#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a72 n THR 2 N 0.00 0.00 -1.37 6.66 -2.24 -1.26 -5.04 114.28 111.03 1a72 n THR 2 Ca 0.00 0.00 -0.51 0.00 -2.27 0.00 0.00 64.05 61.27 1a72 n THR 2 Cb 0.00 -0.17 -0.05 0.00 -2.10 0.00 0.00 70.33 68.00 1a72 n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1a72 n ALA 3 N -1.81 -3.16 -0.71 6.98 0.00 -1.26 -0.93 120.51 119.62 1a72 n ALA 3 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1a72 n ALA 3 Cb 0.10 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1a72 n ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a72 n GLY 4 N 1.61 0.91 3.32 0.00 0.00 -1.26 -4.99 105.19 104.78 1a72 n GLY 4 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 1a72 n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a72 s LYS 5 N -0.26 1.24 -0.28 1.61 1.02 -0.11 -4.82 119.74 118.14 1a72 s LYS 5 Ca 0.00 -1.36 -0.28 0.00 0.02 0.00 0.00 55.97 54.35 1a72 s LYS 5 Cb 0.00 -1.33 -0.03 0.00 -0.52 0.00 0.00 37.83 35.95 1a72 s LYS 5 CO 0.00 0.28 1.95 0.08 -0.92 0.00 0.00 175.35 176.74 1a72 s VAL 6 N -1.89 3.30 0.10 3.17 1.01 -1.26 -4.38 120.40 120.45 1a72 s VAL 6 Ca 0.14 0.31 -0.24 0.00 0.00 0.00 0.00 61.98 62.19 1a72 s VAL 6 Cb -0.06 -3.40 -0.07 0.00 0.00 0.00 0.00 36.38 32.85 1a72 s VAL 6 CO 0.06 -0.25 0.71 -0.63 0.00 0.00 0.00 175.10 174.99 1a72 s ILE 7 N 7.31 4.59 -0.41 2.22 1.01 -1.00 -4.77 121.20 130.15 1a72 s ILE 7 Ca 0.87 1.54 -0.13 0.00 0.00 0.00 0.00 60.65 62.93 1a72 s ILE 7 Cb -0.27 -4.06 0.04 0.00 0.01 0.00 0.00 42.46 38.18 1a72 s ILE 7 CO 0.34 0.48 0.28 -0.54 0.00 0.00 0.00 174.94 175.50 1a72 s LYS 8 N -0.76 2.89 0.33 2.79 1.02 -1.26 0.14 119.74 124.89 1a72 s LYS 8 Ca 0.35 -1.13 0.05 0.00 0.02 0.00 0.00 55.97 55.25 1a72 s LYS 8 Cb -0.21 -3.91 -0.03 0.00 -0.52 0.00 0.00 37.83 33.16 1a72 s LYS 8 CO 0.23 -0.80 0.20 0.00 -0.92 0.00 0.00 175.35 174.06 1a72 s LYS 10 N -3.67 3.73 -0.01 0.00 1.02 -1.25 0.11 119.74 119.68 1a72 s LYS 10 Ca 0.35 0.13 -0.28 0.00 0.02 0.00 0.00 55.97 56.19 1a72 s LYS 10 Cb 0.04 -2.84 0.09 0.00 -0.52 0.00 0.00 37.83 34.59 1a72 s LYS 10 CO 0.21 0.45 0.76 0.00 -0.92 0.00 0.00 175.35 175.85 1a72 s ALA 11 N -1.61 -1.77 -0.34 5.17 0.00 -0.58 -1.19 121.76 121.44 1a72 s ALA 11 Ca 0.40 1.09 -0.27 0.00 0.00 0.00 0.00 51.96 53.18 1a72 s ALA 11 Cb -0.13 0.19 0.01 0.00 0.00 0.00 0.00 23.12 23.20 1a72 s ALA 11 CO 0.21 -0.53 0.97 0.00 0.00 0.00 0.00 175.76 176.42 1a72 s ALA 12 N -2.25 3.45 -0.15 0.00 0.00 0.71 -0.39 121.76 123.12 1a72 s ALA 12 Ca -0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 51.96 51.60 1a72 s ALA 12 Cb -0.01 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 1a72 s ALA 12 CO -0.02 -1.52 -0.01 0.08 0.00 0.00 0.00 175.76 174.30 1a72 s VAL 13 N 3.50 4.15 -0.49 0.00 1.01 0.25 -4.41 120.40 124.42 1a72 s VAL 13 Ca 0.40 -0.27 -0.14 0.00 0.00 0.00 0.00 61.98 61.97 1a72 s VAL 13 Cb -0.12 -2.82 0.10 0.00 0.00 0.00 0.00 36.38 33.53 1a72 s VAL 13 CO 0.17 0.50 0.41 -0.22 0.00 0.00 0.00 175.10 175.96 1a72 s LEU 14 N 0.23 5.79 0.15 3.92 0.20 0.04 -1.26 118.68 127.76 1a72 s LEU 14 Ca -0.01 -1.56 0.08 0.00 0.69 0.00 0.00 54.13 53.34 1a72 s LEU 14 Cb -0.13 -2.16 -0.11 0.00 -0.43 0.00 0.00 46.19 43.35 1a72 s LEU 14 CO 0.02 -0.72 1.34 -0.50 -0.29 0.00 0.00 176.35 176.20 1a72 h TRP 15 N 8.74 0.00 -2.21 5.38 4.06 -1.86 -0.14 115.95 129.93 1a72 h TRP 15 Ca -0.28 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.60 1a72 h TRP 15 Cb 1.10 0.00 -0.20 0.00 -1.00 0.00 0.00 29.16 29.06 1a72 h TRP 15 CO 0.67 0.91 0.07 -1.83 -3.56 0.00 0.00 178.44 174.69 1a72 s GLU 16 N -2.84 0.88 0.47 0.49 -1.05 -1.26 -4.32 118.70 111.07 1a72 s GLU 16 Ca 0.01 0.47 -0.24 0.00 -0.15 0.00 0.00 54.97 55.06 1a72 s GLU 16 Cb 0.10 0.42 -0.08 0.00 -0.44 0.00 0.00 34.13 34.13 1a72 s GLU 16 CO 0.81 -0.21 1.36 -0.85 0.95 0.00 0.00 175.26 177.32 1a72 n GLU 17 N 1.73 2.00 -2.46 -4.83 0.00 -1.26 -2.59 120.64 113.22 1a72 n GLU 17 Ca -0.17 0.72 -0.09 0.00 0.00 0.00 0.00 57.16 57.62 1a72 n GLU 17 Cb 0.56 -2.55 0.01 0.00 0.00 0.00 0.00 31.44 29.46 1a72 n GLU 17 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1a72 n LYS 18 N -0.37 -1.68 -4.16 3.44 5.02 0.55 -4.94 118.16 116.02 1a72 n LYS 18 Ca 0.07 0.39 -0.16 0.00 -2.02 0.00 0.00 58.31 56.59 1a72 n LYS 18 Cb 0.42 -4.21 -0.12 0.00 -0.02 0.00 0.00 35.03 31.10 1a72 n LYS 18 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1a72 s LYS 19 N -4.86 0.69 1.07 1.97 -0.14 -1.07 -5.08 119.74 112.32 1a72 s LYS 19 Ca 0.09 -0.77 -0.13 0.00 -1.36 0.00 0.00 55.97 53.80 1a72 s LYS 19 Cb -0.04 -0.59 0.23 0.00 -1.68 0.00 0.00 37.83 35.75 1a72 s LYS 19 CO 0.11 0.13 1.07 -2.14 -0.76 0.00 0.00 175.35 173.77 1a72 s PRO 20 N -1.42 -0.14 0.50 -1.68 0.02 -1.26 -4.94 135.00 126.08 1a72 s PRO 20 Ca -0.04 0.57 -0.15 0.00 0.02 0.00 0.00 61.00 61.40 1a72 s PRO 20 Cb -0.09 -1.67 -0.07 0.00 0.02 0.00 0.00 34.50 32.69 1a72 s PRO 20 CO 0.01 -3.13 0.95 -0.06 -0.33 0.00 0.00 177.00 174.44 1a72 s PHE 21 N -2.81 3.48 -0.18 6.54 0.08 -1.26 -4.77 117.98 119.06 1a72 s PHE 21 Ca 0.67 1.36 -0.02 0.00 0.12 0.00 0.00 56.93 59.05 1a72 s PHE 21 Cb -0.21 -2.71 -0.00 0.00 -0.57 0.00 0.00 43.02 39.53 1a72 s PHE 21 CO 0.60 -0.35 -0.11 -1.12 -0.10 0.00 0.00 175.22 174.14 1a72 s SER 22 N -3.23 3.95 -0.37 1.36 0.01 -0.39 -4.87 113.70 110.17 1a72 s SER 22 Ca 0.57 -0.43 -0.29 0.00 1.31 0.00 0.00 55.95 57.11 1a72 s SER 22 Cb -0.10 -1.64 0.00 0.00 0.21 0.00 0.00 66.02 64.49 1a72 s SER 22 CO 0.34 0.04 1.48 -0.63 0.41 0.00 0.00 173.24 174.89 1a72 s ILE 23 N 1.07 3.84 0.13 1.44 -1.09 -1.26 -0.58 121.20 124.75 1a72 s ILE 23 Ca 0.00 0.88 0.06 0.00 -2.23 0.00 0.00 60.65 59.36 1a72 s ILE 23 Cb -0.15 -4.06 -0.04 0.00 -1.58 0.00 0.00 42.46 36.64 1a72 s ILE 23 CO -0.02 -0.62 -0.03 -1.61 -1.23 0.00 0.00 174.94 171.43 1a72 s GLU 24 N 4.94 2.38 -0.26 2.79 0.41 0.47 -4.88 118.70 124.54 1a72 s GLU 24 Ca 0.65 -0.99 -0.24 0.00 -0.41 0.00 0.00 54.97 53.98 1a72 s GLU 24 Cb -0.17 -2.41 -0.00 0.00 -1.78 0.00 0.00 34.13 29.77 1a72 s GLU 24 CO 0.31 0.50 0.80 -2.00 -0.49 0.00 0.00 175.26 174.38 1a72 s GLU 25 N -2.52 4.11 0.24 1.61 2.56 -1.26 -1.52 118.70 121.92 1a72 s GLU 25 Ca 0.25 0.79 0.07 0.00 0.00 0.00 0.00 54.97 56.08 1a72 s GLU 25 Cb -0.11 -3.67 -0.05 0.00 2.00 0.00 0.00 34.13 32.30 1a72 s GLU 25 CO 0.17 -0.56 -0.09 0.14 -0.56 0.00 0.00 175.26 174.37 1a72 s VAL 26 N 2.85 1.61 -0.11 3.70 -7.23 0.29 -4.36 120.40 117.16 1a72 s VAL 26 Ca 0.33 -2.15 -0.00 0.00 -1.81 0.00 0.00 61.98 58.35 1a72 s VAL 26 Cb -0.15 -2.27 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 1a72 s VAL 26 CO 0.09 -0.43 -0.10 -1.61 -0.31 0.00 0.00 175.10 172.75 1a72 s GLU 27 N -3.71 3.15 -0.59 4.82 2.02 -0.28 0.81 118.70 124.93 1a72 s GLU 27 Ca 0.26 -0.61 0.00 0.00 0.02 0.00 0.00 54.97 54.64 1a72 s GLU 27 Cb 0.02 -2.65 0.15 0.00 0.10 0.00 0.00 34.13 31.75 1a72 s GLU 27 CO 0.09 0.40 0.37 0.08 0.02 0.00 0.00 175.26 176.22 1a72 s VAL 28 N -0.11 3.24 0.46 2.63 1.01 0.37 -2.73 120.40 125.27 1a72 s VAL 28 Ca 0.00 -3.15 -0.21 0.00 0.00 0.00 0.00 61.98 58.61 1a72 s VAL 28 Cb -0.13 -3.16 -0.12 0.00 0.00 0.00 0.00 36.38 32.97 1a72 s VAL 28 CO 0.03 -0.85 0.52 0.00 0.00 0.00 0.00 175.10 174.80 1a72 n ALA 29 N 3.28 -1.46 -0.66 5.51 0.00 -0.93 -2.37 120.51 123.88 1a72 n ALA 29 Ca 0.07 0.11 -0.30 0.00 0.00 0.00 0.00 53.44 53.32 1a72 n ALA 29 Cb 0.35 -1.77 0.18 0.00 0.00 0.00 0.00 19.45 18.21 1a72 n ALA 29 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1a72 s PRO 30 N -1.67 0.65 0.05 0.00 0.04 -1.26 -4.88 135.00 127.93 1a72 s PRO 30 Ca 0.64 1.42 -0.26 0.00 0.04 0.00 0.00 61.00 62.84 1a72 s PRO 30 Cb -0.56 -1.69 -0.05 0.00 0.04 0.00 0.00 34.50 32.23 1a72 s PRO 30 CO 0.58 -2.84 0.82 -1.25 0.04 0.00 0.00 177.00 174.34 1a72 s PRO 31 N -4.61 4.54 0.00 0.56 0.04 -1.26 -5.06 135.00 129.21 1a72 s PRO 31 Ca 0.67 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1a72 s PRO 31 Cb -0.23 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1a72 s PRO 31 CO 0.59 0.24 0.00 1.63 0.04 0.00 0.00 177.00 179.50 1a72 n LYS 32 N 2.90 1.16 -1.74 4.56 5.02 -1.26 -4.30 118.16 124.50 1a72 n LYS 32 Ca -0.01 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 1a72 n LYS 32 Cb 0.50 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.49 1a72 n LYS 32 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a72 s ALA 33 N -3.51 3.87 -1.47 7.82 0.00 -1.26 -2.32 121.76 124.88 1a72 s ALA 33 Ca 0.00 1.59 -0.01 0.00 0.00 0.00 0.00 51.96 53.54 1a72 s ALA 33 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1a72 s ALA 33 CO 0.00 -0.95 0.11 0.72 0.00 0.00 0.00 175.76 175.63 1a72 n HIS 34 N 3.26 -1.01 -4.40 0.00 8.25 0.95 -4.78 115.22 117.49 1a72 n HIS 34 Ca 0.13 0.09 -0.24 0.00 -0.26 0.00 0.00 57.72 57.44 1a72 n HIS 34 Cb 0.36 -3.61 -0.11 0.00 1.12 0.00 0.00 29.99 27.75 1a72 n HIS 34 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1a72 s GLU 35 N -5.01 1.46 -0.04 -0.41 2.02 -0.98 -0.38 118.70 115.36 1a72 s GLU 35 Ca 0.05 -1.56 -0.01 0.00 0.02 0.00 0.00 54.97 53.48 1a72 s GLU 35 Cb -0.02 -1.58 0.03 0.00 0.10 0.00 0.00 34.13 32.65 1a72 s GLU 35 CO 0.07 0.32 0.02 0.08 0.02 0.00 0.00 175.26 175.76 1a72 s VAL 36 N -2.15 0.10 -0.33 2.63 1.01 0.16 -0.39 120.40 121.43 1a72 s VAL 36 Ca 0.22 0.20 -0.14 0.00 0.00 0.00 0.00 61.98 62.25 1a72 s VAL 36 Cb -0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 36.05 1a72 s VAL 36 CO 0.10 0.16 0.31 -0.60 0.00 0.00 0.00 175.10 175.07 1a72 s ARG 37 N 1.47 3.58 0.12 2.72 3.52 0.11 -0.21 118.95 130.27 1a72 s ARG 37 Ca -0.04 -0.48 0.00 0.00 -0.13 0.00 0.00 55.73 55.09 1a72 s ARG 37 Cb -0.13 -3.79 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 1a72 s ARG 37 CO -0.03 -0.46 0.29 0.42 -0.81 0.00 0.00 175.30 174.71 1a72 s ILE 38 N 1.89 5.31 -0.42 4.11 1.01 0.22 -0.88 121.20 132.44 1a72 s ILE 38 Ca 0.09 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 60.20 1a72 s ILE 38 Cb -0.17 -3.69 0.07 0.00 0.01 0.00 0.00 42.46 38.68 1a72 s ILE 38 CO 0.11 -0.01 0.27 -0.75 0.00 0.00 0.00 174.94 174.57 1a72 s LYS 39 N -2.92 2.72 0.19 2.79 2.20 0.33 -1.59 119.74 123.46 1a72 s LYS 39 Ca 0.36 -1.35 -0.31 0.00 -0.36 0.00 0.00 55.97 54.31 1a72 s LYS 39 Cb -0.12 -3.83 -0.10 0.00 -1.51 0.00 0.00 37.83 32.27 1a72 s LYS 39 CO 0.28 -0.91 1.48 -1.64 -0.36 0.00 0.00 175.35 174.20 1a72 s MET 40 N 1.49 4.26 -0.15 4.03 -1.94 -0.83 -0.34 119.30 125.82 1a72 s MET 40 Ca 0.03 2.27 0.04 0.00 -1.71 0.00 0.00 55.69 56.32 1a72 s MET 40 Cb -0.22 -3.16 -0.12 0.00 2.01 0.00 0.00 34.83 33.34 1a72 s MET 40 CO 0.04 -0.50 -0.08 0.28 -0.01 0.00 0.00 175.02 174.75 1a72 n VAL 41 N 3.36 0.89 -3.62 -6.03 0.31 -1.14 -4.74 118.33 107.36 1a72 n VAL 41 Ca 0.11 -0.40 -0.15 0.00 -0.01 0.00 0.00 64.34 63.89 1a72 n VAL 41 Cb 0.40 -0.94 -0.07 0.00 -0.91 0.00 0.00 33.84 32.32 1a72 n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1a72 s ALA 42 N -2.31 -1.64 -0.03 3.52 0.00 -1.00 -1.59 121.76 118.71 1a72 s ALA 42 Ca -0.17 1.63 -0.02 0.00 0.00 0.00 0.00 51.96 53.40 1a72 s ALA 42 Cb 0.05 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.48 1a72 s ALA 42 CO 0.41 -0.33 0.08 -0.08 0.00 0.00 0.00 175.76 175.84 1a72 s THR 43 N -0.20 -0.02 0.45 0.00 -1.32 -0.53 -1.12 115.64 112.91 1a72 s THR 43 Ca -0.04 0.07 0.02 0.00 -1.21 0.00 0.00 61.69 60.52 1a72 s THR 43 Cb -0.03 -0.12 0.00 0.00 -1.51 0.00 0.00 72.50 70.84 1a72 s THR 43 CO 0.04 0.03 0.65 -0.83 -2.21 0.00 0.00 174.62 172.30 1a72 s GLY 44 N 0.40 1.64 -0.22 6.08 0.00 0.87 0.45 107.32 116.54 1a72 s GLY 44 Ca -0.03 -1.21 -0.05 0.00 0.00 0.00 0.00 44.72 43.43 1a72 s GLY 44 CO -0.01 -1.03 0.01 -0.42 0.00 0.00 0.00 173.10 171.64 1a72 s ILE 45 N -2.52 3.91 0.09 0.90 1.01 -0.26 -4.59 121.20 119.74 1a72 s ILE 45 Ca 0.50 -0.32 0.08 0.00 0.00 0.00 0.00 60.65 60.91 1a72 s ILE 45 Cb -0.10 -2.79 -0.03 0.00 0.01 0.00 0.00 42.46 39.55 1a72 s ILE 45 CO 0.37 0.40 -0.21 0.00 0.00 0.00 0.00 174.94 175.50 1a72 h ARG 47 N 4.30 0.30 -0.38 0.00 9.65 -1.99 0.29 114.38 126.57 1a72 h ARG 47 Ca -0.45 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.41 1a72 h ARG 47 Cb 1.17 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.67 1a72 h ARG 47 CO 0.41 0.20 0.21 0.77 2.80 0.00 0.00 179.97 184.36 1a72 h SER 48 N 0.31 0.45 -0.39 -3.80 0.02 -1.99 0.24 113.55 108.39 1a72 h SER 48 Ca 0.72 -0.02 -0.15 0.00 -0.84 0.00 0.00 61.79 61.50 1a72 h SER 48 Cb 1.78 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 64.20 1a72 h SER 48 