68 1llq h LEU 505 N 0.89 1.04 -0.55 1.67 6.46 -0.38 0.11 115.31 124.55 1llq h LEU 505 Ca 0.24 -0.07 -0.07 0.00 -0.12 0.00 0.00 57.88 57.85 1llq h LEU 505 Cb -0.03 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.61 1llq h LEU 505 CO -0.04 0.81 0.05 0.00 -0.62 0.00 0.00 178.44 178.64 1llq h ALA 506 N 1.36 0.74 -0.37 1.25 0.00 0.44 -2.32 119.26 120.35 1llq h ALA 506 Ca 0.30 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1llq h ALA 506 Cb -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1llq h ALA 506 CO -0.05 0.52 0.15 0.00 0.00 0.00 0.00 179.25 179.87 1llq h ALA 507 N 0.98 0.44 -0.04 0.00 0.00 0.11 -1.83 119.26 118.92 1llq h ALA 507 Ca 0.16 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1llq h ALA 507 Cb 0.47 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1llq h ALA 507 CO 0.02 -0.23 -0.28 0.87 0.00 0.00 0.00 179.25 179.63 1llq h LYS 508 N 0.32 0.07 -0.10 0.00 1.57 -0.69 -2.16 116.57 115.58 1llq h LYS 508 Ca 0.16 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 1llq h LYS 508 Cb 0.11 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1llq h LYS 508 CO -0.14 0.35 -0.38 -0.22 -0.57 0.00 0.00 179.45 178.49 1llq h LYS 509 N 0.07 0.44 -0.21 3.15 1.63 -0.91 -2.21 116.57 118.52 1llq h LYS 509 Ca 0.01 -0.33 0.03 0.00 -0.85 0.00 0.00 60.65 59.51 1llq h LYS 509 Cb 0.53 0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.20 1llq h LYS 509 CO 0.04 0.96 0.03 0.28 -3.45 0.00 0.00 179.45 177.31 1llq h VAL 510 N 0.01 0.89 -0.82 2.00 2.07 -1.19 -2.28 116.25 116.92 1llq h VAL 510 Ca -0.02 -0.04 0.10 0.00 0.82 0.00 0.00 66.70 67.56 1llq h VAL 510 Cb 1.01 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 31.48 1llq h VAL 510 CO 0.08 0.02 0.46 0.00 0.02 0.00 0.00 177.57 178.15 1llq h ALA 511 N 1.16 1.16 0.00 1.67 0.00 -1.40 -1.62 119.26 120.24 1llq h ALA 511 Ca 0.10 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1llq h ALA 511 Cb 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1llq h ALA 511 CO -0.14 0.08 0.00 -1.13 0.00 0.00 0.00 179.25 178.06 1llq n SER 512 N -4.75 0.23 -0.49 0.00 3.41 -0.83 -2.42 113.62 108.76 1llq n SER 512 Ca 0.13 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.43 1llq n SER 512 Cb 0.28 -0.61 0.24 0.00 -0.26 0.00 0.00 64.21 63.86 1llq n SER 512 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1llq s VAL 514 N -2.31 4.07 1.12 0.00 1.01 -1.02 -4.81 120.40 118.47 1llq s VAL 514 Ca 0.26 1.10 -0.13 0.00 0.00 0.00 0.00 61.98 63.21 1llq s VAL 514 Cb 0.19 -4.42 0.26 0.00 0.00 0.00 0.00 36.38 32.42 1llq s VAL 514 CO 0.46 -0.88 1.05 0.42 0.00 0.00 0.00 175.10 176.15 1llq s THR 515 N 4.88 2.03 0.12 3.92 -4.23 -1.26 -4.89 115.64 116.20 1llq s THR 515 Ca 0.54 0.01 -0.11 0.00 -1.18 0.00 0.00 61.69 60.95 1llq s THR 515 Cb -0.10 -2.19 -0.12 0.00 1.34 0.00 0.00 72.50 71.43 1llq s THR 515 CO 0.32 -0.01 1.37 -0.08 -0.54 0.00 0.00 174.62 175.67 1llq h GLU 516 N -2.43 0.82 -0.67 3.99 4.57 -1.99 -2.86 114.58 116.01 1llq h GLU 516 Ca -0.60 -0.59 -0.05 0.00 -1.18 0.00 0.00 59.36 56.95 1llq h GLU 516 Cb 1.33 