CO -0.50 0.36 -0.33 0.44 -1.14 0.00 0.00 176.83 175.66 1a72 h ASP 49 N 0.52 0.97 0.28 3.07 3.32 -0.84 -2.78 116.42 120.95 1a72 h ASP 49 Ca 0.14 -0.45 -0.07 0.00 0.02 0.00 0.00 57.03 56.67 1a72 h ASP 49 Cb 0.01 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1a72 h ASP 49 CO -0.02 1.21 -0.31 -0.78 -1.72 0.00 0.00 179.24 177.62 1a72 h ASP 50 N 0.74 0.06 -0.66 6.45 3.58 -0.87 -2.69 116.42 123.03 1a72 h ASP 50 Ca 0.07 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 1a72 h ASP 50 Cb 0.92 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.92 1a72 h ASP 50 CO 0.08 0.38 0.37 0.45 -2.88 0.00 0.00 179.24 177.65 1a72 h HIS 51 N 0.06 0.89 -0.58 0.28 3.86 -0.33 -2.57 115.15 116.75 1a72 h HIS 51 Ca 0.01 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.32 1a72 h HIS 51 Cb 0.59 -0.29 -0.09 0.00 1.06 0.00 0.00 27.41 28.68 1a72 h HIS 51 CO 0.00 0.62 0.08 0.28 0.86 0.00 0.00 177.93 179.78 1a72 h VAL 52 N 0.89 0.61 -0.22 2.45 2.07 -1.40 -0.52 116.25 120.13 1a72 h VAL 52 Ca 0.23 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.73 1a72 h VAL 52 Cb 0.01 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.12 1a72 h VAL 52 CO -0.04 0.04 -0.06 0.58 0.02 0.00 0.00 177.57 178.11 1a72 h VAL 53 N 0.21 0.77 0.00 2.57 2.07 -1.50 -2.56 116.25 117.80 1a72 h VAL 53 Ca 0.30 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.78 1a72 h VAL 53 Cb 0.46 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1a72 h VAL 53 CO -0.43 0.00 -0.20 0.77 0.02 0.00 0.00 177.57 177.73 1a72 h SER 54 N -0.01 0.00 0.00 0.57 4.64 -0.85 1.60 113.55 119.50 1a72 h SER 54 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1a72 h SER 54 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1a72 h SER 54 CO -0.23 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 1a72 n GLY 55 N -0.33 2.37 0.39 -0.77 0.00 -0.55 -4.73 105.19 101.57 1a72 n GLY 55 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 1a72 n GLY 55 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1a72 h THR 56 N 0.00 0.04 -3.33 2.61 2.02 -1.81 -3.02 112.91 109.42 1a72 h THR 56 Ca 0.00 0.00 -0.71 0.00 0.77 0.00 0.00 66.41 66.47 1a72 h THR 56 Cb 0.00 0.04 -0.20 0.00 -1.74 0.00 0.00 68.15 66.26 1a72 h THR 56 CO 0.00 0.00 -0.14 -0.22 0.37 0.00 0.00 175.52 175.53 1a72 s LEU 57 N -10.71 5.18 -0.11 2.58 0.20 -1.22 -4.36 118.68 110.25 1a72 s LEU 57 Ca -0.14 -1.01 -0.30 0.00 0.69 0.00 0.00 54.13 53.38 1a72 s LEU 57 Cb 0.16 -2.34 -0.01 0.00 -0.43 0.00 0.00 46.19 43.57 1a72 s LEU 57 CO 0.67 -0.74 1.04 -0.69 -0.29 0.00 0.00 176.35 176.35 1a72 s VAL 58 N 2.17 4.69 0.02 1.68 1.01 -1.14 -4.13 120.40 124.69 1a72 s VAL 58 Ca 0.10 1.97 -0.22 0.00 0.00 0.00 0.00 61.98 63.84 1a72 s VAL 58 Cb -0.21 -4.27 0.05 0.00 0.00 0.00 0.00 36.38 31.95 1a72 s VAL 58 CO 0.10 -0.01 0.49 0.28 0.00 0.00 0.00 175.10 175.96 1a72 s THR 59 N 2.16 0.03 0.21 3.92 -1.32 -1.26 -4.74 115.64 114.65 1a72 s THR 59 Ca 0.49 -0.29 -0.32 0.00 -1.21 0.00 0.00 61.69 60.36 1a72 s THR 59 Cb -0.19 -0.91 -0.14 0.00 -1.51 0.00 0.00 72.50 69.75 1a72 s THR 59 CO 0.17 -0.16 1.35 -2.65 -2.21 0.00 0.00 174.62 171.13 1a72 n PRO 60 N 0.67 1.78 -4.38 7.08 -0.02 -1.26 -5.02 135.00 133.85 1a72 n PRO 60 Ca -0.19 0.64 -0.31 0.00 -2.02 0.00 0.00 63.50 61.62 1a72 n PRO 60 Cb 0.59 -2.26 -0.11 0.00 -0.02 0.00 0.00 33.50 31.70 1a72 n PRO 60 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1a72 s LEU 61 N 0.33 2.98 0.73 2.45 2.01 -1.26 -4.17 118.68 121.74 1a72 s LEU 61 Ca 0.71 -0.33 -0.12 0.00 0.01 0.00 0.00 54.13 54.40 1a72 s LEU 61 Cb -0.72 -1.76 0.03 0.00 0.01 0.00 0.00 46.19 43.75 1a72 s LEU 61 CO 0.49 0.22 1.08 -2.16 1.01 0.00 0.00 176.35 177.00 1a72 s PRO 62 N -1.84 2.56 0.10 1.29 0.04 -1.26 -4.93 135.00 130.96 1a72 s PRO 62 Ca 0.19 1.15 -0.16 0.00 0.04 0.00 0.00 61.00 62.22 1a72 s PRO 62 Cb -0.11 -1.93 0.03 0.00 0.04 0.00 0.00 34.50 32.53 1a72 s PRO 62 CO 0.10 -1.41 0.39 0.54 0.04 0.00 0.00 177.00 176.67 1a72 s VAL 63 N -2.82 0.07 -0.40 -0.36 0.11 -0.06 -1.35 120.40 115.59 1a72 s VAL 63 Ca 0.61 -0.56 -0.04 0.00 -2.93 0.00 0.00 61.98 59.06 1a72 s VAL 63 Cb -0.17 -1.10 0.10 0.00 -1.53 0.00 0.00 36.38 33.68 1a72 s VAL 63 CO 0.52 -0.31 0.19 -0.63 -3.33 0.00 0.00 175.10 171.54 1a72 s ILE 64 N -3.36 3.42 0.00 7.04 1.01 -0.81 -0.78 121.20 127.73 1a72 s ILE 64 Ca 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 60.65 58.80 1a72 s ILE 64 Cb 0.01 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.23 1a72 s ILE 64 CO -0.09 -0.58 0.00 0.00 0.00 0.00 0.00 174.94 174.27 1a72 n ALA 65 N 4.66 0.00 -0.00 9.38 0.00 -1.26 -3.57 120.51 129.71 1a72 n ALA 65 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1a72 n ALA 65 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1a72 n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a72 n GLY 66 N 2.45 -1.31 0.00 0.00 0.00 -1.26 -0.68 105.19 104.40 1a72 n GLY 66 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1a72 n GLY 66 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1a72 n HIS 67 N 0.90 0.00 -3.81 1.61 1.44 -1.26 -0.95 115.22 113.15 1a72 n HIS 67 Ca 0.00 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.35 1a72 n HIS 67 Cb 0.00 0.01 -0.12 0.00 0.12 0.00 0.00 29.99 29.99 1a72 n HIS 67 CO 0.00 0.00 0.00 -2.00 -2.81 0.00 0.00 176.34 171.53 1a72 s GLU 68 N 0.00 2.21 -0.05 -1.40 2.12 -1.26 -4.49 118.70 115.82 1a72 s GLU 68 Ca 0.00 -1.57 -0.31 0.00 0.36 0.00 0.00 54.97 53.46 1a72 s GLU 68 Cb 0.00 -3.44 0.11 0.00 0.26 0.00 0.00 34.13 31.06 1a72 s GLU 68 CO 0.00 -0.88 1.00 0.00 -0.54 0.00 0.00 175.26 174.84 1a72 s ALA 69 N 1.21 -1.90 0.02 6.30 0.00 -1.25 -0.09 121.76 126.04 1a72 s ALA 69 Ca 0.03 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.13 1a72 s ALA 69 Cb -0.21 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.15 1a72 s ALA 69 CO -0.02 -0.69 -0.03 0.00 0.00 0.00 0.00 175.76 175.02 1a72 s ALA 70 N -2.89 0.14 0.00 0.00 0.00 -0.27 -3.29 121.76 115.45 1a72 s ALA 70 Ca 0.07 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1a72 s ALA 70 Cb -0.01 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.22 1a72 s ALA 70 CO -0.07 -0.11 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1a72 n GLY 71 N 1.92 2.93 3.34 0.00 0.00 -0.18 -2.37 105.19 110.83 1a72 n GLY 71 Ca -0.21 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 1a72 n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a72 s ILE 72 N -2.56 2.73 -0.14 -0.61 -1.09 0.54 -1.32 121.20 118.76 1a72 s ILE 72 Ca 0.00 -0.79 -0.29 0.00 -2.23 0.00 0.00 60.65 57.34 1a72 s ILE 72 Cb 0.00 -2.11 -0.03 0.00 -1.58 0.00 0.00 42.46 38.74 1a72 s ILE 72 CO 0.00 0.54 1.50 -0.69 -1.23 0.00 0.00 174.94 175.07 1a72 s VAL 73 N 0.19 3.86 -0.06 2.92 1.01 -0.11 0.12 120.40 128.34 1a72 s VAL 73 Ca -0.10 1.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.87 1a72 s VAL 73 Cb -0.16 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 1a72 s VAL 73 CO 0.06 -0.16 -0.07 1.05 0.00 0.00 0.00 175.10 175.98 1a72 h GLU 74 N 9.35 0.00 -6.37 2.72 -0.00 -1.33 0.21 114.58 119.15 1a72 h GLU 74 Ca -0.33 0.00 -0.60 0.00 -0.00 0.00 0.00 59.36 58.43 1a72 h GLU 74 Cb 1.14 0.00 -0.20 0.00 -0.00 0.00 0.00 28.75 29.70 1a72 h GLU 74 CO 0.97 0.00 -0.82 -1.54 -0.00 0.00 0.00 179.01 177.62 1a72 s SER 75 N -4.44 3.01 -0.11 3.06 1.04 -1.08 -4.47 113.70 110.72 1a72 s SER 75 Ca -0.06 -0.81 0.03 0.00 0.48 0.00 0.00 55.95 55.59 1a72 s SER 75 Cb 0.01 -0.20 0.01 0.00 0.10 0.00 0.00 66.02 65.94 1a72 s SER 75 CO 0.09 0.07 -0.20 0.27 0.98 0.00 0.00 173.24 174.45 1a72 s ILE 76 N -1.57 1.80 0.00 -1.02 -4.36 -1.26 -0.71 121.20 114.07 1a72 s ILE 76 Ca 0.15 -0.84 0.00 0.00 -0.26 0.00 0.00 60.65 59.70 1a72 s ILE 76 Cb -0.08 -1.59 0.00 0.00 1.25 0.00 0.00 42.46 42.04 1a72 s ILE 76 CO 0.07 0.50 0.00 0.61 0.24 0.00 0.00 174.94 176.36 1a72 n GLY 77 N 3.85 -2.85 3.76 6.27 0.00 0.47 -4.92 105.19 111.76 1a72 n GLY 77 Ca -0.20 -1.31 -0.31 0.00 0.00 0.00 0.00 46.02 44.20 1a72 n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a72 s GLU 78 N -0.87 2.10 0.00 1.61 2.02 -1.16 -3.53 118.70 118.86 1a72 s GLU 78 Ca 0.00 1.22 0.00 0.00 0.02 0.00 0.00 54.97 56.21 1a72 s GLU 78 Cb 0.00 -1.88 0.00 0.00 0.10 0.00 0.00 34.13 32.35 1a72 s GLU 78 CO 0.00 -1.77 0.00 0.41 0.02 0.00 0.00 175.26 173.92 1a72 n GLY 79 N -1.01 0.00 3.62 -1.39 0.00 -1.26 -0.04 105.19 105.11 1a72 n GLY 79 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1a72 n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a72 s VAL 80 N -0.82 3.10 -0.09 1.61 1.01 -1.23 -4.79 120.40 119.19 1a72 s VAL 80 Ca 0.00 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.15 1a72 s VAL 80 Cb 0.00 -3.12 -0.10 0.00 0.00 0.00 0.00 36.38 33.17 1a72 s VAL 80 CO 0.00 -0.06 -0.01 0.35 0.00 0.00 0.00 175.10 175.38 1a72 n THR 81 N 7.07 0.62 0.30 3.92 -2.24 -1.26 -4.66 114.28 118.03 1a72 n THR 81 Ca 0.26 -0.33 0.18 0.00 -2.27 0.00 0.00 64.05 61.88 1a72 n THR 81 Cb 0.44 -0.81 0.85 0.00 -2.10 0.00 0.00 70.33 68.71 1a72 n THR 81 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1a72 h THR 82 N 0.00 0.00 -4.08 4.28 1.35 -1.97 -3.44 112.91 109.05 1a72 h THR 82 Ca -0.24 -0.21 -0.13 0.00 -0.55 0.00 0.00 66.41 65.28 1a72 h THR 82 Cb 1.49 1.10 -0.13 0.00 -1.73 0.00 0.00 68.15 68.88 1a72 h THR 82 CO -0.00 0.00 -0.44 0.68 -0.25 0.00 0.00 175.52 175.51 1a72 s VAL 83 N -3.78 0.08 0.01 6.82 -7.23 -1.26 -4.64 120.40 110.40 1a72 s VAL 83 Ca -0.01 -1.58 -0.04 0.00 -1.81 0.00 0.00 61.98 58.54 1a72 s VAL 83 Cb 0.10 -1.92 -0.01 0.00 0.56 0.00 0.00 36.38 35.11 1a72 s VAL 83 CO 0.42 -0.35 0.06 -0.13 -0.31 0.00 0.00 175.10 174.80 1a72 s ARG 84 N -4.00 0.43 0.83 4.82 0.52 -1.26 -4.95 118.95 115.34 1a72 s ARG 84 Ca 0.20 -0.54 -0.14 0.00 -0.52 0.00 0.00 55.73 54.73 1a72 s ARG 84 Cb 0.05 0.17 0.04 0.00 0.52 0.00 0.00 34.95 35.73 1a72 s ARG 84 CO 0.01 -0.09 0.79 -2.30 0.02 0.00 0.00 175.30 173.73 1a72 n PRO 85 N 1.40 0.03 0.00 3.54 -0.02 -1.26 -2.48 135.00 136.21 1a72 n PRO 85 Ca -0.23 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 1a72 n PRO 85 Cb 0.56 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1a72 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1a72 n GLY 86 N 1.09 3.21 3.71 -1.23 0.00 0.73 -4.95 105.19 107.75 1a72 n GLY 86 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1a72 n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a72 s ASP 87 N -0.53 6.44 0.16 1.61 1.01 -1.04 -4.64 116.67 119.69 1a72 s ASP 87 Ca 0.00 2.76 -0.30 0.00 0.71 0.00 0.00 52.55 55.72 1a72 s ASP 87 Cb 0.00 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.27 1a72 s ASP 87 CO 0.00 -0.95 1.08 -0.54 0.21 0.00 0.00 175.17 174.96 1a72 s LYS 88 N 1.80 4.61 0.18 8.23 -0.14 -1.26 -0.93 119.74 132.22 1a72 s LYS 88 Ca 0.76 1.67 -0.10 0.00 -1.36 0.00 0.00 55.97 56.93 1a72 s LYS 88 Cb -0.47 -3.30 -0.00 0.00 -1.68 0.00 0.00 37.83 32.38 1a72 s LYS 88 CO 0.33 0.09 0.34 0.14 -0.76 0.00 0.00 175.35 175.49 1a72 s VAL 89 N -0.14 0.05 -0.09 3.17 -7.23 -0.43 -1.19 120.40 114.54 1a72 s VAL 89 Ca 0.49 -1.33 0.00 0.00 -1.81 0.00 0.00 61.98 59.34 1a72 s VAL 89 Cb -0.28 -1.88 0.02 0.00 0.56 0.00 0.00 36.38 34.80 1a72 s VAL 89 CO 0.34 -0.22 -0.08 -0.63 -0.31 0.00 0.00 175.10 174.20 1a72 s ILE 90 N -3.97 0.93 0.56 -0.62 1.01 -0.26 -1.02 121.20 117.83 1a72 s ILE 90 Ca 0.18 -0.28 -0.21 0.00 0.00 0.00 0.00 60.65 60.34 1a72 s ILE 90 Cb 0.02 -0.93 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 1a72 s ILE 90 CO 0.01 0.34 1.27 -2.84 0.00 0.00 0.00 174.94 173.72 1a72 s PRO 91 N 1.35 3.14 -0.27 2.79 0.02 -1.21 -2.04 135.00 138.78 1a72 s PRO 91 Ca -0.02 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.01 1a72 s PRO 91 Cb -0.14 -2.14 0.05 0.00 0.02 0.00 0.00 34.50 32.29 1a72 s PRO 91 CO -0.04 -1.12 -0.07 -0.51 -0.33 0.00 0.00 177.00 174.94 1a72 s LEU 92 N -3.69 3.52 0.14 -5.54 1.43 0.57 -4.75 118.68 110.36 1a72 s LEU 92 Ca 0.73 -1.24 0.21 0.00 -1.03 0.00 0.00 54.13 52.80 1a72 s LEU 92 Cb -0.35 -1.63 0.85 0.00 0.03 0.00 0.00 46.19 45.10 1a72 s LEU 92 CO 0.40 -0.20 1.64 -2.67 0.23 0.00 0.00 176.35 175.75 1a72 n TRP 93 N 4.55 0.47 -4.06 0.29 4.27 -1.26 -4.04 117.44 117.66 1a72 n TRP 93 Ca -0.14 0.18 -0.32 0.00 -3.89 0.00 0.00 57.50 53.33 1a72 n TRP 93 Cb 0.44 -0.79 -0.15 0.00 -1.36 0.00 0.00 31.31 29.45 1a72 n TRP 93 CO 0.00 0.00 0.00 -0.08 -2.29 0.00 0.00 177.69 175.32 1a72 s THR 94 N -3.16 2.18 0.87 -1.67 -1.32 -1.26 -4.73 115.64 106.54 1a72 s THR 94 Ca 0.06 -1.76 -0.14 0.00 -1.21 0.00 0.00 61.69 58.64 1a72 s THR 94 Cb 0.10 -2.35 0.22 0.00 -1.51 0.00 0.00 72.50 68.97 1a72 s THR 94 CO 0.37 -0.13 0.57 -2.65 -2.21 0.00 0.00 174.62 170.57 1a72 n PRO 95 N 4.40 -3.40 -2.76 7.08 -0.02 -1.26 -4.58 135.00 134.46 1a72 n PRO 95 Ca -0.11 -0.95 -0.05 0.00 -2.02 0.00 0.00 63.50 60.37 1a72 n PRO 95 Cb 0.42 -1.12 0.02 0.00 -0.02 0.00 0.00 33.50 32.80 1a72 n PRO 95 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1a72 n GLN 96 N -4.14 0.61 0.10 -0.52 7.27 -1.08 -4.34 117.38 115.28 1a72 n GLN 96 Ca 0.09 -1.96 0.11 0.00 0.07 0.00 0.00 57.00 55.31 1a72 n GLN 96 Cb 0.37 -1.47 0.44 0.00 2.41 0.00 0.00 30.24 31.99 1a72 n GLN 96 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1a72 n GLY 98 N -0.03 0.61 0.00 0.00 0.00 -1.26 -4.78 105.19 99.73 1a72 n GLY 98 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1a72 n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1a72 n LYS 99 N -2.56 1.95 -2.55 1.61 5.02 -1.26 -4.80 118.16 115.56 1a72 n LYS 99 Ca -0.20 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 55.88 1a72 n LYS 99 Cb 0.62 -0.18 0.11 0.00 -0.02 0.00 0.00 35.03 35.56 1a72 n LYS 99 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a72 h ARG 101 N 0.00 -0.16 -0.62 0.00 3.08 -1.99 -1.39 114.38 113.30 1a72 h ARG 101 Ca -0.31 0.01 0.05 0.00 0.07 0.00 0.00 59.98 59.81 1a72 h ARG 101 Cb 1.17 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 31.21 1a72 h ARG 101 CO 0.34 -0.11 0.34 0.28 -1.07 0.00 0.00 179.97 179.76 1a72 h VAL 102 N -0.17 0.98 -0.06 2.04 2.07 -1.92 0.28 116.25 119.47 1a72 h VAL 102 Ca 0.05 -0.22 -0.16 0.00 0.82 0.00 0.00 66.70 67.18 1a72 h VAL 102 Cb 0.23 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1a72 h VAL 102 CO -0.12 0.12 -0.69 0.00 0.02 0.00 0.00 177.57 176.89 1a72 h LYS 104 N 0.18 0.08 -7.02 0.00 1.79 -0.97 -3.45 116.57 107.18 1a72 h LYS 104 Ca -0.02 -0.07 -0.54 0.00 -2.18 0.00 0.00 60.65 57.84 1a72 h LYS 104 Cb 1.24 0.02 0.11 0.00 -1.58 0.00 0.00 32.23 32.02 1a72 h LYS 104 CO 0.11 0.77 0.60 -1.58 -1.08 0.00 0.00 179.45 178.27 1a72 s HIS 105 N -3.43 2.49 -1.08 -1.35 2.46 0.96 -4.87 115.29 110.48 1a72 s HIS 105 Ca -0.02 1.39 0.26 0.00 0.47 0.00 0.00 55.06 57.16 1a72 s HIS 105 Cb 0.12 -3.73 1.13 0.00 -0.13 0.00 0.00 32.58 29.97 1a72 s HIS 105 CO 0.79 -2.56 1.83 -2.30 -2.47 0.00 0.00 174.74 170.03 1a72 n PRO 106 N -0.63 0.07 -0.01 2.88 -0.02 -1.26 -4.31 135.00 131.72 1a72 n PRO 106 Ca 0.08 0.06 -0.04 0.00 -2.02 0.00 0.00 63.50 61.57 1a72 n PRO 106 Cb 0.45 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.41 1a72 n PRO 106 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1a72 n GLU 107 N -1.46 0.18 -1.44 -0.52 4.07 -1.26 -5.06 120.64 115.15 1a72 n GLU 107 Ca 0.07 0.07 -0.37 0.00 -0.06 0.00 0.00 57.16 56.88 1a72 n GLU 107 Cb 0.28 -0.81 0.06 0.00 -0.06 0.00 0.00 31.44 30.91 1a72 n GLU 107 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1a72 n GLY 108 N 2.75 -0.93 0.00 8.31 0.00 -1.26 -4.94 105.19 109.11 1a72 n GLY 108 Ca -0.07 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1a72 n GLY 108 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1a72 n ASN 109 N -0.55 2.88 -4.44 1.61 6.94 -1.26 -4.56 115.26 115.88 1a72 n ASN 109 Ca 0.12 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.55 1a72 n ASN 109 Cb 0.49 0.31 -0.10 0.00 -2.36 0.00 0.00 39.78 38.12 1a72 n ASN 109 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 1a72 n PHE 110 N -1.32 0.72 -1.64 -2.53 7.35 -1.26 -4.84 117.46 113.94 1a72 n PHE 110 Ca 0.00 -0.15 -0.46 0.00 -0.76 0.00 0.00 57.45 56.08 1a72 n PHE 110 Cb 0.26 -2.20 -0.03 0.00 0.35 0.00 0.00 39.48 37.86 1a72 n PHE 110 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1a72 h LEU 112 N 4.03 0.44 -3.53 0.00 3.38 -1.94 -2.29 115.31 115.41 1a72 h LEU 112 Ca -0.44 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.35 1a72 h LEU 112 Cb 1.29 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.88 1a72 h LEU 112 CO 0.75 0.29 0.03 0.29 0.09 0.00 0.00 178.44 179.89 1a72 n LYS 113 N -4.47 1.58 -2.89 1.13 5.02 -1.26 -4.84 118.16 112.43 1a72 n LYS 113 Ca 0.07 -0.85 -0.19 0.00 -2.02 0.00 0.00 58.31 55.32 1a72 n LYS 113 Cb 0.22 -1.51 0.03 0.00 -0.02 0.00 0.00 35.03 33.75 1a72 n LYS 113 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1a72 s ASN 114 N 1.44 5.37 -0.13 4.39 2.20 -0.86 -4.76 114.94 122.58 1a72 s ASN 114 Ca 0.30 -0.39 0.15 0.00 -0.94 0.00 0.00 52.86 51.99 1a72 s ASN 114 Cb 0.18 -0.50 0.35 0.00 -2.00 0.00 0.00 41.25 39.28 1a72 s ASN 114 CO -0.03 -1.04 1.17 -0.67 -2.94 0.00 0.00 177.10 173.60 1a72 n ASP 115 N -2.12 1.57 -0.08 3.54 2.03 -1.26 -4.76 116.55 115.47 1a72 n ASP 115 Ca 0.10 -3.18 -0.23 0.00 0.52 0.00 0.00 54.79 52.00 1a72 n ASP 115 Cb 0.60 -0.43 -0.12 0.00 -0.72 0.00 0.00 41.12 40.45 1a72 n ASP 115 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1a72 n LEU 116 N -0.78 2.22 0.30 -2.67 0.00 -1.26 -3.54 117.00 111.26 1a72 n LEU 116 Ca 0.14 0.29 -0.17 0.00 0.00 0.00 0.00 56.01 56.27 1a72 n LEU 116 Cb 0.77 -0.97 -0.08 0.00 0.00 0.00 0.00 43.42 43.13 1a72 n LEU 116 CO -0.02 0.57 0.67 0.28 0.00 0.00 0.00 177.39 178.88 1a72 h SER 117 N -0.60 -0.72 -2.81 1.96 0.02 -1.98 -3.34 113.55 106.08 1a72 h SER 117 Ca -0.47 0.04 -0.61 0.00 -0.84 0.00 0.00 61.79 59.91 1a72 h SER 117 Cb 1.63 0.21 -0.41 0.00 0.14 0.00 0.00 62.40 63.97 1a72 h SER 117 CO -0.16 -0.47 -0.69 0.80 -1.14 0.00 0.00 176.83 175.17 1a72 n MET 118 N -5.43 1.47 -1.60 3.45 0.00 -1.26 -5.09 117.12 108.65 1a72 n MET 118 Ca -0.12 -4.16 -0.46 0.00 -0.00 0.00 0.00 57.70 52.97 1a72 n MET 118 Cb 0.33 -2.11 -0.02 0.00 0.00 0.00 0.00 33.22 31.42 1a72 n MET 118 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1a72 n PRO 119 N 2.05 1.41 0.00 2.12 -0.02 -1.23 -4.88 135.00 134.45 1a72 n PRO 119 Ca 0.23 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1a72 n PRO 119 Cb 0.39 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1a72 n PRO 119 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1a72 n ARG 120 N 1.13 2.85 -3.14 -0.52 1.74 -1.26 -4.74 116.66 112.72 1a72 n ARG 120 Ca 0.11 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.05 1a72 n ARG 120 Cb 0.30 -0.96 0.05 0.00 -1.02 0.00 0.00 32.46 30.84 1a72 n ARG 120 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1a72 n GLY 121 N 2.92 -0.04 3.28 -0.13 0.00 -1.26 -4.61 105.19 105.35 1a72 n GLY 121 Ca 0.00 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 1a72 n GLY 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1a72 s THR 122 N -3.22 0.05 0.71 2.61 -4.23 -1.26 -0.55 115.64 109.75 1a72 s THR 122 Ca 0.27 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.70 1a72 s THR 122 Cb -0.12 -2.49 0.16 0.00 1.34 0.00 0.00 72.50 71.39 1a72 s THR 122 CO 0.48 0.00 0.97 0.23 -0.54 0.00 0.00 174.62 175.76 1a72 n MET 123 N -0.57 -0.62 -0.29 3.99 2.81 0.24 -4.44 117.12 118.24 1a72 n MET 123 Ca 0.05 -1.88 0.04 0.00 -1.81 0.00 0.00 57.70 54.10 1a72 n MET 123 Cb 0.63 -0.88 0.18 0.00 -0.71 0.00 0.00 33.22 32.44 1a72 n MET 123 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1a72 h GLN 124 N 0.00 0.69 0.00 0.03 1.08 -1.98 -1.95 115.11 112.98 1a72 h GLN 124 Ca -0.32 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.84 1a72 h GLN 124 Cb 0.97 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 28.24 1a72 h GLN 124 CO 0.26 0.46 0.00 -0.40 -0.95 0.00 0.00 178.83 178.20 1a72 n ASP 125 N -4.80 0.00 0.00 1.46 5.68 -1.26 -4.83 116.55 112.81 1a72 n ASP 125 Ca 0.14 -0.09 0.00 0.00 -0.50 0.00 0.00 54.79 54.34 1a72 n ASP 125 Cb 0.32 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 1a72 n ASP 125 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a72 n GLY 126 N -0.14 0.79 3.99 6.12 0.00 -0.73 -5.05 105.19 110.18 1a72 n GLY 126 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1a72 n GLY 126 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1a72 s THR 127 N -2.57 2.12 -0.03 2.61 -4.23 -1.26 -4.80 115.64 107.48 1a72 s THR 127 Ca 0.00 -1.14 0.04 0.00 -1.18 0.00 0.00 61.69 59.41 1a72 s THR 127 Cb 0.00 -2.26 -0.00 0.00 1.34 0.00 0.00 72.50 71.57 1a72 s THR 127 CO 0.00 0.00 -0.16 -0.55 -0.54 0.00 0.00 174.62 173.37 1a72 s SER 128 N -4.52 1.99 -0.19 3.99 0.15 -1.26 -0.59 113.70 113.27 1a72 s SER 128 Ca 0.54 -0.32 0.08 0.00 0.70 0.00 0.00 55.95 56.95 1a72 s SER 128 Cb -0.05 -0.48 0.54 0.00 -1.71 0.00 0.00 66.02 64.32 1a72 s SER 128 CO 0.34 0.15 1.40 0.54 1.20 0.00 0.00 173.24 176.87 1a72 n ARG 129 N 3.06 3.35 -4.32 5.44 5.12 -1.26 -4.92 116.66 123.14 1a72 n ARG 129 Ca -0.17 -2.13 -0.21 0.00 -1.93 0.00 0.00 57.85 53.41 1a72 n ARG 129 Cb 0.53 -1.99 -0.13 0.00 -1.16 0.00 0.00 32.46 29.72 1a72 n ARG 129 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1a72 s PHE 130 N -2.21 1.39 -0.22 -1.55 0.08 -1.26 -2.19 117.98 112.03 1a72 s PHE 130 Ca 0.37 -0.40 -0.18 0.00 0.12 0.00 0.00 56.93 56.85 1a72 s PHE 130 Cb 0.29 -0.80 0.06 0.00 -0.57 0.00 0.00 43.02 42.00 1a72 s PHE 130 CO 0.10 0.08 0.56 0.99 -0.10 0.00 0.00 175.22 176.85 1a72 s THR 131 N -1.03 -0.00 -0.17 0.64 2.01 -1.11 -1.51 115.64 114.47 1a72 s THR 131 Ca 0.02 0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.04 1a72 s THR 131 Cb -0.09 -0.80 0.03 0.00 0.01 0.00 0.00 72.50 71.65 1a72 s THR 131 CO 0.02 0.01 -0.15 0.00 -0.69 0.00 0.00 174.62 173.80 1a72 n ARG 133 N 4.69 -2.49 0.00 0.00 1.74 -1.26 -0.97 116.66 118.37 1a72 n ARG 133 Ca -0.18 0.41 0.00 0.00 -0.77 0.00 0.00 57.85 57.31 1a72 n ARG 133 Cb 0.49 -4.29 0.00 0.00 -1.02 0.00 0.00 32.46 27.64 1a72 n ARG 133 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1a72 n GLY 134 N -1.89 2.37 3.73 -0.13 0.00 -1.26 -4.96 105.19 103.05 1a72 n GLY 134 Ca -0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 1a72 n GLY 134 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1a72 s LYS 135 N 0.00 4.53 0.18 1.61 2.20 -0.14 -4.98 119.74 123.13 1a72 s LYS 135 Ca 0.00 1.17 -0.31 0.00 -0.36 0.00 0.00 55.97 56.47 1a72 s LYS 135 Cb 0.00 -3.41 -0.09 0.00 -1.51 0.00 0.00 37.83 32.82 1a72 s LYS 135 CO 0.00 0.14 1.38 -1.25 -0.36 0.00 0.00 175.35 175.26 1a72 s PRO 136 N 0.42 4.33 -0.13 4.03 0.04 -1.26 0.16 135.00 142.59 1a72 s PRO 136 Ca 0.43 2.13 -0.01 0.00 0.04 0.00 0.00 61.00 63.59 1a72 s PRO 136 Cb -0.20 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 1a72 s PRO 136 CO 0.24 -0.37 -0.10 0.42 0.04 0.00 0.00 177.00 177.23 1a72 s ILE 137 N 0.52 3.35 0.67 0.56 -1.09 -0.57 -4.85 121.20 119.80 1a72 s ILE 137 Ca 0.61 -0.56 -0.16 0.00 -2.23 0.00 0.00 60.65 58.32 1a72 s ILE 137 Cb -0.38 -2.42 0.01 0.00 -1.58 0.00 0.00 42.46 38.08 1a72 s ILE 137 CO 0.36 0.52 1.15 -1.00 -1.23 0.00 0.00 174.94 174.74 1a72 s HIS 138 N 0.25 2.41 0.44 3.97 3.76 -0.45 -4.25 115.29 121.43 1a72 s HIS 138 Ca -0.07 1.57 -0.01 0.00 -0.15 0.00 0.00 55.06 56.39 1a72 s HIS 138 Cb -0.15 -3.30 -0.02 0.00 1.11 0.00 0.00 32.58 30.22 1a72 s HIS 138 CO 0.04 -2.02 0.68 -1.01 -0.85 0.00 0.00 174.74 171.58 1a72 s HIS 139 N -2.13 3.37 -0.12 1.40 3.76 0.28 -1.92 115.29 119.94 1a72 s HIS 139 Ca 0.71 0.42 0.01 0.00 -0.15 0.00 0.00 55.06 56.04 1a72 s HIS 139 Cb -0.24 -2.24 0.02 0.00 1.11 0.00 0.00 32.58 31.22 1a72 s HIS 139 CO 0.41 -0.26 -0.13 0.12 -0.85 0.00 0.00 174.74 174.03 1a72 s PHE 140 N -2.57 1.89 -0.87 1.40 5.36 -1.23 -4.14 117.98 117.81 1a72 s PHE 140 Ca 0.46 -0.93 -0.03 0.00 -0.96 0.00 0.00 56.93 55.47 1a72 s PHE 140 Cb -0.10 -1.40 0.03 0.00 -0.34 0.00 0.00 43.02 41.20 1a72 s PHE 140 CO 0.39 -0.52 0.15 1.28 -1.46 0.00 0.00 175.22 175.06 1a72 n LEU 141 N 4.45 -0.95 -2.45 6.12 4.32 -1.26 0.65 117.00 127.89 1a72 n LEU 141 Ca -0.18 0.07 -0.20 0.00 -0.02 0.00 0.00 56.01 55.69 1a72 n LEU 141 Cb 0.51 -1.83 -0.01 0.00 -1.62 0.00 0.00 43.42 40.47 1a72 n LEU 141 CO 0.22 -0.01 -0.24 0.61 -1.22 0.00 0.00 177.39 176.75 1a72 n GLY 142 N -0.83 -0.50 1.64 -0.72 0.00 -1.26 -4.60 105.19 98.92 1a72 n GLY 142 Ca -0.07 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1a72 n GLY 142 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a72 n THR 143 N -3.97 0.32 -3.41 2.61 -2.24 0.21 -4.53 114.28 103.27 1a72 n THR 143 Ca -0.23 0.11 -0.18 0.00 -2.27 0.00 0.00 64.05 61.48 1a72 n THR 143 Cb 0.68 -0.89 0.01 0.00 -2.10 0.00 0.00 70.33 68.02 1a72 n THR 143 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1a72 n SER 144 N -3.26 -6.21 0.01 3.42 7.64 -0.71 -4.64 113.62 109.87 1a72 n SER 144 Ca 0.00 -0.37 0.13 0.00 1.01 