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.99 1llq h GLU 516 CO 0.52 1.21 0.23 -0.44 -1.18 0.00 0.00 179.01 179.35 1llq h ASP 517 N 0.60 0.93 0.71 1.04 3.32 -2.00 -0.96 116.42 120.06 1llq h ASP 517 Ca -0.02 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 56.81 1llq h ASP 517 Cb 1.27 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 1llq h ASP 517 CO 0.14 0.86 -0.32 0.28 -1.72 0.00 0.00 179.24 178.48 1llq h SER 518 N 0.97 0.00 0.51 6.45 0.02 -1.87 -2.84 113.55 116.79 1llq h SER 518 Ca 0.22 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.94 1llq h SER 518 Cb 0.25 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 1llq h SER 518 CO -0.01 0.32 -1.00 0.25 -1.14 0.00 0.00 176.83 175.25 1llq h LEU 519 N 0.00 0.40 -1.35 5.07 5.85 -1.07 0.72 115.31 124.93 1llq h LEU 519 Ca -0.00 -0.35 -0.06 0.00 0.84 0.00 0.00 57.88 58.31 1llq h LEU 519 Cb 0.76 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1llq h LEU 519 CO 0.04 1.19 -0.26 0.07 -0.34 0.00 0.00 178.44 179.13 1llq h LYS 520 N 0.15 0.00 -0.10 1.25 2.10 -0.99 -1.21 116.57 117.77 1llq h LYS 520 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1llq h LYS 520 Cb 1.66 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.99 1llq h LYS 520 CO 0.16 0.26 0.00 0.28 -2.00 0.00 0.00 179.45 178.16 1llq n VAL 521 N -3.65 0.12 -0.86 0.07 0.31 -1.11 -4.93 118.33 108.29 1llq n VAL 521 Ca -0.01 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 1llq n VAL 521 Cb 0.39 0.33 0.00 0.00 -0.91 0.00 0.00 33.84 33.65 1llq n VAL 521 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1llq n GLY 522 N 1.12 0.66 3.61 2.92 0.00 -0.46 -1.72 105.19 111.31 1llq n GLY 522 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1llq n GLY 522 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1llq s ARG 523 N -0.14 3.96 -0.19 1.61 3.52 0.23 -4.57 118.95 123.37 1llq s ARG 523 Ca 0.00 0.41 0.15 0.00 -0.13 0.00 0.00 55.73 56.16 1llq s ARG 523 Cb 0.00 -3.71 0.76 0.00 -1.56 0.00 0.00 34.95 30.45 1llq s ARG 523 CO 0.00 -0.55 1.67 1.33 -0.81 0.00 0.00 175.30 176.94 1llq n VAL 524 N 5.37 2.37 -4.11 7.11 0.24 -1.26 -3.84 118.33 124.20 1llq n VAL 524 Ca 0.00 -1.28 -0.15 0.00 -2.04 0.00 0.00 64.34 60.87 1llq n VAL 524 Cb 0.49 -0.16 -0.12 0.00 -1.47 0.00 0.00 33.84 32.59 1llq n VAL 524 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1llq s TYR 525 N -2.41 0.91 1.09 6.34 1.51 -1.26 -4.69 117.35 118.84 1llq s TYR 525 Ca 0.52 -0.50 -0.13 0.00 -1.01 0.00 0.00 57.07 55.96 1llq s TYR 525 Cb 0.37 -0.53 0.24 0.00 -0.11 0.00 0.00 41.96 41.94 1llq s TYR 525 CO 0.18 -0.02 1.06 -2.14 -1.11 0.00 0.00 175.55 173.52 1llq s PRO 526 N -1.73 -0.32 0.39 -1.71 0.02 -1.26 -4.93 135.00 125.46 1llq s PRO 526 Ca -0.06 0.69 -0.25 0.00 0.02 0.00 0.00 61.00 61.40 1llq s PRO 526 Cb -0.10 -1.64 -0.09 0.00 0.02 0.00 0.00 34.50 32.70 1llq s PRO 526 CO 0.01 -3.28 1.12 -0.65 -0.33 0.00 0.00 177.00 173.87 1llq s GLN 527 N -4.70 4.16 0.32 5.54 -0.21 -1.26 -4.93 119.66 118.58 1llq s GLN 527 Ca 0.67 1.72 0.01 0.00 0.02 0.00 0.00 55.36 57.77 1llq