0.00 0.00 58.87 59.63 1a72 n SER 144 Cb 0.05 -3.19 0.34 0.00 -1.01 0.00 0.00 64.21 60.40 1a72 n SER 144 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1a72 n THR 145 N -1.64 0.07 -1.18 0.44 -2.24 0.15 -4.22 114.28 105.65 1a72 n THR 145 Ca -0.13 -0.05 -0.22 0.00 -2.27 0.00 0.00 64.05 61.38 1a72 n THR 145 Cb 0.61 -0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.71 1a72 n THR 145 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1a72 n PHE 146 N -1.60 0.95 -3.73 4.78 3.72 -0.95 -4.72 117.46 115.91 1a72 n PHE 146 Ca 0.06 -2.05 -0.14 0.00 -0.05 0.00 0.00 57.45 55.26 1a72 n PHE 146 Cb 0.35 -1.84 -0.09 0.00 -0.94 0.00 0.00 39.48 36.96 1a72 n PHE 146 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1a72 s SER 147 N 1.82 -0.32 0.50 4.37 0.15 -1.26 -0.21 113.70 118.75 1a72 s SER 147 Ca 0.66 0.40 0.29 0.00 0.70 0.00 0.00 55.95 58.00 1a72 s SER 147 Cb 0.28 0.51 1.15 0.00 -1.71 0.00 0.00 66.02 66.25 1a72 s SER 147 CO -0.04 -0.36 1.91 1.56 1.20 0.00 0.00 173.24 177.51 1a72 h GLN 148 N 4.32 0.00 -3.88 5.44 4.20 -1.44 -3.42 115.11 120.34 1a72 h GLN 148 Ca -0.28 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.19 1a72 h GLN 148 Cb 1.17 0.00 -0.27 0.00 0.30 0.00 0.00 27.48 28.69 1a72 h GLN 148 CO 0.35 0.11 -0.72 0.71 -0.67 0.00 0.00 178.83 178.61 1a72 s TYR 149 N -3.69 0.13 0.08 2.96 1.51 -1.26 -1.97 117.35 115.10 1a72 s TYR 149 Ca 0.01 -0.11 -0.08 0.00 -1.01 0.00 0.00 57.07 55.88 1a72 s TYR 149 Cb 0.10 -0.08 -0.00 0.00 -0.11 0.00 0.00 41.96 41.86 1a72 s TYR 149 CO 0.59 -0.03 0.17 -0.08 -1.11 0.00 0.00 175.55 175.09 1a72 s THR 150 N -0.28 0.14 -0.16 -0.71 -1.32 -0.62 -4.98 115.64 107.71 1a72 s THR 150 Ca -0.02 -1.18 0.00 0.00 -1.21 0.00 0.00 61.69 59.28 1a72 s THR 150 Cb -0.02 -1.27 0.03 0.00 -1.51 0.00 0.00 72.50 69.73 1a72 s THR 150 CO -0.00 -0.65 -0.11 -0.69 -2.21 0.00 0.00 174.62 170.96 1a72 s VAL 151 N -3.61 1.46 0.07 5.08 1.01 -1.26 0.71 120.40 123.86 1a72 s VAL 151 Ca 0.03 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.40 1a72 s VAL 151 Cb 0.04 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 1a72 s VAL 151 CO -0.10 0.31 -0.25 0.68 0.00 0.00 0.00 175.10 175.75 1a72 s VAL 152 N 1.51 2.07 1.07 2.92 -7.23 0.70 -4.80 120.40 116.64 1a72 s VAL 152 Ca 0.03 -1.48 -0.12 0.00 -1.81 0.00 0.00 61.98 58.60 1a72 s VAL 152 Cb -0.14 -1.80 0.23 0.00 0.56 0.00 0.00 36.38 35.23 1a72 s VAL 152 CO -0.09 0.23 1.07 -1.81 -0.31 0.00 0.00 175.10 174.18 1a72 s ASP 153 N -1.51 1.75 0.37 4.85 1.01 -1.26 0.36 116.67 122.23 1a72 s ASP 153 Ca 0.11 1.68 0.12 0.00 0.71 0.00 0.00 52.55 55.17 1a72 s ASP 153 Cb -0.10 -2.35 0.72 0.00 1.01 0.00 0.00 42.92 42.21 1a72 s ASP 153 CO 0.03 -3.75 1.84 -0.08 0.21 0.00 0.00 175.17 173.42 1a72 h GLU 154 N -2.31 0.06 0.00 8.23 4.81 -1.02 -1.96 114.58 122.38 1a72 h GLU 154 Ca -0.55 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 1a72 h GLU 154 Cb 1.31 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 1a72 h GLU 154 CO 0.49 0.39 0.00 0.44 -0.73 0.00 0.00 179.01 179.59 1a72 n ILE 155 N -4.13 0.76 -1.14 2.32 -5.35 -1.26 -2.83 119.36 107.73 1a72 n ILE 155 Ca -0.02 0.07 -0.03 0.00 -0.27 0.00 0.00 62.75 62.51 1a72 n ILE 155 Cb 0.38 -1.00 0.26 0.00 -1.74 0.00 0.00 39.64 37.55 1a72 n ILE 155 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1a72 n SER 156 N -2.29 4.00 -3.94 7.28 7.64 -0.74 -2.65 113.62 122.92 1a72 n SER 156 Ca 0.03 -3.32 -0.10 0.00 1.01 0.00 0.00 58.87 56.49 1a72 n SER 156 Cb 0.29 -0.67 -0.12 0.00 -1.01 0.00 0.00 64.21 62.70 1a72 n SER 156 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1a72 s VAL 157 N -3.03 0.08 -0.02 0.44 0.11 -1.13 -0.31 120.40 116.54 1a72 s VAL 157 Ca 0.50 -0.64 0.00 0.00 -2.93 0.00 0.00 61.98 58.91 1a72 s VAL 157 Cb 0.41 -0.20 0.02 0.00 -1.53 0.00 0.00 36.38 35.08 1a72 s VAL 157 CO 0.09 -0.35 0.01 0.00 -3.33 0.00 0.00 175.10 171.52 1a72 s ALA 158 N -1.03 0.17 -0.06 1.54 0.00 -0.87 -4.91 121.76 116.60 1a72 s ALA 158 Ca -0.11 0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 1a72 s ALA 158 Cb -0.07 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 1a72 s ALA 158 CO -0.01 -0.06 1.10 0.21 0.00 0.00 0.00 175.76 177.00 1a72 s LYS 159 N 0.78 4.41 0.00 0.00 2.20 -1.26 -1.11 119.74 124.76 1a72 s LYS 159 Ca -0.07 1.54 0.00 0.00 -0.36 0.00 0.00 55.97 57.08 1a72 s LYS 159 Cb -0.10 -3.52 0.00 0.00 -1.51 0.00 0.00 37.83 32.69 1a72 s LYS 159 CO -0.02 -0.34 0.00 0.44 -0.36 0.00 0.00 175.35 175.08 1a72 n ILE 160 N 4.46 0.00 -2.43 5.43 -5.35 -0.34 -4.57 119.36 116.56 1a72 n ILE 160 Ca 0.09 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 62.16 1a72 n ILE 160 Cb 0.48 -0.18 -0.03 0.00 -1.74 0.00 0.00 39.64 38.17 1a72 n ILE 160 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1a72 s ASP 161 N -0.45 7.11 0.46 7.28 -1.08 -1.26 -4.63 116.67 124.10 1a72 s ASP 161 Ca 0.00 2.05 0.29 0.00 -0.52 0.00 0.00 52.55 54.37 1a72 s ASP 161 Cb 0.00 -2.59 1.57 0.00 -1.46 0.00 0.00 42.92 40.45 1a72 s ASP 161 CO 0.00 -0.42 1.87 0.00 0.52 0.00 0.00 175.17 177.15 1a72 h ALA 162 N 6.34 1.04 -0.35 3.66 0.00 -1.99 0.42 119.26 128.39 1a72 h ALA 162 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1a72 h ALA 162 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1a72 h ALA 162 CO 0.79 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.99 1a72 n ALA 163 N -1.86 2.42 -1.68 0.00 0.00 -1.26 -4.98 120.51 113.15 1a72 n ALA 163 Ca -0.02 -0.97 -0.44 0.00 0.00 0.00 0.00 53.44 52.01 1a72 n ALA 163 Cb 0.10 -0.86 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 1a72 n ALA 163 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1a72 n SER 164 N 1.48 3.77 -4.57 0.00 7.64 0.15 -4.88 113.62 117.21 1a72 n SER 164 Ca 0.19 0.99 -0.41 0.00 1.01 0.00 0.00 58.87 60.65 1a72 n SER 164 Cb 0.61 -1.49 -0.03 0.00 -1.01 0.00 0.00 64.21 62.29 1a72 n SER 164 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 1a72 s PRO 165 N 2.85 3.24 0.11 1.43 0.02 -1.26 -4.84 135.00 136.55 1a72 s PRO 165 Ca 0.84 0.19 0.09 0.00 0.02 0.00 0.00 61.00 62.14 1a72 s PRO 165 Cb -0.55 -4.15 0.46 0.00 0.02 0.00 0.00 34.50 30.27 1a72 s PRO 165 CO 0.41 -2.04 1.28 1.28 -0.33 0.00 0.00 177.00 177.60 1a72 n LEU 166 N 9.59 0.20 0.04 -5.54 4.77 -1.26 -1.07 117.00 123.73 1a72 n LEU 166 Ca 0.09 0.59 0.13 0.00 -0.03 0.00 0.00 56.01 56.78 1a72 n LEU 166 Cb 0.49 -0.60 0.34 0.00 -2.33 0.00 0.00 43.42 41.32 1a72 n LEU 166 CO 0.71 -0.61 0.62 -0.62 -1.33 0.00 0.00 177.39 176.16 1a72 n GLU 167 N -1.76 0.15 -0.01 3.23 4.71 -1.26 -3.84 120.64 121.86 1a72 n GLU 167 Ca 0.00 0.07 -0.01 0.00 -0.01 0.00 0.00 57.16 57.21 1a72 n GLU 167 Cb 0.04 -1.62 -0.01 0.00 -1.01 0.00 0.00 31.44 28.84 1a72 n GLU 167 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1a72 n LYS 168 N -1.85 2.76 0.00 3.49 5.02 -0.35 -4.67 118.16 122.56 1a72 n LYS 168 Ca 0.05 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.47 1a72 n LYS 168 Cb 0.39 -1.04 0.58 0.00 -0.02 0.00 0.00 35.03 34.94 1a72 n LYS 168 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1a72 n VAL 169 N -2.19 0.23 0.25 -0.18 0.24 -0.23 -3.10 118.33 113.35 1a72 n VAL 169 Ca -0.03 0.06 0.09 0.00 -2.04 0.00 0.00 64.34 62.42 1a72 n VAL 169 Cb 0.55 -0.63 0.65 0.00 -1.47 0.00 0.00 33.84 32.95 1a72 n VAL 169 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1a72 h LEU 171 N 0.00 0.12 0.00 0.00 3.38 -1.88 0.13 115.31 117.06 1a72 h LEU 171 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1a72 h LEU 171 Cb 0.22 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1a72 h LEU 171 CO 0.01 0.06 0.00 -0.38 0.09 0.00 0.00 178.44 178.23 1a72 n ILE 172 N -4.40 0.00 0.33 1.22 5.41 -0.84 -1.67 119.36 119.41 1a72 n ILE 172 Ca 0.12 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.98 1a72 n ILE 172 Cb 0.60 -0.50 -0.01 0.00 -0.71 0.00 0.00 39.64 39.03 1a72 n ILE 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1a72 n GLY 173 N 0.09 -1.27 0.00 7.39 0.00 0.44 -4.64 105.19 107.21 1a72 n GLY 173 Ca 0.07 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1a72 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a72 n GLY 175 N -0.59 -2.51 0.43 0.00 0.00 -1.15 -0.15 105.19 101.23 1a72 n GLY 175 Ca 0.00 0.75 -0.17 0.00 0.00 0.00 0.00 46.02 46.60 1a72 n GLY 175 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1a72 h PHE 176 N 0.00 -1.01 -0.59 1.61 3.57 -1.64 -2.82 116.94 116.06 1a72 h PHE 176 Ca 0.06 -0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.71 1a72 h PHE 176 Cb 0.16 0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 1a72 h PHE 176 CO -0.85 -0.63 0.43 0.77 -2.23 0.00 0.00 178.31 175.80 1a72 h SER 177 N -1.10 0.00 -0.42 0.41 0.02 -1.67 0.20 113.55 110.99 1a72 h SER 177 Ca -0.11 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.70 1a72 h SER 177 Cb 0.84 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.37 1a72 h SER 177 CO 0.18 0.00 -0.27 0.74 -1.14 0.00 0.00 176.83 176.35 1a72 h THR 178 N 0.00 1.27 0.00 -2.27 2.02 -0.44 -1.04 112.91 112.45 1a72 h THR 178 Ca 0.28 -1.43 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1a72 h THR 178 Cb 1.13 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1a72 h THR 178 CO -0.00 0.48 0.00 0.61 0.37 0.00 0.00 175.52 176.98 1a72 n GLY 179 N -0.01 -0.91 0.31 2.16 0.00 -0.25 -2.84 105.19 103.66 1a72 n GLY 179 Ca -0.01 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.29 1a72 n GLY 179 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1a72 n TYR 180 N -2.00 1.04 0.05 1.61 9.36 0.54 0.88 117.16 128.64 1a72 n TYR 180 Ca 0.00 1.14 -0.05 0.00 3.32 0.00 0.00 57.90 62.31 1a72 n TYR 180 Cb 0.00 -1.49 0.15 0.00 -0.63 0.00 0.00 39.34 37.37 1a72 n TYR 180 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1a72 h GLY 181 N 0.00 0.39 1.23 2.98 0.00 -1.31 -0.23 103.07 106.14 1a72 h GLY 181 Ca 0.78 -0.41 0.03 0.00 0.00 0.00 0.00 47.33 47.73 1a72 h GLY 181 CO -0.77 0.37 0.44 1.76 0.00 0.00 0.00 176.54 178.34 1a72 h SER 182 N 0.29 0.68 0.15 0.19 0.02 0.65 0.62 113.55 116.15 1a72 h SER 182 Ca 0.02 -0.01 -0.32 0.00 -0.84 0.00 0.00 61.79 60.64 1a72 h SER 182 Cb 0.95 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1a72 h SER 182 CO 0.08 0.47 -1.60 0.00 -1.14 0.00 0.00 176.83 174.63 1a72 h ALA 183 N 1.62 0.18 0.00 3.77 0.00 -1.31 0.24 119.26 123.75 1a72 h ALA 183 Ca 0.26 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1a72 h ALA 183 Cb 0.08 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1a72 h ALA 183 CO -0.07 0.94 -0.92 0.28 0.00 0.00 0.00 179.25 179.48 1a72 n VAL 184 N -3.75 0.03 0.00 0.00 0.31 -0.13 -0.98 118.33 113.81 1a72 n VAL 184 Ca -0.25 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 1a72 n VAL 184 Cb 0.99 0.62 0.00 0.00 -0.91 0.00 0.00 33.84 34.54 1a72 n VAL 184 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1a72 n LYS 185 N -1.61 0.00 0.00 5.55 3.00 0.19 -4.65 118.16 120.63 1a72 n LYS 185 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 1a72 n LYS 185 Cb 0.36 -0.71 0.00 0.00 0.00 0.00 0.00 35.03 34.68 1a72 n LYS 185 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1a72 n VAL 186 N -2.40 0.00 -0.20 3.15 0.31 0.49 -4.39 118.33 115.29 1a72 n VAL 186 Ca 0.00 0.24 0.09 0.00 -0.01 0.00 0.00 64.34 64.66 1a72 n VAL 186 Cb 0.36 -0.84 0.39 0.00 -0.91 0.00 0.00 33.84 32.84 1a72 n VAL 186 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1a72 h ALA 187 N -2.00 1.81 -3.91 3.52 0.00 -0.72 -3.47 119.26 114.49 1a72 h ALA 187 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1a72 h ALA 187 Cb 0.00 -0.15 0.09 0.00 0.00 0.00 0.00 17.79 17.73 1a72 h ALA 187 CO 0.00 0.03 -0.41 1.63 0.00 0.00 0.00 179.25 180.50 1a72 n LYS 188 N -4.50 -3.86 -1.41 0.00 5.02 -1.01 -4.97 118.16 107.43 1a72 n LYS 188 Ca 0.13 0.46 -0.44 0.00 -2.02 0.00 0.00 58.31 56.45 1a72 n LYS 188 Cb 0.34 -4.36 -0.01 0.00 -0.02 0.00 0.00 35.03 30.99 1a72 n LYS 188 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1a72 n VAL 189 N -3.05 1.54 -4.32 -0.18 0.31 -0.15 -4.98 118.33 107.49 1a72 n VAL 189 Ca -0.11 -0.50 -0.26 0.00 -0.01 0.00 0.00 64.34 63.46 1a72 n VAL 189 Cb 0.58 -0.28 -0.09 0.00 -0.91 0.00 0.00 33.84 33.13 1a72 n VAL 189 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1a72 s THR 190 N -1.35 3.09 0.07 2.52 -4.23 -1.26 -4.84 115.64 109.64 1a72 s THR 190 Ca 0.62 -1.84 -0.36 0.00 -1.18 0.00 0.00 61.69 58.93 1a72 s THR 190 Cb -0.72 -2.57 -0.15 0.00 1.34 0.00 0.00 72.50 70.41 1a72 s THR 190 