s GLN 527 Cb -0.22 -2.69 0.54 0.00 1.00 0.00 0.00 33.01 31.64 1llq s GLN 527 CO 0.61 -0.19 1.96 -0.07 -2.12 0.00 0.00 175.29 175.47 1llq h LEU 528 N 2.72 0.78 -0.60 2.90 3.38 -2.02 -1.53 115.31 120.94 1llq h LEU 528 Ca -0.48 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1llq h LEU 528 Cb 1.23 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1llq h LEU 528 CO 0.63 0.62 0.00 2.29 0.09 0.00 0.00 178.44 182.07 1llq n LYS 529 N -4.39 0.09 -0.02 1.13 2.85 -1.26 -2.00 118.16 114.56 1llq n LYS 529 Ca 0.06 0.47 0.13 0.00 -1.05 0.00 0.00 58.31 57.92 1llq n LYS 529 Cb 0.09 -1.73 0.32 0.00 -0.65 0.00 0.00 35.03 33.05 1llq n LYS 529 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1llq n GLU 530 N -1.91 2.00 -0.32 -1.58 -0.58 -0.58 -4.48 120.64 113.19 1llq n GLU 530 Ca 0.01 -1.46 -0.02 0.00 -0.42 0.00 0.00 57.16 55.27 1llq n GLU 530 Cb 0.10 -1.47 0.11 0.00 -0.57 0.00 0.00 31.44 29.61 1llq n GLU 530 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1llq h ILE 531 N 3.44 1.16 -0.48 -3.67 2.04 -1.51 -1.09 117.51 117.41 1llq h ILE 531 Ca 0.00 -0.38 0.06 0.00 1.00 0.00 0.00 64.86 65.53 1llq h ILE 531 Cb 0.73 -0.06 -0.05 0.00 -0.74 0.00 0.00 36.82 36.71 1llq h ILE 531 CO 0.00 0.20 0.19 0.03 0.00 0.00 0.00 178.15 178.58 1llq h ARG 532 N 1.12 0.37 -0.35 2.37 3.08 -1.75 0.48 114.38 119.70 1llq h ARG 532 Ca 0.34 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.26 1llq h ARG 532 Cb -0.03 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1llq h ARG 532 CO -0.11 0.25 -0.23 1.49 -1.07 0.00 0.00 179.97 180.30 1llq h GLU 533 N 0.38 0.69 -0.47 0.04 4.57 -1.79 -2.04 114.58 115.97 1llq h GLU 533 Ca 0.22 -0.27 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 1llq h GLU 533 Cb 0.20 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 1llq h GLU 533 CO -0.21 0.86 0.18 0.82 -1.18 0.00 0.00 179.01 179.48 1llq h ILE 534 N 0.61 1.21 -0.17 2.32 2.04 -0.14 -1.72 117.51 121.66 1llq h ILE 534 Ca 0.09 -0.67 0.02 0.00 1.00 0.00 0.00 64.86 65.30 1llq h ILE 534 Cb 0.71 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 1llq h ILE 534 CO 0.05 0.25 0.02 0.28 0.00 0.00 0.00 178.15 178.75 1llq h SER 535 N 0.62 -0.02 -0.77 1.72 0.02 0.17 -0.52 113.55 114.78 1llq h SER 535 Ca 0.16 0.03 0.07 0.00 -0.84 0.00 0.00 61.79 61.20 1llq h SER 535 Cb 0.22 0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 1llq h SER 535 CO -0.01 0.02 0.44 0.40 -1.14 0.00 0.00 176.83 176.54 1llq h ILE 536 N 0.09 0.97 -0.05 3.27 2.04 -1.17 -0.28 117.51 122.38 1llq h ILE 536 Ca 0.08 -0.27 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 1llq h ILE 536 Cb 0.08 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.25 1llq h ILE 536 CO -0.11 0.15 -0.42 1.56 0.00 0.00 0.00 178.15 179.32 1llq h GLN 537 N 0.80 0.10 -0.27 2.37 1.08 -0.86 -2.26 115.11 116.06 1llq h GLN 537 Ca 0.35 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.41 1llq h GLN 537 Cb 0.23 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 1llq h GLN 537 CO -0.20 0.50 -0.18 0.82 -0.95 0.00 0.00 178.83 178.83 1llq h ILE 