CO 0.59 -0.21 1.53 0.00 -0.54 0.00 0.00 174.62 175.99 1a72 n GLN 191 N -0.23 1.66 0.00 3.99 1.13 -1.21 -1.90 117.38 120.82 1a72 n GLN 191 Ca -0.09 0.60 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 1a72 n GLN 191 Cb 0.57 -2.32 0.00 0.00 0.11 0.00 0.00 30.24 28.60 1a72 n GLN 191 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1a72 n GLY 192 N 3.22 2.68 3.17 1.08 0.00 -0.97 -4.89 105.19 109.48 1a72 n GLY 192 Ca 0.19 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 1a72 n GLY 192 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a72 n SER 193 N 0.85 -3.05 -4.07 1.61 3.41 -0.80 -3.35 113.62 108.22 1a72 n SER 193 Ca 0.00 0.03 -0.32 0.00 -0.26 0.00 0.00 58.87 58.32 1a72 n SER 193 Cb 0.00 -0.83 -0.15 0.00 -0.26 0.00 0.00 64.21 62.97 1a72 n SER 193 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1a72 s THR 194 N -2.15 2.04 0.21 6.66 2.01 -1.26 -0.36 115.64 122.78 1a72 s THR 194 Ca 0.48 -1.35 0.05 0.00 0.31 0.00 0.00 61.69 61.18 1a72 s THR 194 Cb -0.07 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 1a72 s THR 194 CO 0.69 0.14 0.25 0.00 -0.69 0.00 0.00 174.62 175.01 1a72 s ALA 196 N -1.92 0.58 -0.19 0.00 0.00 -0.72 -0.99 121.76 118.52 1a72 s ALA 196 Ca 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.29 1a72 s ALA 196 Cb -0.09 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.67 1a72 s ALA 196 CO 0.27 -0.01 -0.17 0.08 0.00 0.00 0.00 175.76 175.93 1a72 s VAL 197 N 0.88 2.28 -0.21 0.00 1.01 0.53 -0.58 120.40 124.31 1a72 s VAL 197 Ca -0.11 -0.90 -0.18 0.00 0.00 0.00 0.00 61.98 60.79 1a72 s VAL 197 Cb -0.14 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 1a72 s VAL 197 CO -0.00 0.49 0.50 -0.36 0.00 0.00 0.00 175.10 175.73 1a72 s PHE 198 N 1.31 3.35 0.00 5.22 0.40 0.11 -0.12 117.98 128.26 1a72 s PHE 198 Ca 0.04 0.73 0.00 0.00 -0.60 0.00 0.00 56.93 57.10 1a72 s PHE 198 Cb -0.14 -2.66 0.00 0.00 0.51 0.00 0.00 43.02 40.74 1a72 s PHE 198 CO -0.11 -0.12 0.00 0.41 0.70 0.00 0.00 175.22 176.10 1a72 n GLY 199 N 3.98 -0.66 1.25 4.36 0.00 0.64 -0.20 105.19 114.55 1a72 n GLY 199 Ca -0.05 -1.15 -0.07 0.00 0.00 0.00 0.00 46.02 44.74 1a72 n GLY 199 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1a72 n LEU 200 N -0.17 4.05 0.00 0.99 4.77 -1.26 -4.45 117.00 120.92 1a72 n LEU 200 Ca 0.00 -4.10 0.00 0.00 -0.03 0.00 0.00 56.01 51.88 1a72 n LEU 200 Cb 0.00 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.54 1a72 n LEU 200 CO 0.00 1.54 0.00 0.61 -1.33 0.00 0.00 177.39 178.21 1a72 n GLY 201 N -1.01 -2.71 0.27 -0.72 0.00 -1.26 -4.45 105.19 95.30 1a72 n GLY 201 Ca 0.33 -1.35 -0.05 0.00 0.00 0.00 0.00 46.02 44.95 1a72 n GLY 201 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1a72 h GLY 202 N -0.33 0.77 1.90 -0.02 0.00 -1.93 -0.38 103.07 103.07 1a72 h GLY 202 Ca 0.00 -0.55 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 1a72 h GLY 202 CO 0.00 0.51 -0.33 0.00 0.00 0.00 0.00 176.54 176.72 1a72 h ALA 203 N 1.25 1.33 0.00 3.60 0.00 -1.90 -1.68 119.26 121.86 1a72 h ALA 203 Ca 0.12 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1a72 h ALA 203 Cb 0.54 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1a72 h ALA 203 CO 0.03 0.47 -0.00 0.78 0.00 0.00 0.00 179.25 180.54 1a72 h GLY 204 N 1.06 -0.00 2.00 0.00 0.00 -1.50 -1.98 103.07 102.65 1a72 h GLY 204 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 1a72 h GLY 204 CO 0.05 -0.00 -0.02 1.41 0.00 0.00 0.00 176.54 177.98 1a72 h LEU 205 N -0.53 0.00 -0.03 3.11 4.07 -0.90 0.26 115.31 121.30 1a72 h LEU 205 Ca -0.00 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.70 1a72 h LEU 205 Cb 0.53 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.28 1a72 h LEU 205 CO 0.00 0.02 -1.06 0.28 -1.08 0.00 0.00 178.44 176.60 1a72 h SER 206 N 0.00 0.78 -0.26 -0.43 0.02 -1.18 -1.93 113.55 110.54 1a72 h SER 206 Ca -0.00 -0.65 -0.03 0.00 -0.84 0.00 0.00 61.79 60.27 1a72 h SER 206 Cb 0.04 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1a72 h SER 206 CO 0.00 1.45 0.06 0.58 -1.14 0.00 0.00 176.83 177.78 1a72 h VAL 207 N 0.32 1.22 -0.71 2.27 2.07 -0.25 -1.17 116.25 119.99 1a72 h VAL 207 Ca -0.13 -0.73 0.07 0.00 0.82 0.00 0.00 66.70 66.73 1a72 h VAL 207 Cb 1.71 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 32.64 1a72 h VAL 207 CO 0.20 0.23 0.47 0.40 0.02 0.00 0.00 177.57 178.89 1a72 h ILE 208 N 0.25 1.01 -0.05 4.57 2.04 -1.04 0.75 117.51 125.04 1a72 h ILE 208 Ca 0.08 -0.25 -0.12 0.00 1.00 0.00 0.00 64.86 65.57 1a72 h ILE 208 Cb 0.30 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1a72 h ILE 208 CO 0.00 0.13 -0.51 0.24 0.00 0.00 0.00 178.15 178.02 1a72 h MET 209 N 0.73 0.13 -0.09 2.37 2.86 -0.97 -2.00 114.93 117.96 1a72 h MET 209 Ca 0.31 -0.08 -0.04 0.00 -2.06 0.00 0.00 59.70 57.83 1a72 h MET 209 Cb 0.28 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 1a72 h MET 209 CO -0.10 0.61 -0.12 0.78 1.06 0.00 0.00 176.91 179.14 1a72 h GLY 210 N 1.44 0.26 1.10 8.32 0.00 0.30 -0.97 103.07 113.52 1a72 h GLY 210 Ca 0.00 -0.28 0.05 0.00 0.00 0.00 0.00 47.33 47.11 1a72 h GLY 210 CO 0.07 0.25 0.47 0.00 0.00 0.00 0.00 176.54 177.33 1a72 h LYS 212 N 0.77 0.77 -0.27 0.00 3.64 -1.19 -0.16 116.57 120.13 1a72 h LYS 212 Ca 0.30 -0.47 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 1a72 h LYS 212 Cb 0.20 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1a72 h LYS 212 CO -0.09 1.10 0.12 0.00 -2.27 0.00 0.00 179.45 178.30 1a72 h ALA 213 N 0.67 1.70 -0.16 5.00 0.00 0.25 -2.30 119.26 124.41 1a72 h ALA 213 Ca 0.02 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 1a72 h ALA 213 Cb 1.03 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1a72 h ALA 213 CO 0.10 0.24 -0.64 0.00 0.00 0.00 0.00 179.25 178.95 1a72 h ALA 214 N 1.76 0.56 0.00 0.00 0.00 -0.13 -3.48 119.26 117.97 1a72 h ALA 214 Ca 0.10 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1a72 h ALA 214 Cb 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1a72 h ALA 214 CO -0.01 0.71 0.00 0.41 0.00 0.00 0.00 179.25 180.35 1a72 n GLY 215 N 0.44 0.96 3.53 0.00 0.00 -0.14 -3.28 105.19 106.70 1a72 n GLY 215 Ca -0.04 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.47 1a72 n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a72 n ALA 216 N -0.21 -1.82 0.06 4.61 0.00 -0.80 -2.28 120.51 120.05 1a72 n ALA 216 Ca 0.00 0.49 0.05 0.00 0.00 0.00 0.00 53.44 53.98 1a72 n ALA 216 Cb 0.00 -1.89 -0.06 0.00 0.00 0.00 0.00 19.45 17.50 1a72 n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a72 n ALA 217 N 1.23 2.20 -3.53 0.00 0.00 0.52 -4.78 120.51 116.15 1a72 n ALA 217 Ca 0.17 -0.44 -0.27 0.00 0.00 0.00 0.00 53.44 52.90 1a72 n ALA 217 Cb 0.21 -0.99 -0.17 0.00 0.00 0.00 0.00 19.45 18.50 1a72 n ALA 217 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1a72 s ARG 218 N -3.12 2.09 -0.28 0.00 3.52 -1.20 -4.91 118.95 115.04 1a72 s ARG 218 Ca -0.02 -0.53 -0.03 0.00 -0.13 0.00 0.00 55.73 55.02 1a72 s ARG 218 Cb 0.09 -1.73 0.09 0.00 -1.56 0.00 0.00 34.95 31.84 1a72 s ARG 218 CO 0.81 -0.00 0.10 0.42 -0.81 0.00 0.00 175.30 175.82 1a72 s ILE 219 N 0.80 0.36 -0.36 4.11 1.01 -1.25 -0.21 121.20 125.66 1a72 s ILE 219 Ca -0.11 -0.94 -0.20 0.00 0.00 0.00 0.00 60.65 59.40 1a72 s ILE 219 Cb -0.16 -1.22 0.00 0.00 0.01 0.00 0.00 42.46 41.09 1a72 s ILE 219 CO 0.02 -0.62 0.60 -0.63 0.00 0.00 0.00 174.94 174.31 1a72 s ILE 220 N 1.89 4.92 -0.15 2.92 1.01 -0.16 -1.29 121.20 130.33 1a72 s ILE 220 Ca 0.08 0.47 -0.15 0.00 0.00 0.00 0.00 60.65 61.05 1a72 s ILE 220 Cb -0.17 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 1a72 s ILE 220 CO -0.27 -0.31 0.36 -0.83 0.00 0.00 0.00 174.94 173.88 1a72 s GLY 221 N 1.80 2.26 -0.09 6.18 0.00 -0.42 -0.35 107.32 116.71 1a72 s GLY 221 Ca 0.23 -0.37 0.04 0.00 0.00 0.00 0.00 44.72 44.61 1a72 s GLY 221 CO 0.15 0.57 -0.21 0.54 0.00 0.00 0.00 173.10 174.14 1a72 s VAL 222 N 0.57 1.83 -0.19 1.40 0.11 0.83 0.55 120.40 125.50 1a72 s VAL 222 Ca 0.20 -0.88 -0.24 0.00 -2.93 0.00 0.00 61.98 58.12 1a72 s VAL 222 Cb -0.14 -1.59 0.06 0.00 -1.53 0.00 0.00 36.38 33.18 1a72 s VAL 222 CO 0.06 0.51 0.64 -0.62 -3.33 0.00 0.00 175.10 172.36 1a72 s ASP 223 N 0.42 -0.65 0.00 3.54 -1.08 -1.14 -0.26 116.67 117.50 1a72 s ASP 223 Ca -0.18 1.12 0.21 0.00 -0.52 0.00 0.00 52.55 53.18 1a72 s ASP 223 Cb -0.17 1.10 1.01 0.00 -1.46 0.00 0.00 42.92 43.40 1a72 s ASP 223 CO 0.08 -0.32 1.67 2.30 0.52 0.00 0.00 175.17 179.42 1a72 n ILE 224 N 2.26 0.42 -3.68 4.11 -5.35 -1.26 -4.14 119.36 111.72 1a72 n ILE 224 Ca -0.15 0.10 -0.39 0.00 -0.27 0.00 0.00 62.75 62.04 1a72 n ILE 224 Cb 0.56 -0.75 -0.11 0.00 -1.74 0.00 0.00 39.64 37.60 1a72 n ILE 224 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1a72 s ASN 225 N -2.71 5.46 0.50 7.28 2.47 -1.26 -4.85 114.94 121.83 1a72 s ASN 225 Ca 0.17 -1.46 0.26 0.00 0.42 0.00 0.00 52.86 52.25 1a72 s ASN 225 Cb 0.14 -1.92 1.34 0.00 -1.45 0.00 0.00 41.25 39.36 1a72 s ASN 225 CO 0.34 -0.47 1.89 0.11 -3.72 0.00 0.00 177.10 175.25 1a72 h LYS 226 N 8.29 0.13 0.00 0.43 1.79 -2.01 -0.81 116.57 124.39 1a72 h LYS 226 Ca -0.22 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.25 1a72 h LYS 226 Cb 1.08 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1a72 h LYS 226 CO 0.69 0.09 0.00 -0.25 -1.08 0.00 0.00 179.45 178.90 1a72 n ASP 227 N -4.37 0.00 -0.87 0.86 8.00 -1.26 -1.78 116.55 117.13 1a72 n ASP 227 Ca 0.18 0.09 0.12 0.00 0.71 0.00 0.00 54.79 55.89 1a72 n ASP 227 Cb 0.83 -0.24 0.11 0.00 -0.02 0.00 0.00 41.12 41.81 1a72 n ASP 227 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1a72 n LYS 228 N -1.24 2.14 0.07 -1.24 4.76 -0.31 -4.48 118.16 117.86 1a72 n LYS 228 Ca 0.04 -1.75 -0.07 0.00 -2.87 0.00 0.00 58.31 53.66 1a72 n LYS 228 Cb 0.06 -1.46 0.09 0.00 -1.84 0.00 0.00 35.03 31.88 1a72 n LYS 228 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1a72 h PHE 229 N 4.28 0.40 0.70 2.13 0.04 -1.54 -3.17 116.94 119.78 1a72 h PHE 229 Ca 0.00 -0.16 -0.03 0.00 2.80 0.00 0.00 57.97 60.58 1a72 h PHE 229 Cb 0.94 -0.07 0.01 0.00 2.20 0.00 0.00 35.95 39.03 1a72 h PHE 229 CO 0.00 0.85 -0.33 0.00 -0.60 0.00 0.00 178.31 178.22 1a72 h ALA 230 N 1.12 -1.07 -0.28 2.45 0.00 -1.80 -0.75 119.26 118.92 1a72 h ALA 230 Ca -0.01 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1a72 h ALA 230 Cb 1.15 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 19.23 1a72 h ALA 230 CO 0.10 -1.00 -0.53 -0.22 0.00 0.00 0.00 179.25 177.60 1a72 h LYS 231 N -1.09 -0.44 -0.60 0.00 1.63 -1.87 0.41 116.57 114.61 1a72 h LYS 231 Ca -0.10 0.03 0.11 0.00 -0.85 0.00 0.00 60.65 59.84 1a72 h LYS 231 Cb 0.72 0.10 -0.12 0.00 -0.60 0.00 0.00 32.23 32.33 1a72 h LYS 231 CO 0.16 -0.29 -0.31 0.00 -3.45 0.00 0.00 179.45 175.55 1a72 h ALA 232 N -0.20 0.02 0.36 5.00 0.00 -1.59 1.37 119.26 124.22 1a72 h ALA 232 Ca 0.05 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1a72 h ALA 232 Cb 0.61 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1a72 h ALA 232 CO -0.51 -0.64 -0.22 0.87 0.00 0.00 0.00 179.25 178.75 1a72 h LYS 233 N -0.14 -0.54 -0.89 0.00 1.57 -0.29 0.48 116.57 116.77 1a72 h LYS 233 Ca 0.25 0.04 0.19 0.00 -1.87 0.00 0.00 60.65 59.25 1a72 h LYS 233 Cb 0.55 0.12 -0.07 0.00 0.08 0.00 0.00 32.23 32.91 1a72 h LYS 233 CO -0.68 -0.36 0.58 1.49 -0.57 0.00 0.00 179.45 179.91 1a72 h GLU 234 N -0.56 0.45 0.00 3.15 4.81 0.15 0.34 114.58 122.92 1a72 h GLU 234 Ca -0.04 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.02 1a72 h GLU 234 Cb 0.46 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1a72 h GLU 234 CO 0.04 0.30 -0.75 0.28 -0.73 0.00 0.00 179.01 178.14 1a72 h VAL 235 N 0.46 1.15 0.00 0.32 2.07 0.24 -3.48 116.25 117.02 1a72 h VAL 235 Ca 0.46 -2.65 0.00 0.00 0.82 0.00 0.00 66.70 65.33 1a72 h VAL 235 Cb 1.07 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 33.39 1a72 h VAL 235 CO -0.18 0.66 0.00 0.61 0.02 0.00 0.00 177.57 178.67 1a72 n GLY 236 N 1.29 0.49 3.67 2.17 0.00 0.15 -4.66 105.19 108.28 1a72 n GLY 236 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.56 1a72 n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a72 n ALA 237 N 0.00 1.19 0.83 4.61 0.00 0.11 -4.81 120.51 122.45 1a72 n ALA 237 Ca 0.00 0.43 0.13 0.00 0.00 0.00 0.00 53.44 54.00 1a72 n ALA 237 Cb 0.00 -2.36 0.50 0.00 0.00 0.00 0.00 19.45 17.59 1a72 n ALA 237 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1a72 n THR 238 N 3.62 0.25 -3.65 0.00 -2.24 -0.41 -4.14 114.28 107.71 1a72 n THR 238 Ca 0.18 -0.13 -0.04 0.00 -2.27 0.00 0.00 64.05 61.80 1a72 n THR 238 Cb 0.28 -0.49 -0.07 0.00 -2.10 0.00 0.00 70.33 67.96 1a72 n THR 238 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1a72 s GLU 239 N -3.05 0.11 0.11 -0.78 -1.05 -1.19 -4.99 118.70 107.87 1a72 s GLU 239 Ca 0.12 0.13 0.08 0.00 -0.15 0.00 0.00 54.97 55.15 1a72 s GLU 239 Cb 0.16 0.06 -0.04 0.00 -0.44 0.00 0.00 34.13 33.87 1a72 s GLU 239 CO 0.57 -0.02 -0.13 0.00 0.95 0.00 0.00 175.26 176.63 1a72 s VAL 241 N -1.21 0.92 -0.37 0.00 -7.23 0.19 -4.89 120.40 107.81 1a72 s VAL 241 Ca 0.20 -0.35 -0.22 0.00 -1.81 0.00 0.00 61.98 59.80 1a72 s VAL 241 Cb -0.11 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 35.80 1a72 s VAL 241 CO 0.12 0.24 0.75 0.21 -0.31 0.00 0.00 175.10 176.11 1a72 s ASN 242 N 1.73 6.51 0.58 4.85 2.47 -1.26 -2.90 114.94 126.93 1a72 s ASN 242 Ca 0.03 0.26 0.28 0.00 0.42 0.00 0.00 52.86 53.85 1a72 s ASN 242 Cb -0.14 -2.38 1.59 0.00 -1.45 0.00 0.00 41.25 38.88 1a72 s ASN 242 CO -0.08 -0.72 2.04 -0.65 -3.72 0.00 0.00 177.10 173.98 1a72 h PRO 243 N 8.52 0.00 0.00 0.43 0.11 -1.91 -1.28 132.00 137.87 1a72 h PRO 243 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1a72 h PRO 243 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1a72 h PRO 243 CO 0.90 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.73 1a72 n GLN 244 N -3.82 0.69 0.09 1.05 6.02 -1.26 -3.27 117.38 116.88 1a72 n GLN 244 Ca 0.04 0.01 -0.04 0.00 -0.01 0.00 0.00 57.00 57.00 1a72 n GLN 244 Cb 0.42 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.12 1a72 n GLN 244 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1a72 h ASP 245 N 0.00 0.00 -2.22 1.08 3.32 -1.65 -3.47 116.42 113.49 1a72 h ASP 245 Ca 0.00 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 56.61 1a72 h ASP 245 Cb 0.09 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.68 1a72 h ASP 245 CO 0.00 0.85 -0.06 -0.31 -1.72 0.00 0.00 179.24 178.00 1a72 s TYR 246 N -2.85 2.67 -0.06 4.55 2.02 -1.20 -5.02 117.35 117.47 1a72 s TYR 246 Ca 0.01 -0.14 0.16 0.00 -0.37 0.00 0.00 57.07 56.74 1a72 s TYR 246 Cb 0.10 -2.69 -0.24 0.00 -0.40 0.00 0.00 41.96 38.73 1a72 s TYR 246 CO 0.80 -0.88 0.27 1.63 -1.57 0.00 0.00 175.55 175.80 1a72 n LYS 247 N -2.30 0.78 -3.42 -0.62 5.02 -1.26 -4.98 118.16 111.38 1a72 n LYS 247 Ca 0.09 -0.11 -0.22 0.00 -2.02 0.00 0.00 58.31 56.05 1a72 n LYS 247 Cb 0.60 -1.39 -0.01 0.00 -0.02 0.00 0.00 35.03 34.21 1a72 n LYS 247 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1a72 s LYS 248 N -2.92 3.32 0.62 1.97 -2.85 -1.26 -5.08 119.74 113.54 1a72 s LYS 248 Ca -0.06 -0.57 -0.18 0.00 -1.00 0.00 0.00 55.97 54.16 1a72 s LYS 248 Cb 0.09 -2.71 -0.02 0.00 -2.06 0.00 0.00 37.83 33.13 1a72 s LYS 248 CO 0.67 0.10 1.20 -2.14 0.10 0.00 0.00 175.35 175.27 1a72 s PRO 249 N -4.28 2.83 0.08 1.78 0.02 -1.26 -4.88 135.00 129.29 1a72 s PRO 249 Ca 0.41 1.79 -0.21 0.00 0.02 0.00 0.00 61.00 63.01 1a72 s PRO 249 Cb -0.10 -1.91 -0.11 0.00 0.02 0.00 0.00 34.50 32.40 1a72 s PRO 249 CO 0.34 -1.31 1.63 -0.84 -0.33 0.00 0.00 177.00 176.49 1a72 h ILE 250 N 0.64 1.15 -0.85 2.83 -2.65 -1.98 -1.95 117.51 114.70 1a72 h ILE 250 Ca -0.50 -0.43 0.23 0.00 1.03 0.00 0.00 64.86 65.18 1a72 h ILE 250 Cb 1.29 1.16 -0.04 0.00 -2.05 0.00 0.00 36.82 37.18 1a72 h ILE 250 CO 0.54 0.14 0.59 0.06 0.03 0.00 0.00 178.15 179.51 1a72 h GLN 251 N 0.09 0.14 0.29 0.16 -0.00 -1.93 0.48 115.11 114.34 1a72 h GLN 251 Ca 0.05 -0.01 -0.01 0.00 -0.00 0.00 0.00 58.65 58.68 1a72 h GLN 251 Cb 0.16 -0.03 0.00 0.00 -0.00 0.00 0.00 27.48 27.61 1a72 h GLN 251 CO -0.00 0.09 -0.14 0.93 -0.00 0.00 0.00 178.83 179.71 1a72 h GLU 252 N 0.14 -0.37 0.00 0.06 5.08 -1.71 -0.21 114.58 117.56 1a72 h GLU 252 Ca 0.42 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1a72 h GLU 252 Cb 1.43 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.76 1a72 h GLU 252 CO -0.07 -0.17 0.00 1.55 -1.00 0.00 0.00 179.01 179.33 1a72 n VAL 253 N -5.20 0.81 0.03 3.13 3.14 0.95 -0.85 118.33 120.32 1a72 n VAL 253 Ca -0.10 0.18 -0.06 0.00 -2.96 0.00 0.00 64.34 61.41 1a72 n VAL 253 Cb 0.21 -1.11 -0.11 0.00 -1.06 0.00 0.00 33.84 31.77 1a72 n VAL 253 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1a72 h LEU 254 N 0.00 0.00 0.01 6.55 -0.00 0.21 -2.42 115.31 119.66 1a72 h LEU 254 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.88 57.74 1a72 h LEU 254 Cb 0.40 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.07 1a72 h LEU 254 CO 0.00 0.89 -0.56 0.71 -0.00 0.00 0.00 178.44 179.48 1a72 h THR 255 N 0.00 1.46 0.34 0.22 1.35 -0.15 -0.36 112.91 115.77 1a72 h THR 255 Ca -0.15 -2.10 -0.00 0.00 -0.55 0.00 0.00 66.41 63.61 1a72 h THR 255 Cb 1.80 2.69 -0.03 0.00 -1.73 0.00 0.00 68.15 70.89 1a72 h THR 255 CO 0.09 0.60 -0.40 -0.33 -0.25 0.00 0.00 175.52 175.23 1a72 h GLU 256 N -0.20 -0.76 -0.52 4.72 5.08 -1.09 0.95 114.58 122.76 1a72 h GLU 256 Ca -0.07 0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.44 1a72 h GLU 256 Cb 1.29 0.17 -0.09 0.00 0.50 0.00 0.00 28.75 30.62 1a72 h GLU 256 CO 0.11 -0.50 -0.05 0.52 -1.00 0.00 0.00 179.01 178.09 1a72 h MET 257 N -0.78 0.07 0.00 2.33 2.86 -1.48 0.16 114.93 118.09 1a72 h MET 257 Ca -0.02 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1a72 h MET 257 Cb 0.72 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.36 1a72 h MET 257 CO -0.10 0.04 0.00 -1.13 1.06 0.00 0.00 176.91 176.78 1a72 n SER 258 N -5.29 0.00 -3.07 1.22 3.41 -0.15 -4.94 113.62 104.81 1a72 n SER 258 Ca 0.06 -0.05 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1a72 n SER 258 Cb 0.28 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1a72 n SER 258 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1a72 n ASN 259 N -1.32 -7.78 0.00 4.04 5.03 0.32 -4.29 115.26 111.26 1a72 n ASN 259 Ca 0.13 -0.08 0.00 0.00 0.87 0.00 0.00 54.58 55.50 1a72 n ASN 259 Cb 0.25 -5.28 0.00 0.00 -1.02 0.00 0.00 39.78 33.74 1a72 n ASN 259 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1a72 n GLY 260 N -1.77 1.09 0.00 7.41 0.00 -0.52 -4.99 105.19 106.41 1a72 n GLY 260 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1a72 n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a72 n GLY 261 N -1.28 1.06 3.73 -0.02 0.00 -1.24 -4.12 105.19 103.32 1a72 n GLY 261 Ca 0.00 -1.52 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 1a72 n GLY 261 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1a72 s VAL 262 N -1.44 2.87 0.05 1.61 -7.23 -0.15 -3.53 120.40 112.58 1a72 s VAL 262 Ca 0.00 0.28 -0.19 0.00 -1.81 0.00 0.00 61.98 60.27 1a72 s VAL 262 Cb 0.00 -2.72 -0.15 0.00 0.56 0.00 0.00 36.38 34.07 1a72 s VAL 262 CO 0.00 -0.37 1.31 0.44 -0.31 0.00 0.00 175.10 176.17 1a72 h ASP 263 N -1.43 0.51 -3.82 4.85 3.32 -1.11 0.53 116.42 119.27 1a72 h ASP 263 Ca -0.47 -0.54 -0.30 0.00 0.02 0.00 0.00 57.03 55.74 1a72 h ASP 263 Cb 1.26 -0.15 -0.29 0.00 0.22 0.00 0.00 39.33 40.38 1a72 h ASP 263 CO 0.52 0.95 -0.75 -0.36 -1.72 0.00 0.00 179.24 177.89 1a72 s PHE 264 N -4.08 0.34 -0.03 4.55 0.08 -1.20 -1.93 117.98 115.71 1a72 s PHE 264 Ca -0.13 -0.06 0.06 0.00 0.12 0.00 0.00 56.93 56.92 1a72 s PHE 264 Cb 0.06 -0.24 -0.01 0.00 -0.57 0.00 0.00 43.02 42.26 1a72 s PHE 264 CO 0.79 -0.02 -0.22 -1.54 -0.10 0.00 0.00 175.22 174.13 1a72 s SER 265 N 0.02 2.59 0.00 1.36 1.04 -0.49 -1.76 113.70 116.47 1a72 s SER 265 Ca 0.00 -0.41 0.06 0.00 0.48 0.00 0.00 55.95 56.08 1a72 s SER 265 Cb -0.03 -0.43 -0.02 0.00 0.10 0.00 0.00 66.02 65.65 1a72 s SER 265 CO -0.00 0.25 -0.18 -0.36 0.98 0.00 0.00 173.24 173.92 1a72 s PHE 266 N -0.37 1.63 -0.26 5.02 0.08 0.26 -0.54 117.98 123.79 1a72 s PHE 266 Ca 0.04 -0.32 0.01 0.00 0.12 0.00 0.00 56.93 56.78 1a72 s PHE 266 Cb -0.10 -1.02 0.05 0.00 -0.57 0.00 0.00 43.02 41.38 1a72 s PHE 266 CO 0.00 0.01 -0.09 -2.00 -0.10 0.00 0.00 175.22 173.04 1a72 s GLU 267 N -0.66 2.39 -0.31 0.44 -6.30 -0.78 0.09 118.70 113.57 1a72 s GLU 267 Ca 0.07 -1.26 0.07 0.00 -2.50 0.00 0.00 54.97 51.34 1a72 s GLU 267 Cb -0.07 -2.95 0.45 0.00 0.00 0.00 0.00 34.13 31.56 1a72 s GLU 267 CO 0.00 -0.54 1.17 1.33 0.02 0.00 0.00 175.26 177.24 1a72 n VAL 268 N 4.51 2.48 -0.00 3.70 0.24 0.71 -1.52 118.33 128.45 1a72 n VAL 268 Ca -0.14 -4.31 -0.01 0.00 -2.04 0.00 0.00 64.34 57.83 1a72 n VAL 268 Cb 0.43 -1.12 -0.00 0.00 -1.47 0.00 0.00 33.84 31.69 1a72 n VAL 268 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1a72 n ILE 269 N -0.67 0.29 0.00 1.34 5.41 -1.25 -4.68 119.36 119.81 1a72 n ILE 269 Ca 0.42 0.22 0.00 0.00 1.00 0.00 0.00 62.75 64.39 1a72 n ILE 269 Cb 0.92 -1.34 0.00 0.00 -0.71 0.00 0.00 39.64 38.51 1a72 n ILE 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1a72 n GLY 270 N 2.74 0.65 3.81 7.39 0.00 -1.26 -4.93 105.19 113.59 1a72 n GLY 270 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1a72 n GLY 270 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a72 s ARG 271 N 0.00 3.32 -0.07 1.61 1.81 -1.26 -4.26 118.95 120.10 1a72 s ARG 271 Ca 0.00 1.14 -0.05 0.00 -1.72 0.00 0.00 55.73 55.10 1a72 s ARG 271 Cb 0.00 -2.04 -0.27 0.00 -0.45 0.00 0.00 34.95 32.19 1a72 s ARG 271 CO 0.00 -0.80 0.55 -0.07 -0.68 0.00 0.00 175.30 174.30 1a72 h LEU 272 N 0.31 0.42 -0.11 2.53 3.38 -1.99 -3.07 115.31 116.78 1a72 h LEU 272 Ca -0.46 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 56.72 1a72 h LEU 272 Cb 1.21 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1a72 h LEU 272 CO 0.58 1.69 0.07 -2.24 0.09 0.00 0.00 178.44 178.63 1a72 h ASP 273 N 0.07 0.13 0.59 -0.43 2.03 -1.97 -2.33 116.42 114.52 1a72 h ASP 273 Ca -0.36 -0.02 -0.05 0.00 -0.73 0.00 0.00 57.03 55.87 1a72 h ASP 273 Cb 2.05 -0.03 -0.01 0.00 -0.83 0.00 0.00 39.33 40.51 1a72 h ASP 273 CO 0.12 0.11 -0.23 0.74 -1.03 0.00 0.00 179.24 178.95 1a72 h THR 274 N 0.14 0.73 -0.48 1.15 2.02 -1.97 -2.70 112.91 111.79 1a72 h THR 274 Ca 0.04 -0.97 -0.00 0.00 0.77 0.00 0.00 66.41 66.25 1a72 h THR 274 Cb -0.00 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 1a72 h THR 274 CO -0.01 0.23 0.30 0.24 0.37 0.00 0.00 175.52 176.65 1a72 h MET 275 N 0.00 0.65 -0.16 6.66 2.86 -1.32 0.11 114.93 123.73 1a72 h MET 275 Ca -0.00 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1a72 h MET 275 Cb 0.59 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.11 1a72 h MET 275 CO 0.03 0.47 -0.07 0.28 1.06 0.00 0.00 176.91 178.67 1a72 h VAL 276 N 0.65 1.31 -0.66 -2.22 2.07 -1.32 -3.03 116.25 113.05 1a72 h VAL 276 Ca 0.17 -1.11 0.08 0.00 0.82 0.00 0.00 66.70 66.66 1a72 h VAL 276 Cb -0.02 1.70 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 1a72 h VAL 276 CO -0.03 0.33 0.32 0.74 0.02 0.00 0.00 177.57 178.95 1a72 h THR 277 N 0.01 0.87 -0.50 2.57 2.02 -1.14 0.03 112.91 116.77 1a72 h THR 277 Ca 0.04 -0.20 0.06 0.00 0.77 0.00 0.00 66.41 67.08 1a72 h THR 277 Cb 0.54 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 1a72 h THR 277 CO 0.02 0.10 0.33 0.00 0.37 0.00 0.00 175.52 176.35 1a72 h ALA 278 N 1.40 1.90 0.13 6.16 0.00 -0.75 -2.16 119.26 125.93 1a72 h ALA 278 Ca 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1a72 h ALA 278 Cb 0.31 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1a72 h ALA 278 CO -0.25 0.02 -0.06 1.25 0.00 0.00 0.00 179.25 180.21 1a72 h LEU 279 N 0.44 -0.15 0.00 0.00 6.46 -1.06 -3.26 115.31 117.76 1a72 h LEU 279 Ca 0.21 -0.41 0.00 0.00 -0.12 0.00 0.00 57.88 57.56 1a72 h LEU 279 Cb 0.28 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1a72 h LEU 279 CO -0.06 0.42 0.16 -1.20 -0.62 0.00 0.00 178.44 177.15 1a72 n SER 280 N -4.89 0.00 -0.18 1.25 7.64 -0.14 -1.96 113.62 115.33 1a72 n SER 280 Ca -0.08 0.27 0.03 0.00 1.01 0.00 0.00 58.87 60.10 1a72 n SER 280 Cb 0.27 -0.27 0.06 0.00 -1.01 0.00 0.00 64.21 63.27 1a72 n SER 280 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a72 n GLN 283 N -1.07 0.88 0.21 0.00 0.00 0.19 -4.62 117.38 112.97 1a72 n GLN 283 Ca -0.08 0.32 0.07 0.00 -0.00 0.00 0.00 57.00 57.31 1a72 n GLN 283 Cb 0.56 -1.95 0.58 0.00 0.00 0.00 0.00 30.24 29.43 1a72 n GLN 283 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 1a72 h GLU 284 N 5.63 0.08 -0.02 3.69 -0.00 -1.91 0.53 114.58 122.59 1a72 h GLU 284 Ca -0.47 -0.01 0.00 0.00 -0.00 0.00 0.00 59.36 58.88 1a72 h GLU 284 Cb 1.34 -0.02 0.00 0.00 -0.00 0.00 0.00 28.75 30.07 1a72 h GLU 284 CO 0.87 0.10 -0.05 0.00 -0.00 0.00 0.00 179.01 179.92 1a72 n ALA 285 N -2.52 2.67 -1.11 1.06 0.00 -1.26 -2.35 120.51 116.99 1a72 n ALA 285 Ca -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1a72 