538 N 0.08 1.30 -0.46 2.54 2.04 0.21 -1.55 117.51 121.68 1llq h ILE 538 Ca 0.01 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 1llq h ILE 538 Cb 0.78 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 38.39 1llq h ILE 538 CO 0.06 0.41 0.24 0.00 0.00 0.00 0.00 178.15 178.86 1llq h ALA 539 N 0.72 0.59 0.14 1.87 0.00 -0.93 0.24 119.26 121.89 1llq h ALA 539 Ca 0.05 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1llq h ALA 539 Cb 0.71 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1llq h ALA 539 CO 0.05 0.12 -0.20 0.28 0.00 0.00 0.00 179.25 179.50 1llq h VAL 540 N 0.60 0.54 -0.94 0.00 2.07 -1.34 0.18 116.25 117.37 1llq h VAL 540 Ca 0.16 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.74 1llq h VAL 540 Cb 0.07 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 1llq h VAL 540 CO -0.02 0.00 0.60 -0.08 0.02 0.00 0.00 177.57 178.08 1llq h GLU 541 N -0.40 1.07 -0.44 1.57 4.57 -1.01 -1.05 114.58 118.89 1llq h GLU 541 Ca 0.02 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1llq h GLU 541 Cb 0.41 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 1llq h GLU 541 CO -0.09 0.71 0.19 0.52 -1.18 0.00 0.00 179.01 179.16 1llq h MET 542 N 1.11 0.65 0.07 1.92 2.86 0.10 -1.96 114.93 119.67 1llq h MET 542 Ca 0.40 -0.11 0.02 0.00 -2.06 0.00 0.00 59.70 57.95 1llq h MET 542 Cb 0.13 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1llq h MET 542 CO -0.16 0.58 -0.22 0.00 1.06 0.00 0.00 176.91 178.17 1llq h ALA 543 N 1.03 -0.33 -0.54 6.32 0.00 0.25 0.14 119.26 126.13 1llq h ALA 543 Ca 0.15 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1llq h ALA 543 Cb 0.16 0.36 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 1llq h ALA 543 CO -0.01 -0.73 0.05 0.87 0.00 0.00 0.00 179.25 179.42 1llq h LYS 544 N -0.38 0.16 -0.32 0.00 1.57 -1.06 0.83 116.57 117.37 1llq h LYS 544 Ca 0.04 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 1llq h LYS 544 Cb 0.43 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1llq h LYS 544 CO -0.15 0.11 0.06 -0.92 -0.57 0.00 0.00 179.45 177.97 1llq h TYR 545 N 0.17 0.56 0.00 -1.35 3.20 -0.98 -2.91 116.97 115.66 1llq h TYR 545 Ca 0.28 -0.08 -0.11 0.00 3.14 0.00 0.00 58.73 61.95 1llq h TYR 545 Cb 0.41 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 1llq h TYR 545 CO -0.29 0.60 -0.55 0.00 -1.64 0.00 0.00 178.16 176.28 1llq h TYR 547 N 0.00 0.93 -0.86 0.00 -1.99 -0.87 0.18 116.97 114.37 1llq h TYR 547 Ca -0.01 -0.37 -0.02 0.00 2.00 0.00 0.00 58.73 60.34 1llq h TYR 547 Cb 1.01 -0.16 -0.04 0.00 2.00 0.00 0.00 36.73 39.54 1llq h TYR 547 CO 0.00 1.17 0.46 -0.22 -0.00 0.00 0.00 178.16 179.57 1llq h LYS 548 N 0.52 1.20 -0.66 4.88 3.64 -1.43 -2.55 116.57 122.17 1llq h LYS 548 Ca -0.02 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1llq h LYS 548 Cb 1.25 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1llq h LYS 548 CO 0.13 0.88 0.00 0.27 -2.27 0.00 0.00 179.45 178.47 1llq n ASN 549 N -4.33 3.82 -3.30 4.20 2.04 -1.04 -4.98 115.26 111.66 1llq n ASN 549 Ca 0.09 -2.00 -0.18 0.00 -0.44 0.00 0.00 54.58 