n ALA 285 Cb 0.12 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1a72 n ALA 285 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1a72 n TYR 286 N 0.18 0.00 -2.64 0.00 0.18 -1.06 -4.67 117.16 109.15 1a72 n TYR 286 Ca 0.17 0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.56 1a72 n TYR 286 Cb 0.39 0.15 -0.05 0.00 -0.38 0.00 0.00 39.34 39.45 1a72 n TYR 286 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1a72 s GLY 287 N 0.00 2.99 -0.19 -7.48 0.00 0.18 -4.84 107.32 97.99 1a72 s GLY 287 Ca 0.00 0.70 -0.01 0.00 0.00 0.00 0.00 44.72 45.41 1a72 s GLY 287 CO 0.00 1.24 -0.13 0.14 0.00 0.00 0.00 173.10 174.35 1a72 s VAL 288 N -1.32 2.73 -0.11 1.40 1.01 -0.81 -1.06 120.40 122.24 1a72 s VAL 288 Ca 0.46 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 1a72 s VAL 288 Cb -0.26 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1a72 s VAL 288 CO 0.33 0.49 -0.07 -0.55 0.00 0.00 0.00 175.10 175.30 1a72 s SER 289 N 1.21 4.62 -0.12 3.32 0.15 -0.69 -1.39 113.70 120.80 1a72 s SER 289 Ca 0.02 -0.10 0.03 0.00 0.70 0.00 0.00 55.95 56.60 1a72 s SER 289 Cb -0.14 -1.44 -0.00 0.00 -1.71 0.00 0.00 66.02 62.73 1a72 s SER 289 CO -0.06 0.27 -0.21 -0.69 1.20 0.00 0.00 173.24 173.75 1a72 s VAL 290 N -0.26 2.25 -0.53 4.45 1.01 0.29 -1.54 120.40 126.08 1a72 s VAL 290 Ca 0.04 -0.94 -0.21 0.00 0.00 0.00 0.00 61.98 60.86 1a72 s VAL 290 Cb -0.13 -1.89 0.05 0.00 0.00 0.00 0.00 36.38 34.42 1a72 s VAL 290 CO 0.03 0.55 0.78 -0.63 0.00 0.00 0.00 175.10 175.82 1a72 s ILE 291 N 0.48 4.64 0.23 2.22 1.01 -0.47 -1.86 121.20 127.45 1a72 s ILE 291 Ca -0.14 -0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1a72 s ILE 291 Cb -0.17 -4.42 -0.02 0.00 0.01 0.00 0.00 42.46 37.86 1a72 s ILE 291 CO 0.05 -0.97 1.58 0.58 0.00 0.00 0.00 174.94 176.19 1a72 h VAL 292 N 5.94 1.32 -2.54 2.92 2.07 -1.59 -3.33 116.25 121.04 1a72 h VAL 292 Ca -0.27 -1.71 -0.05 0.00 0.82 0.00 0.00 66.70 65.49 1a72 h VAL 292 Cb 1.08 1.73 -0.16 0.00 -1.52 0.00 0.00 31.29 32.42 1a72 h VAL 292 CO 1.03 0.53 0.13 -0.83 0.02 0.00 0.00 177.57 178.45 1a72 s GLY 293 N -4.16 -0.53 0.02 2.17 0.00 -1.25 -4.79 107.32 98.79 1a72 s GLY 293 Ca -0.06 0.84 0.03 0.00 0.00 0.00 0.00 44.72 45.53 1a72 s GLY 293 CO 0.82 0.51 -0.11 -1.34 0.00 0.00 0.00 173.10 172.98 1a72 s VAL 294 N -2.28 0.82 0.26 1.40 -7.23 -1.26 -4.26 120.40 107.85 1a72 s VAL 294 Ca -0.06 -0.72 -0.30 0.00 -1.81 0.00 0.00 61.98 59.09 1a72 s VAL 294 Cb -0.01 -0.74 -0.10 0.00 0.56 0.00 0.00 36.38 36.09 1a72 s VAL 294 CO 0.00 0.03 1.49 -2.16 -0.31 0.00 0.00 175.10 174.15 1a72 s PRO 295 N -0.78 4.22 0.00 4.82 0.04 -1.26 -4.81 135.00 137.23 1a72 s PRO 295 Ca 0.00 2.38 0.09 0.00 0.04 0.00 0.00 61.00 63.51 1a72 s PRO 295 Cb -0.06 -3.09 0.52 0.00 0.04 0.00 0.00 34.50 31.91 1a72 s PRO 295 CO 0.00 -0.49 0.94 -0.35 0.04 0.00 0.00 177.00 177.15 1a72 n PRO 296 N 2.39 0.41 -0.08 0.56 -0.04 -1.26 -1.21 135.00 135.77 1a72 n PRO 296 Ca 0.08 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.56 1a72 n PRO 296 Cb 0.39 -1.33 0.07 0.00 -0.04 0.00 0.00 33.50 32.59 1a72 n PRO 296 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1a72 n ASP 297 N -0.83 2.30 -4.44 3.54 5.75 -1.26 -4.81 116.55 116.80 1a72 n ASP 297 Ca 0.07 -1.86 -0.33 0.00 -0.01 0.00 0.00 54.79 52.66 1a72 n ASP 297 Cb 0.03 -0.10 0.13 0.00 -1.03 0.00 0.00 41.12 40.15 1a72 n ASP 297 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1a72 n SER 298 N 0.09 -1.77 -2.21 -1.12 3.41 -0.35 -5.05 113.62 106.62 1a72 n SER 298 Ca 0.06 0.31 -0.04 0.00 -0.26 0.00 0.00 58.87 58.94 1a72 n SER 298 Cb 0.31 -1.23 -0.01 0.00 -0.26 0.00 0.00 64.21 63.02 1a72 n SER 298 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a72 n GLN 299 N -2.10 1.67 -2.36 4.33 6.02 -1.26 -5.09 117.38 118.58 1a72 n GLN 299 Ca 0.07 -0.43 -0.43 0.00 -0.01 0.00 0.00 57.00 56.20 1a72 n GLN 299 Cb 0.54 0.14 -0.02 0.00 1.02 0.00 0.00 30.24 31.91 1a72 n GLN 299 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1a72 s ASN 300 N -1.32 6.94 0.10 1.08 0.01 -1.26 -5.02 114.94 115.47 1a72 s ASN 300 Ca 0.00 1.85 -0.23 0.00 -0.71 0.00 0.00 52.86 53.78 1a72 s ASN 300 Cb 0.00 -2.55 -0.07 0.00 0.41 0.00 0.00 41.25 39.04 1a72 s ASN 300 CO 0.00 -0.71 0.68 -1.48 -1.51 0.00 0.00 177.10 174.08 1a72 s LEU 301 N 2.97 4.53 -0.16 0.60 0.05 -1.26 -5.04 118.68 120.37 1a72 s LEU 301 Ca 0.58 1.43 -0.17 0.00 0.05 0.00 0.00 54.13 56.02 1a72 s LEU 301 Cb -0.25 -3.11 -0.04 0.00 -2.05 0.00 0.00 46.19 40.74 1a72 s LEU 301 CO 0.20 0.19 0.45 -0.55 -0.55 0.00 0.00 176.35 176.10 1a72 s SER 302 N -0.85 6.58 -0.12 1.48 0.15 -1.26 -5.06 113.70 114.62 1a72 s SER 302 Ca 0.33 0.69 -0.13 0.00 0.70 0.00 0.00 55.95 57.54 1a72 s SER 302 Cb -0.21 -2.27 0.03 0.00 -1.71 0.00 0.00 66.02 61.87 1a72 s SER 302 CO 0.22 -0.05 0.36 -0.32 1.20 0.00 0.00 173.24 174.65 1a72 s MET 303 N 1.01 0.47 -0.29 5.44 0.00 -1.26 -4.96 119.30 119.71 1a72 s MET 303 Ca 0.23 0.42 -0.20 0.00 0.00 0.00 0.00 55.69 56.15 1a72 s MET 303 Cb -0.15 0.22 -0.01 0.00 0.00 0.00 0.00 34.83 34.89 1a72 s MET 303 CO 0.09 -0.07 0.59 1.21 0.00 0.00 0.00 175.02 176.84 1a72 s ASN 304 N -0.00 6.48 0.36 1.11 3.84 -1.26 -4.94 114.94 120.53 1a72 s ASN 304 Ca -0.02 0.46 0.15 0.00 0.21 0.00 0.00 52.86 53.66 1a72 s ASN 304 Cb -0.03 -2.31 0.80 0.00 -0.55 0.00 0.00 41.25 39.15 1a72 s ASN 304 CO 0.01 -0.42 1.36 1.55 -2.79 0.00 0.00 177.10 176.81 1a72 h PRO 305 N 8.12 0.00 -0.83 0.43 0.13 -2.03 -0.61 132.00 137.21 1a72 h PRO 305 Ca -0.27 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 64.99 1a72 h PRO 305 Cb 1.12 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.19 1a72 h PRO 305 CO 0.77 0.00 0.54 1.98 -0.23 0.00 0.00 178.00 181.07 1a72 h MET 306 N 0.00 0.59 -0.97 0.86 4.05 -2.01 0.17 114.93 117.62 1a72 h MET 306 Ca 0.00 -0.04 0.27 0.00 -0.28 0.00 0.00 59.70 59.66 1a72 h MET 306 Cb 0.61 -0.13 -0.05 0.00 -0.80 0.00 0.00 31.60 31.23 1a72 h MET 306 CO 0.00 0.39 0.69 -0.07 0.23 0.00 0.00 176.91 178.15 1a72 h LEU 307 N 0.61 0.09 0.00 3.39 3.38 -1.52 -0.18 115.31 121.07 1a72 h LEU 307 Ca 0.41 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.23 1a72 h LEU 307 Cb 0.72 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 1a72 h LEU 307 CO -0.17 0.03 -1.56 0.18 0.09 0.00 0.00 178.44 177.01 1a72 n LEU 308 N -4.31 0.68 -0.31 1.67 4.77 0.60 -4.12 117.00 115.98 1a72 n LEU 308 Ca 0.21 0.30 0.01 0.00 -0.03 0.00 0.00 56.01 56.49 1a72 n LEU 308 Cb 0.99 0.11 0.14 0.00 -2.33 0.00 0.00 43.42 42.32 1a72 n LEU 308 CO 0.37 0.15 1.19 0.25 -1.33 0.00 0.00 177.39 178.03 1a72 h LEU 309 N 0.00 0.84 -1.78 2.23 5.85 -0.92 -1.23 115.31 120.31 1a72 h LEU 309 Ca -0.18 0.02 0.27 0.00 0.84 0.00 0.00 57.88 58.82 1a72 h LEU 309 Cb 1.57 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 42.39 1a72 h LEU 309 CO 0.04 0.54 0.69 0.28 -0.34 0.00 0.00 178.44 179.65 1a72 h SER 310 N 0.98 0.17 0.00 1.25 0.02 -1.71 -3.43 113.55 110.82 1a72 h SER 310 Ca 0.37 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 1a72 h SER 310 Cb 0.16 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1a72 h SER 310 CO -0.17 0.05 0.00 0.61 -1.14 0.00 0.00 176.83 176.18 1a72 n GLY 311 N -1.64 1.18 3.59 -3.77 0.00 -0.49 -4.22 105.19 99.85 1a72 n GLY 311 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 1a72 n GLY 311 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a72 s ARG 312 N 0.00 3.93 0.20 1.61 0.52 -1.07 -2.94 118.95 121.20 1a72 s ARG 312 Ca 0.00 -0.12 -0.25 0.00 -0.52 0.00 0.00 55.73 54.84 1a72 s ARG 312 Cb 0.00 -3.68 -0.08 0.00 0.52 0.00 0.00 34.95 31.71 1a72 s ARG 312 CO 0.00 -0.29 0.81 0.99 0.02 0.00 0.00 175.30 176.83 1a72 s THR 313 N 1.98 4.33 -0.12 0.02 2.01 -0.22 -4.69 115.64 118.95 1a72 s THR 313 Ca 0.12 1.72 0.00 0.00 0.31 0.00 0.00 61.69 63.85 1a72 s THR 313 Cb -0.16 -4.13 0.02 0.00 0.01 0.00 0.00 72.50 68.25 1a72 s THR 313 CO 0.10 0.46 -0.10 0.86 -0.69 0.00 0.00 174.62 175.25 1a72 s TRP 314 N -1.23 1.67 0.07 4.92 -0.00 -1.26 -1.70 118.94 121.41 1a72 s TRP 314 Ca 0.38 -0.84 0.07 0.00 -0.00 0.00 0.00 56.10 55.71 1a72 s TRP 314 Cb -0.22 -1.31 -0.03 0.00 -0.00 0.00 0.00 33.47 31.90 1a72 s TRP 314 CO 0.26 -0.52 -0.18 0.15 -0.00 0.00 0.00 176.95 176.66 1a72 s LYS 315 N 1.50 1.08 0.42 5.86 1.02 -0.59 -4.99 119.74 124.04 1a72 s LYS 315 Ca 0.02 -1.00 0.04 0.00 0.02 0.00 0.00 55.97 55.05 1a72 s LYS 315 Cb -0.13 -1.22 -0.05 0.00 -0.52 0.00 0.00 37.83 35.91 1a72 s LYS 315 CO -0.07 0.29 0.03 0.20 -0.92 0.00 0.00 175.35 174.88 1a72 s GLY 316 N -1.58 2.59 -0.15 -3.33 0.00 -1.26 -1.37 107.32 102.22 1a72 s GLY 316 Ca 0.04 -1.53 -0.34 0.00 0.00 0.00 0.00 44.72 42.89 1a72 s GLY 316 CO 0.03 -2.04 1.16 0.00 0.00 0.00 0.00 173.10 172.25 1a72 s ALA 317 N -2.95 -2.04 -0.13 3.20 0.00 -1.25 -4.94 121.76 113.65 1a72 s ALA 317 Ca 0.25 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.67 1a72 s ALA 317 Cb 0.06 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.20 1a72 s ALA 317 CO 0.13 -0.65 -0.22 0.42 0.00 0.00 0.00 175.76 175.44 1a72 s ILE 318 N -2.54 2.09 -0.96 0.00 -1.09 -1.26 -4.73 121.20 112.72 1a72 s ILE 318 Ca 0.09 -0.98 -0.01 0.00 -2.23 0.00 0.00 60.65 57.52 1a72 s ILE 318 Cb -0.01 -1.83 0.00 0.00 -1.58 0.00 0.00 42.46 39.05 1a72 s ILE 318 CO -0.05 0.55 0.81 0.33 -1.23 0.00 0.00 174.94 175.34 1a72 n PHE 319 N 3.97 -1.80 -2.27 3.97 7.35 -1.26 -2.43 117.46 124.99 1a72 n PHE 319 Ca -0.20 0.74 -0.09 0.00 -0.76 0.00 0.00 57.45 57.14 1a72 n PHE 319 Cb 0.52 -4.37 -0.01 0.00 0.35 0.00 0.00 39.48 35.96 1a72 n PHE 319 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1a72 n GLY 320 N -1.20 -0.28 3.40 7.13 0.00 -1.20 -0.97 105.19 112.07 1a72 n GLY 320 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1a72 n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a72 n GLY 321 N -0.64 0.11 3.78 -0.02 0.00 -1.02 -3.88 105.19 103.52 1a72 n GLY 321 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 1a72 n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a72 s PHE 322 N -1.31 2.73 -1.03 1.61 0.08 -0.15 -4.67 117.98 115.25 1a72 s PHE 322 Ca 0.00 1.55 -0.13 0.00 0.12 0.00 0.00 56.93 58.47 1a72 s PHE 322 Cb 0.00 -3.21 0.22 0.00 -0.57 0.00 0.00 43.02 39.45 1a72 s PHE 322 CO 0.00 -1.45 1.10 0.21 -0.10 0.00 0.00 175.22 174.98 1a72 s LYS 323 N -3.49 3.93 0.00 0.44 2.20 -1.26 -4.70 119.74 116.86 1a72 s LYS 323 Ca 0.70 -2.65 0.00 0.00 -0.36 0.00 0.00 55.97 53.66 1a72 s LYS 323 Cb -0.21 -4.70 0.00 0.00 -1.51 0.00 0.00 37.83 31.41 1a72 s LYS 323 CO 0.29 -1.46 0.00 -1.13 -0.36 0.00 0.00 175.35 172.69 1a72 n SER 324 N 4.32 0.00 -0.31 1.43 3.41 -1.26 -0.22 113.62 120.99 1a72 n SER 324 Ca 0.24 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.81 1a72 n SER 324 Cb 0.44 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.46 1a72 n SER 324 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1a72 h LYS 325 N 0.00 1.16 -0.11 4.33 3.64 -1.85 0.59 116.57 124.33 1a72 h LYS 325 Ca 0.00 -0.13 -0.09 0.00 -1.27 0.00 0.00 60.65 59.16 1a72 h LYS 325 Cb 0.00 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 1a72 h LYS 325 CO 0.00 0.85 -0.28 -0.44 -2.27 0.00 0.00 179.45 177.30 1a72 h ASP 326 N 1.16 0.44 0.05 4.20 5.19 -1.22 -3.39 116.42 122.85 1a72 h ASP 326 Ca 0.29 -0.58 -0.00 0.00 -0.62 0.00 0.00 57.03 56.12 1a72 h ASP 326 Cb 0.02 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.40 1a72 h ASP 326 CO -0.05 0.95 -0.02 0.28 -3.12 0.00 0.00 179.24 177.28 1a72 h SER 327 N -0.04 -0.05 -0.87 6.45 0.02 -0.38 -3.38 113.55 115.30 1a72 h SER 327 Ca -0.00 -0.59 0.20 0.00 -0.84 0.00 0.00 61.79 60.55 1a72 h SER 327 Cb 0.89 0.01 -0.16 0.00 0.14 0.00 0.00 62.40 63.28 1a72 h SER 327 CO 0.06 0.61 -0.09 0.58 -1.14 0.00 0.00 176.83 176.85 1a72 h VAL 328 N -0.77 0.16 -0.50 2.27 2.07 -1.08 0.18 116.25 118.57 1a72 h VAL 328 Ca -0.01 -0.01 0.05 0.00 0.82 0.00 0.00 66.70 67.56 1a72 h VAL 328 Cb 0.64 0.12 -0.05 0.00 -1.52 0.00 0.00 31.29 30.49 1a72 h VAL 328 CO 0.01 0.01 0.23 -0.65 0.02 0.00 0.00 177.57 177.19 1a72 h PRO 329 N 0.03 0.43 -0.23 1.57 0.11 -1.78 -0.10 132.00 132.03 1a72 h PRO 329 Ca 0.46 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.45 1a72 h PRO 329 Cb 0.81 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.81 1a72 h PRO 329 CO -0.84 0.29 -0.28 0.87 -0.21 0.00 0.00 178.00 177.82 1a72 h LYS 330 N 0.45 0.46 -0.17 1.05 1.57 -0.94 0.29 116.57 119.28 1a72 h LYS 330 Ca 0.23 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1a72 