52.05 1llq n ASN 549 Cb 0.11 -0.44 0.08 0.00 -2.53 0.00 0.00 39.78 37.00 1llq n ASN 549 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1llq n GLY 550 N 1.63 -0.35 0.06 4.83 0.00 -0.24 -4.94 105.19 106.19 1llq n GLY 550 Ca 0.23 0.10 0.01 0.00 0.00 0.00 0.00 46.02 46.36 1llq n GLY 550 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1llq n THR 551 N -4.18 0.13 -3.42 2.61 -2.24 0.46 -4.95 114.28 102.69 1llq n THR 551 Ca -0.19 -0.57 -0.42 0.00 -2.27 0.00 0.00 64.05 60.60 1llq n THR 551 Cb 0.63 0.96 -0.10 0.00 -2.10 0.00 0.00 70.33 69.72 1llq n THR 551 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1llq s ALA 552 N -0.23 3.47 -0.79 6.98 0.00 -1.18 -1.37 121.76 128.63 1llq s ALA 552 Ca 0.02 -1.48 0.25 0.00 0.00 0.00 0.00 51.96 50.75 1llq s ALA 552 Cb 0.01 -2.88 0.94 0.00 0.00 0.00 0.00 23.12 21.19 1llq s ALA 552 CO 0.02 -1.32 1.76 0.09 0.00 0.00 0.00 175.76 176.32 1llq n ASN 553 N 5.33 0.45 -4.63 0.00 4.13 -0.53 -4.76 115.26 115.24 1llq n ASN 553 Ca -0.10 0.56 -0.43 0.00 1.68 0.00 0.00 54.58 56.30 1llq n ASN 553 Cb 0.48 -0.67 -0.03 0.00 -1.54 0.00 0.00 39.78 38.02 1llq n ASN 553 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1llq s LEU 554 N -3.88 3.96 -0.10 3.41 2.96 -0.83 -4.96 118.68 119.24 1llq s LEU 554 Ca 0.10 2.00 0.02 0.00 -0.22 0.00 0.00 54.13 56.03 1llq s LEU 554 Cb 0.13 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.28 1llq s LEU 554 CO 0.49 -1.34 -0.16 -0.47 -1.32 0.00 0.00 176.35 173.55 1llq s TYR 555 N 5.63 2.71 0.61 5.38 5.04 -1.26 -4.04 117.35 131.42 1llq s TYR 555 Ca 0.83 -0.62 -0.00 0.00 -2.44 0.00 0.00 57.07 54.84 1llq s TYR 555 Cb -0.32 -1.75 0.06 0.00 0.35 0.00 0.00 41.96 40.30 1llq s TYR 555 CO 0.34 -0.16 0.86 -1.25 -1.34 0.00 0.00 175.55 173.99 1llq s PRO 556 N 0.07 2.29 0.09 4.97 0.04 -1.26 -5.04 135.00 136.15 1llq s PRO 556 Ca -0.07 -0.79 -0.33 0.00 0.04 0.00 0.00 61.00 59.86 1llq s PRO 556 Cb -0.15 -2.41 -0.12 0.00 0.04 0.00 0.00 34.50 31.87 1llq s PRO 556 CO 0.05 -0.96 1.78 0.94 0.04 0.00 0.00 177.00 178.85 1llq n GLN 557 N -2.54 2.50 -1.84 4.56 7.27 -1.26 -4.88 117.38 121.19 1llq n GLN 557 Ca 0.10 0.91 -0.38 0.00 0.07 0.00 0.00 57.00 57.70 1llq n GLN 557 Cb 0.60 -2.76 0.04 0.00 2.41 0.00 0.00 30.24 30.53 1llq n GLN 557 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1llq s PRO 558 N 2.50 3.15 0.14 3.69 0.04 -1.26 -4.90 135.00 138.36 1llq s PRO 558 Ca 0.83 2.15 -0.22 0.00 0.04 0.00 0.00 61.00 63.81 1llq s PRO 558 Cb -0.58 -2.23 0.01 0.00 0.04 0.00 0.00 34.50 31.75 1llq s PRO 558 CO 0.40 -1.15 1.65 0.93 0.04 0.00 0.00 177.00 178.87 1llq h GLU 559 N 1.43 -0.18 -3.91 4.56 5.08 -2.03 -3.34 114.58 116.18 1llq h GLU 559 Ca -0.51 0.01 -0.66 0.00 -1.00 0.00 0.00 59.36 57.21 1llq h GLU 559 Cb 1.30 0.04 -0.40 0.00 0.50 0.00 0.00 28.75 30.19 1llq h GLU 559 CO 0.57 -0.12 -0.62 0.34 -1.00 0.00 0.00 179.01 178.17 1llq s ASP 560 N -5.06 4.63 0.20 1.42 -1.08 -1.26 -4.99 116.67 110.52 1llq s ASP 560 Ca -0.14 -2.65 -0.15 0.00 -0.52 0.00 0.00 52.55 49.08 1llq s ASP 560 Cb 0.11 -1.67 0.20 0.00 -1.46 0.00 0.00 42.92 40.10 1llq s ASP 560 CO 0.68 -0.32 1.62 -0.07 0.52 0.00 0.00 175.17 177.61 1llq h LEU 561 N 7.03 -0.65 -0.52 -1.34 3.38 -1.98 -0.84 115.31 120.39 1llq h LEU 561 Ca -0.06 0.18 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 1llq h LEU 561 Cb 0.95 0.40 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 1llq h LEU 561 CO 0.64 -0.22 0.12 -0.08 0.09 0.00 0.00 178.44 178.99 1llq h GLU 562 N -0.04 0.83 -0.63 1.13 4.81 -1.95 0.01 114.58 118.73 1llq h GLU 562 Ca 0.27 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 1llq h GLU 562 Cb 0.46 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 1llq h GLU 562 CO -0.62 0.80 0.13 0.87 -0.73 0.00 0.00 179.01 179.46 1llq h LYS 563 N 0.72 1.02 0.35 1.92 1.57 -1.89 -0.78 116.57 119.49 1llq h LYS 563 Ca 0.16 -0.25 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1llq h LYS 563 Cb 0.34 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1llq h LYS 563 CO 0.00 0.92 -0.17 -0.92 -0.57 0.00 0.00 179.45 178.71 1llq h TYR 564 N 0.96 -0.44 -0.06 -1.35 3.20 -0.89 -1.87 116.97 116.53 1llq h TYR 564 Ca 0.20 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.09 1llq h TYR 564 Cb 0.38 0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 1llq h TYR 564 CO 0.03 -0.22 -0.20 0.28 -1.64 0.00 0.00 178.16 176.41 1llq h VAL 565 N -0.57 0.51 -0.05 1.81 2.07 -0.84 -1.69 116.25 117.50 1llq h VAL 565 Ca -0.05 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.49 1llq h VAL 565 Cb 0.42 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1llq h VAL 565 CO 0.08 0.00 0.05 0.03 0.02 0.00 0.00 177.57 177.75 1llq h ARG 566 N -0.29 0.00 0.00 1.57 3.08 -1.09 0.41 114.38 118.06 1llq h ARG 566 Ca 0.08 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1llq h ARG 566 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 1llq h ARG 566 CO -0.23 0.00 -0.05 0.00 -1.07 0.00 0.00 179.97 178.62 1llq h ALA 567 N 1.95 0.97 0.00 0.04 0.00 -0.46 -3.32 119.26 118.43 1llq h ALA 567 Ca 0.02 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 1llq h ALA 567 Cb 0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1llq h ALA 567 CO -0.00 0.07 -1.55 1.04 0.00 0.00 0.00 179.25 178.81 1llq n GLN 568 N -3.12 0.63 -1.87 0.00 1.13 0.10 -4.50 117.38 109.75 1llq n GLN 568 Ca 0.04 0.18 -0.35 0.00 -1.94 0.00 0.00 57.00 54.92 1llq n GLN 568 Cb 0.54 -1.76 0.05 0.00 0.11 0.00 0.00 30.24 29.17 1llq n GLN 568 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1llq s VAL 569 N -2.92 2.69 0.44 5.09 -7.23 -0.99 -4.76 120.40 112.73 1llq s VAL 569 Ca -0.04 0.39 -0.25 0.00 -1.81 0.00 0.00 61.98 60.28 1llq s VAL 569 Cb 0.09 -3.07 -0.09 0.00 0.56 0.00 0.00 36.38 33.87 1llq s VAL 569 CO 0.82 -0.13 1.26 0.00 -0.31 0.00 0.00 175.10 176.74 1llq n TYR 570 N -1.92 2.06 -4.09 2.82 9.36 0.14 -5.00 117.16 120.53 1llq n TYR 570 Ca 0.13 0.49 -0.32 0.00 3.32 0.00 0.00 57.90 61.52 1llq n TYR 570 Cb 0.50 -2.36 -0.15 0.00 -0.63 0.00 0.00 39.34 36.70 1llq n TYR 570 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1llq s ASN 571 N -0.60 3.94 0.23 2.98 2.47 -1.26 -4.96 