h LYS 330 Cb 0.18 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1a72 h LYS 330 CO -0.19 0.70 0.05 -0.07 -0.57 0.00 0.00 179.45 179.37 1a72 h LEU 331 N 0.40 0.25 0.11 2.94 4.07 -0.25 -2.30 115.31 120.52 1a72 h LEU 331 Ca 0.06 -0.22 0.02 0.00 0.08 0.00 0.00 57.88 57.82 1a72 h LEU 331 Cb 0.70 -0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.34 1a72 h LEU 331 CO 0.05 0.40 -0.34 0.58 -1.08 0.00 0.00 178.44 178.06 1a72 h VAL 332 N 0.08 0.29 -0.98 1.22 2.07 -0.56 -1.59 116.25 116.78 1a72 h VAL 332 Ca 0.05 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.77 1a72 h VAL 332 Cb 0.24 0.29 -0.11 0.00 -1.52 0.00 0.00 31.29 30.19 1a72 h VAL 332 CO -0.00 0.00 0.58 0.00 0.02 0.00 0.00 177.57 178.16 1a72 h ALA 333 N 0.08 1.64 -0.14 1.67 0.00 -0.92 0.60 119.26 122.20 1a72 h ALA 333 Ca 0.03 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1a72 h ALA 333 Cb 0.59 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1a72 h ALA 333 CO -0.21 -0.12 0.06 -0.44 0.00 0.00 0.00 179.25 178.55 1a72 h ASP 334 N 0.69 0.18 -0.67 0.00 3.32 -0.73 1.06 116.42 120.27 1a72 h ASP 334 Ca 0.58 -0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.53 1a72 h ASP 334 Cb 0.96 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.42 1a72 h ASP 334 CO -0.41 0.26 0.42 0.15 -1.72 0.00 0.00 179.24 177.94 1a72 h PHE 335 N 0.09 0.79 0.00 4.55 3.57 -0.06 0.33 116.94 126.21 1a72 h PHE 335 Ca 0.05 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1a72 h PHE 335 Cb 0.13 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 38.61 1a72 h PHE 335 CO -0.03 0.46 -0.05 0.52 -2.23 0.00 0.00 178.31 176.98 1a72 h MET 336 N 0.83 0.00 -0.02 1.11 2.86 0.10 -1.05 114.93 118.76 1a72 h MET 336 Ca 0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.91 1a72 h MET 336 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1a72 h MET 336 CO -0.10 0.05 0.00 0.00 1.06 0.00 0.00 176.91 177.92 1a72 n ALA 337 N -2.14 2.62 -2.08 6.32 0.00 0.36 -4.87 120.51 120.71 1a72 n ALA 337 Ca -0.01 -0.22 -0.08 0.00 0.00 0.00 0.00 53.44 53.14 1a72 n ALA 337 Cb 0.27 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.39 1a72 n ALA 337 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1a72 n LYS 338 N -0.63 -0.63 0.00 0.00 3.00 -0.40 -5.02 118.16 114.49 1a72 n LYS 338 Ca 0.18 0.41 0.00 0.00 -0.00 0.00 0.00 58.31 58.90 1a72 n LYS 338 Cb 0.14 -4.35 0.00 0.00 0.00 0.00 0.00 35.03 30.82 1a72 n LYS 338 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1a72 n LYS 339 N -1.84 0.00 -0.91 1.64 5.02 -0.97 -4.95 118.16 116.15 1a72 n LYS 339 Ca -0.09 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.88 1a72 n LYS 339 Cb 0.55 0.00 0.14 0.00 -0.02 0.00 0.00 35.03 35.70 1a72 n LYS 339 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1a72 s PHE 340 N 0.40 1.80 0.14 2.13 -0.12 -1.26 -4.99 117.98 116.08 1a72 s PHE 340 Ca 0.00 1.73 0.10 0.00 -0.05 0.00 0.00 56.93 58.71 1a72 s PHE 340 Cb 0.00 -3.35 -0.04 0.00 -0.63 0.00 0.00 43.02 39.00 1a72 s PHE 340 CO 0.00 -2.69 -0.20 0.00 -0.05 0.00 0.00 175.22 172.28 1a72 s ALA 341 N -2.51 2.63 -0.76 1.99 0.00 -1.26 -4.65 121.76 117.19 1a72 s ALA 341 Ca 0.68 -1.45 0.11 0.00 0.00 0.00 0.00 51.96 51.30 1a72 s ALA 341 Cb -0.24 -0.54 -0.06 0.00 0.00 0.00 0.00 23.12 22.28 1a72 s ALA 341 CO 0.55 0.53 0.56 1.28 0.00 0.00 0.00 175.76 178.68 1a72 n LEU 342 N 0.60 0.89 0.13 0.00 4.77 -1.26 -4.74 117.00 117.38 1a72 n LEU 342 Ca -0.15 -0.63 -0.13 0.00 -0.03 0.00 0.00 56.01 55.07 1a72 n LEU 342 Cb 0.54 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 1a72 n LEU 342 CO 0.28 0.19 0.72 0.44 -1.33 0.00 0.00 177.39 177.69 1a72 h ASP 343 N 0.62 -0.61 0.00 -1.43 5.19 -1.93 -2.49 116.42 115.77 1a72 h ASP 343 Ca 0.00 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 1a72 h ASP 343 Cb 0.31 0.22 0.00 0.00 0.18 0.00 0.00 39.33 40.05 1a72 h ASP 343 CO 0.00 -0.32 0.33 -0.81 -3.12 0.00 0.00 179.24 175.32 1a72 n PRO 344 N -5.35 0.08 -0.04 3.56 -0.04 -1.26 -0.26 135.00 131.69 1a72 n PRO 344 Ca -0.07 0.56 -0.10 0.00 -0.04 0.00 0.00 63.50 63.84 1a72 n PRO 344 Cb 0.26 -2.10 -0.15 0.00 -0.04 0.00 0.00 33.50 31.47 1a72 n PRO 344 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1a72 n LEU 345 N -2.02 0.80 -4.53 1.53 4.77 -0.94 -4.73 117.00 111.89 1a72 n LEU 345 Ca -0.01 0.27 -0.41 0.00 -0.03 0.00 0.00 56.01 55.83 1a72 n LEU 345 Cb 0.35 0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1a72 n LEU 345 CO 0.05 0.46 1.12 -0.63 -1.33 0.00 0.00 177.39 177.07 1a72 s ILE 346 N -2.56 3.89 -1.39 -0.08 1.01 0.64 -0.07 121.20 122.64 1a72 s ILE 346 Ca -0.08 0.05 0.20 0.00 0.00 0.00 0.00 60.65 60.82 1a72 s ILE 346 Cb 0.07 -4.89 -0.12 0.00 0.01 0.00 0.00 42.46 37.54 1a72 s ILE 346 CO 0.82 -1.78 0.93 1.07 0.00 0.00 0.00 174.94 175.97 1a72 n THR 347 N 6.33 0.00 -3.64 2.92 5.66 -0.68 -4.92 114.28 119.95 1a72 n THR 347 Ca 0.06 -0.15 -0.14 0.00 -3.05 0.00 0.00 64.05 60.77 1a72 n THR 347 Cb 0.49 1.11 -0.07 0.00 -1.55 0.00 0.00 70.33 70.31 1a72 n THR 347 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 1a72 s HIS 348 N -2.61 -0.70 -0.07 1.09 3.76 -1.02 -4.98 115.29 110.76 1a72 s HIS 348 Ca 0.12 1.65 0.00 0.00 -0.15 0.00 0.00 55.06 56.68 1a72 s HIS 348 Cb 0.16 0.26 0.02 0.00 1.11 0.00 0.00 32.58 34.13 1a72 s HIS 348 CO 0.68 -0.38 -0.06 0.08 -0.85 0.00 0.00 174.74 174.21 1a72 s VAL 349 N 0.12 0.71 0.01 -0.90 1.01 -1.25 0.04 120.40 120.14 1a72 s VAL 349 Ca -0.02 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1a72 s VAL 349 Cb -0.04 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.59 1a72 s VAL 349 CO 0.02 0.29 -0.09 -0.76 0.00 0.00 0.00 175.10 174.55 1a72 s LEU 350 N 1.25 2.09 0.34 3.92 1.43 0.01 -4.93 118.68 122.79 1a72 s LEU 350 Ca -0.05 -0.28 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 1a72 s LEU 350 Cb -0.14 -0.42 -0.12 0.00 0.03 0.00 0.00 46.19 45.54 1a72 s LEU 350 CO -0.02 0.04 1.49 -0.81 0.23 0.00 0.00 176.35 177.27 1a72 n PRO 351 N 2.42 2.57 -0.63 1.29 -0.04 -1.26 -1.06 135.00 138.29 1a72 n PRO 351 Ca -0.16 0.91 0.49 0.00 -0.04 0.00 0.00 63.50 64.70 1a72 n PRO 351 Cb 0.56 -2.63 0.80 0.00 -0.04 0.00 0.00 33.50 32.20 1a72 n PRO 351 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1a72 h PHE 352 N 3.50 0.05 -0.24 0.54 3.04 -0.23 0.63 116.94 124.23 1a72 h PHE 352 Ca -0.49 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.45 1a72 h PHE 352 Cb 1.24 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.73 1a72 h PHE 352 CO 0.54 -0.02 0.09 0.93 -2.02 0.00 0.00 178.31 177.83 1a72 h GLU 353 N 0.01 0.34 -0.98 1.11 4.39 -1.87 -1.17 114.58 116.41 1a72 h GLU 353 Ca 0.88 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 60.53 1a72 h GLU 353 Cb 3.46 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 32.03 1a72 h GLU 353 CO -0.05 0.29 0.01 1.63 -1.16 0.00 0.00 179.01 179.73 1a72 n LYS 354 N -4.43 1.24 0.05 2.33 4.01 0.22 -4.53 118.16 117.06 1a72 n LYS 354 Ca 0.01 -0.22 -0.12 0.00 -0.51 0.00 0.00 58.31 57.47 1a72 n LYS 354 Cb 0.13 -1.46 -0.08 0.00 -0.51 0.00 0.00 35.03 33.12 1a72 n LYS 354 CO 0.00 0.00 0.00 0.97 -1.11 0.00 0.00 177.40 177.26 1a72 h ILE 355 N 0.24 0.00 -0.20 -0.18 2.10 -1.34 0.31 117.51 118.44 1a72 h ILE 355 Ca 0.01 0.00 0.06 0.00 1.08 0.00 0.00 64.86 66.01 1a72 h ILE 355 Cb 0.71 0.00 -0.01 0.00 -1.09 0.00 0.00 36.82 36.43 1a72 h ILE 355 CO 0.04 0.00 0.46 0.78 -1.08 0.00 0.00 178.15 178.36 1a72 h ASN 356 N -0.53 0.00 0.45 2.19 2.35 -1.87 1.03 115.58 119.21 1a72 h ASN 356 Ca 0.00 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.45 1a72 h ASN 356 Cb 0.56 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.94 1a72 h ASN 356 CO -0.26 0.00 -1.38 -0.08 -1.65 0.00 0.00 177.43 174.06 1a72 h GLU 357 N 0.00 0.39 -0.29 0.81 4.81 -0.91 -3.10 114.58 116.29 1a72 h GLU 357 Ca 0.09 -0.66 -0.08 0.00 -0.13 0.00 0.00 59.36 58.58 1a72 h GLU 357 Cb 1.02 0.25 -0.02 0.00 0.63 0.00 0.00 28.75 30.63 1a72 h GLU 357 CO -0.00 1.31 -0.16 0.78 -0.73 0.00 0.00 179.01 180.21 1a72 h GLY 358 N 0.98 0.55 0.86 1.92 0.00 0.45 -3.07 103.07 104.75 1a72 h GLY 358 Ca -0.20 -0.40 -0.03 0.00 0.00 0.00 0.00 47.33 46.70 1a72 h GLY 358 CO 0.23 0.37 0.03 0.74 0.00 0.00 0.00 176.54 177.91 1a72 h PHE 359 N 0.47 0.45 -0.94 5.60 -1.00 -1.38 -1.84 116.94 118.30 1a72 h PHE 359 Ca 0.08 -0.07 0.14 0.00 2.81 0.00 0.00 57.97 60.94 1a72 h PHE 359 Cb 0.55 -0.12 -0.08 0.00 3.61 0.00 0.00 35.95 39.91 1a72 h PHE 359 CO 0.02 0.56 0.60 -0.44 -1.61 0.00 0.00 178.31 177.43 1a72 h ASP 360 N 0.22 0.74 -0.20 2.17 3.32 -1.45 0.99 116.42 122.20 1a72 h ASP 360 Ca 0.07 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1a72 h ASP 360 Cb 0.36 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1a72 h ASP 360 CO 0.01 0.37 0.08 -0.07 -1.72 0.00 0.00 179.24 177.91 1a72 h LEU 361 N 0.78 0.28 0.93 1.55 3.38 -1.45 0.29 115.31 121.06 1a72 h LEU 361 Ca 0.48 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.24 1a72 h LEU 361 Cb 0.69 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.38 1a72 h LEU 361 CO -0.24 0.36 -0.44 0.25 0.09 0.00 0.00 178.44 178.46 1a72 h LEU 362 N 0.17 -1.05 -0.13 1.67 5.85 0.27 -3.32 115.31 118.77 1a72 h LEU 362 Ca 0.07 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.86 1a72 h LEU 362 Cb 0.17 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.41 1a72 h LEU 362 CO -0.01 -0.72 -0.48 0.03 -0.34 0.00 0.00 178.44 176.92 1a72 h ARG 363 N -1.30 -0.53 -4.35 1.25 3.08 0.84 -3.36 114.38 110.02 1a72 h ARG 363 Ca -0.13 0.04 -0.71 0.00 0.07 0.00 0.00 59.98 59.25 1a72 h ARG 363 Cb 0.95 0.12 -0.32 0.00 0.08 0.00 0.00 29.97 30.80 1a72 h ARG 363 CO 0.21 -0.35 -0.46 -1.12 -1.07 0.00 0.00 179.97 177.17 1a72 s SER 364 N -4.86 5.46 0.00 7.04 0.01 0.09 -4.99 113.70 116.45 1a72 s SER 364 Ca -0.15 -2.03 0.00 0.00 1.31 0.00 0.00 55.95 55.07 1a72 s SER 364 Cb 0.08 -1.91 0.00 0.00 0.21 0.00 0.00 66.02 64.40 1a72 s SER 364 CO 0.63 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 174.29 1a72 n GLY 365 N 4.66 0.81 3.72 3.44 0.00 -1.26 -4.64 105.19 111.92 1a72 n GLY 365 Ca -0.04 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 1a72 n GLY 365 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1a72 s GLU 366 N -1.39 4.58 -0.29 1.61 2.12 -1.26 -4.52 118.70 119.54 1a72 s GLU 366 Ca 0.00 1.51 0.04 0.00 0.36 0.00 0.00 54.97 56.88 1a72 s GLU 366 Cb 0.00 -3.40 0.20 0.00 0.26 0.00 0.00 34.13 31.18 1a72 s GLU 366 CO 0.00 -0.00 0.64 0.45 -0.54 0.00 0.00 175.26 175.81 1a72 s SER 367 N 0.65 -1.51 0.00 -1.70 0.15 -1.26 -4.96 113.70 105.07 1a72 s SER 367 Ca 0.51 0.18 0.00 0.00 0.70 0.00 0.00 55.95 57.35 1a72 s SER 367 Cb -0.24 1.96 0.00 0.00 -1.71 0.00 0.00 66.02 66.03 1a72 s SER 367 CO 0.29 -0.28 0.30 -0.38 1.20 0.00 0.00 173.24 174.38 1a72 n ILE 368 N 5.39 0.00 -4.47 6.45 2.08 -1.26 -4.67 119.36 122.88 1a72 n ILE 368 Ca 0.05 0.80 -0.28 0.00 0.56 0.00 0.00 62.75 63.88 1a72 n ILE 368 Cb 0.54 -1.53 -0.17 0.00 -0.75 0.00 0.00 39.64 37.74 1a72 n ILE 368 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 1a72 s ARG 369 N -0.60 2.18 -0.24 0.38 6.06 0.91 -4.66 118.95 122.97 1a72 s ARG 369 Ca 0.00 -0.55 -0.11 0.00 -2.50 0.00 0.00 55.73 52.58 1a72 s ARG 369 Cb 0.00 -1.85 -0.05 0.00 0.06 0.00 0.00 34.95 33.11 1a72 s ARG 369 CO 0.00 -0.06 0.16 0.99 -2.50 0.00 0.00 175.30 173.90 1a72 s THR 370 N 0.96 5.35 -0.24 4.11 2.01 -1.26 -1.68 115.64 124.91 1a72 s THR 370 Ca -0.07 0.18 -0.09 0.00 0.31 0.00 0.00 61.69 62.02 1a72 s THR 370 Cb -0.15 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.81 1a72 s THR 370 CO -0.01 0.34 0.12 -0.63 -0.69 0.00 0.00 174.62 173.74 1a72 s ILE 371 N 1.12 4.92 -0.14 1.82 -1.09 0.11 -1.10 121.20 126.84 1a72 s ILE 371 Ca 0.08 0.03 -0.16 0.00 -2.23 0.00 0.00 60.65 58.37 1a72 s ILE 371 Cb -0.14 -3.29 -0.04 0.00 -1.58 0.00 0.00 42.46 37.41 1a72 s ILE 371 CO 0.05 0.35 0.37 -0.76 -1.23 0.00 0.00 174.94 173.73 1a72 s LEU 372 N 1.19 4.26 0.08 2.97 1.02 0.17 -0.81 118.68 127.56 1a72 s LEU 372 Ca 0.06 0.64 0.04 0.00 0.02 0.00 0.00 54.13 54.89 1a72 s LEU 372 Cb -0.14 -2.52 -0.04 0.00 0.02 0.00 0.00 46.19 43.51 1a72 s LEU 372 CO 0.05 0.06 0.03 0.42 0.02 0.00 0.00 176.35 176.92 1a72 s THR 373 N 0.53 4.20 -1.89 5.49 -4.23 -0.23 -1.45 115.64 118.06 1a72 s THR 373 Ca 0.21 -0.89 0.15 0.00 -1.18 0.00 0.00 61.69 59.98 1a72 s THR 373 Cb -0.14 -3.00 0.12 0.00 1.34 0.00 0.00 72.50 70.82 1a72 s THR 373 CO 0.07 0.13 0.98 0.49 -0.54 0.00 0.00 174.62 175.75