114.94 117.74 1llq s ASN 571 Ca 0.63 -1.10 0.22 0.00 0.42 0.00 0.00 52.86 53.03 1llq s ASN 571 Cb -0.50 -1.53 0.94 0.00 -1.45 0.00 0.00 41.25 38.72 1llq s ASN 571 CO 0.57 -0.12 1.66 0.35 -3.72 0.00 0.00 177.10 175.84 1llq n THR 572 N 4.51 0.89 -2.33 -5.21 -2.24 -1.26 -4.81 114.28 103.83 1llq n THR 572 Ca -0.17 0.29 -0.39 0.00 -2.27 0.00 0.00 64.05 61.52 1llq n THR 572 Cb 0.45 -1.21 -0.03 0.00 -2.10 0.00 0.00 70.33 67.44 1llq n THR 572 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1llq s GLU 573 N -3.30 4.20 0.64 -0.78 0.41 -1.26 -4.67 118.70 113.94 1llq s GLU 573 Ca 0.04 1.84 -0.18 0.00 -0.41 0.00 0.00 54.97 56.26 1llq s GLU 573 Cb 0.09 -2.79 -0.02 0.00 -1.78 0.00 0.00 34.13 29.63 1llq s GLU 573 CO 0.35 -0.19 1.25 0.66 -0.49 0.00 0.00 175.26 176.83 1llq n TYR 574 N 0.33 1.78 -4.31 1.61 0.53 -1.26 -5.02 117.16 110.82 1llq n TYR 574 Ca 0.03 0.42 -0.23 0.00 -1.02 0.00 0.00 57.90 57.10 1llq n TYR 574 Cb 0.46 -2.25 -0.12 0.00 -1.03 0.00 0.00 39.34 36.40 1llq n TYR 574 CO 0.00 0.00 0.00 -1.21 -1.02 0.00 0.00 176.86 174.63 1llq s GLU 575 N -3.28 1.19 0.29 -0.72 2.02 -1.26 -5.11 118.70 111.84 1llq s GLU 575 Ca 0.82 -1.26 -0.29 0.00 0.02 0.00 0.00 54.97 54.25 1llq s GLU 575 Cb -0.39 -1.40 -0.10 0.00 0.10 0.00 0.00 34.13 32.35 1llq s GLU 575 CO 0.41 0.31 1.43 -1.21 0.02 0.00 0.00 175.26 176.23 1llq s GLU 576 N -2.24 4.25 -0.02 1.61 0.41 -1.26 -4.91 118.70 116.53 1llq s GLU 576 Ca 0.10 2.36 0.18 0.00 -0.41 0.00 0.00 54.97 57.20 1llq s GLU 576 Cb -0.08 -3.07 -0.26 0.00 -1.78 0.00 0.00 34.13 28.94 1llq s GLU 576 CO 0.05 -0.41 0.45 1.28 -0.49 0.00 0.00 175.26 176.15 1llq n LEU 577 N 1.66 0.15 -4.80 1.80 4.77 -1.26 -4.71 117.00 114.60 1llq n LEU 577 Ca 0.04 -0.09 -0.39 0.00 -0.03 0.00 0.00 56.01 55.55 1llq n LEU 577 Cb 0.40 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.43 1llq n LEU 577 CO 0.61 0.04 0.26 -0.63 -1.33 0.00 0.00 177.39 176.34 1llq s ILE 578 N -3.13 4.80 0.30 -0.08 1.01 -1.26 -4.28 121.20 118.57 1llq s ILE 578 Ca -0.04 1.19 -0.28 0.00 0.00 0.00 0.00 60.65 61.51 1llq s ILE 578 Cb 0.12 -3.89 -0.13 0.00 0.01 0.00 0.00 42.46 38.56 1llq s ILE 578 CO 0.73 0.53 1.16 0.59 0.00 0.00 0.00 174.94 177.95 1llq n ASN 579 N 1.95 2.03 -4.73 3.58 4.13 -1.26 -4.96 115.26 116.00 1llq n ASN 579 Ca -0.10 1.19 -0.41 0.00 1.68 0.00 0.00 54.58 56.94 1llq n ASN 579 Cb 0.51 -1.38 -0.05 0.00 -1.54 0.00 0.00 39.78 37.32 1llq n ASN 579 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1llq s ALA 580 N -0.98 3.30 0.12 5.41 0.00 -1.26 -5.05 121.76 123.31 1llq s ALA 580 Ca 0.58 0.43 0.06 0.00 0.00 0.00 0.00 51.96 53.03 1llq s ALA 580 Cb -0.65 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 1llq s ALA 580 CO 0.60 0.00 -0.02 0.95 0.00 0.00 0.00 175.76 177.29 1llq s THR 581 N 0.05 3.79 -0.01 0.00 -4.23 -1.26 -5.07 115.64 108.90 1llq s THR 581 Ca 0.43 -1.19 -0.16 0.00 -1.18 0.00 0.00 61.69 59.59 1llq s THR 581 Cb -0.22 -2.83 0.03 0.00 1.34 0.00 0.00 72.50 70.81 1llq s THR 581 CO 0.26 0.04 0.33 -0.72 -0.54 0.00 0.00 174.62 173.99 1llq s TYR 582 N -1.43 -0.20 0.63 3.99 -0.85 -1.26 -1.38 117.35 116.84 1llq s TYR 582 Ca 0.25 0.29 -0.11 0.00 -0.52 0.00 0.00 57.07 56.99 1llq s TYR 582 Cb -0.11 0.12 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 1llq s TYR 582 CO 0.17 -0.41 1.03 -0.51 -1.52 0.00 0.00 175.55 174.32 1llq s ASP 583 N -1.38 6.16 0.41 -0.18 1.01 -0.20 -4.88 116.67 117.61 1llq s ASP 583 Ca -0.13 1.41 0.07 0.00 0.71 0.00 0.00 52.55 54.61 1llq s ASP 583 Cb -0.05 -2.44 -0.07 0.00 1.01 0.00 0.00 42.92 41.38 1llq s ASP 583 CO 0.04 -0.91 0.05 0.26 0.21 0.00 0.00 175.17 174.82 1llq s TRP 584 N -3.19 2.54 0.23 4.23 0.52 -1.26 -4.05 118.94 117.96 1llq s TRP 584 Ca 0.55 -0.64 -0.31 0.00 0.02 0.00 0.00 56.10 55.72 1llq s TRP 584 Cb -0.11 -1.81 -0.14 0.00 -1.15 0.00 0.00 33.47 30.25 1llq s TRP 584 CO 0.54 0.39 1.27 -2.30 0.02 0.00 0.00 176.95 176.86 1llq n PRO 585 N -1.03 1.66 -0.32 4.98 -0.02 -1.26 -4.78 135.00 134.23 1llq n PRO 585 Ca -0.04 0.59 0.29 0.00 -2.02 0.00 0.00 63.50 62.32 1llq n PRO 585 Cb 0.66 -2.15 0.55 0.00 -0.02 0.00 0.00 33.50 32.53 1llq n PRO 585 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1llq h GLU 586 N 3.55 0.09 0.00 -0.52 4.81 -2.00 0.40 114.58 120.90 1llq h GLU 586 Ca -0.44 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 58.71 1llq h GLU 586 Cb 1.31 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.65 1llq h GLU 586 CO 0.71 0.06 -0.39 0.37 -0.73 0.00 0.00 179.01 179.03 1llq h GLN 587 N 0.09 0.00 -0.01 1.92 5.75 -2.00 -3.19 115.11 117.67 1llq h GLN 587 Ca 0.81 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 59.31 1llq h GLN 587 Cb 2.05 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.60 1llq h GLN 587 CO -0.73 0.39 -0.01 -0.25 -2.65 0.00 0.00 178.83 175.58 1llq n ASP 588 N -3.45 1.33 -0.00 -0.69 8.00 0.14 -3.69 116.55 118.19 1llq n ASP 588 Ca 0.00 -1.41 0.07 0.00 0.71 0.00 0.00 54.79 54.16 1llq n ASP 588 Cb 0.55 0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.56 1llq n ASP 588 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1llq n MET 589 N 0.02 1.80 -1.70 -1.24 2.81 -1.13 -4.93 117.12 112.74 1llq n MET 589 Ca 0.19 -0.04 -0.43 0.00 -1.81 0.00 0.00 57.70 55.61 1llq n MET 589 Cb 0.33 -1.22 -0.02 0.00 -0.71 0.00 0.00 33.22 31.60 1llq n MET 589 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1llq n ARG 590 N -1.52 2.34 -3.58 0.03 1.85 -1.23 -4.99 116.66 109.56 1llq n ARG 590 Ca 0.01 0.83 -0.37 0.00 -1.00 0.00 0.00 57.85 57.32 1llq n ARG 590 Cb 0.27 -2.55 -0.06 0.00 -1.05 0.00 0.00 32.46 29.06 1llq n ARG 590 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1llq s HIS 591 N 0.07 3.59 0.00 2.89 3.76 -1.26 -5.00 115.29 119.35 1llq s HIS 591 Ca 0.67 0.75 0.00 0.00 -0.15 0.00 0.00 55.06 56.33 1llq s HIS 591 Cb -0.58 -2.26 0.00 0.00 1.11 0.00 0.00 32.58 30.85 1llq s HIS 591 CO 0.48 0.48 0.00 0.41 -0.85 0.00 0.00 174.74 175.26 1llq n GLY 592 N 2.52 2.95 0.00 -2.22 0.00 -1.26 -5.26 105.19 101.92 1llq n GLY 592 Ca -0.14 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.83 1llq n GLY 592 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01