#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ijq s LYS 47 N 0.00 3.34 -0.16 3.17 1.02 -0.60 -3.48 119.74 123.02 3ijq s LYS 47 Ca 0.00 -0.69 -0.03 0.00 0.02 0.00 0.00 55.97 55.27 3ijq s LYS 47 Cb 0.00 -2.61 -0.02 0.00 -0.52 0.00 0.00 37.83 34.68 3ijq s LYS 47 CO 0.00 0.23 -0.07 1.41 -0.92 0.00 0.00 175.35 176.00 3ijq s MET 48 N 0.30 3.49 0.20 1.68 -2.45 -1.26 -0.38 119.30 120.87 3ijq s MET 48 Ca -0.10 -0.61 0.10 0.00 -1.25 0.00 0.00 55.69 53.83 3ijq s MET 48 Cb -0.16 -2.84 -0.04 0.00 1.25 0.00 0.00 34.83 33.03 3ijq s MET 48 CO 0.06 0.11 -0.21 0.95 1.05 0.00 0.00 175.02 176.98 3ijq s THR 49 N 0.67 2.13 -0.23 10.11 -4.23 -0.04 -4.98 115.64 119.06 3ijq s THR 49 Ca -0.04 -2.05 -0.26 0.00 -1.18 0.00 0.00 61.69 58.16 3ijq s THR 49 Cb -0.15 -2.03 0.08 0.00 1.34 0.00 0.00 72.50 71.74 3ijq s THR 49 CO 0.02 -0.26 0.79 0.72 -0.54 0.00 0.00 174.62 175.35 3ijq s PHE 50 N -2.02 -0.68 0.02 3.99 -0.12 -1.26 -0.66 117.98 117.25 3ijq s PHE 50 Ca 0.20 1.58 -0.09 0.00 -0.05 0.00 0.00 56.93 58.57 3ijq s PHE 50 Cb -0.06 0.32 0.01 0.00 -0.63 0.00 0.00 43.02 42.65 3ijq s PHE 50 CO 0.09 -0.38 0.19 -0.59 -0.05 0.00 0.00 175.22 174.48 3ijq s PHE 51 N 0.03 0.02 0.39 3.49 -0.12 -0.58 -4.98 117.98 116.22 3ijq s PHE 51 Ca -0.01 -0.14 -0.27 0.00 -0.05 0.00 0.00 56.93 56.46 3ijq s PHE 51 Cb -0.04 -0.02 -0.09 0.00 -0.63 0.00 0.00 43.02 42.23 3ijq s PHE 51 CO 0.01 -0.36 1.36 -2.14 -0.05 0.00 0.00 175.22 174.03 3ijq s PRO 52 N -1.87 4.06 -0.41 1.99 0.02 -1.26 -1.17 135.00 136.36 3ijq s PRO 52 Ca -0.11 2.29 0.04 0.00 0.02 0.00 0.00 61.00 63.24 3ijq s PRO 52 Cb -0.04 -2.87 0.17 0.00 0.02 0.00 0.00 34.50 31.77 3ijq s PRO 52 CO -0.00 -0.46 0.43 -0.47 -0.33 0.00 0.00 177.00 176.16 3ijq s TYR 53 N -1.19 -0.11 0.22 6.54 5.04 0.23 -4.83 117.35 123.25 3ijq s TYR 53 Ca 0.54 -1.25 -0.31 0.00 -2.44 0.00 0.00 57.07 53.61 3ijq s TYR 53 Cb -0.41 -0.43 -0.11 0.00 0.35 0.00 0.00 41.96 41.36 3ijq s TYR 53 CO 0.54 -0.98 1.65 -2.00 -1.34 0.00 0.00 175.55 173.41 3ijq s GLU 54 N 0.90 4.15 -0.05 4.97 2.12 -1.26 -3.95 118.70 125.58 3ijq s GLU 54 Ca 0.24 2.54 -0.22 0.00 0.36 0.00 0.00 54.97 57.90 3ijq s GLU 54 Cb -0.07 -3.08 -0.04 0.00 0.26 0.00 0.00 34.13 31.20 3ijq s GLU 54 CO -0.08 -0.68 0.63 -0.51 -0.54 0.00 0.00 175.26 174.08 3ijq s LEU 55 N 0.65 4.35 -0.33 2.70 1.43 -0.42 -4.90 118.68 122.16 3ijq s LEU 55 Ca 0.70 1.13 -0.13 0.00 -1.03 0.00 0.00 54.13 54.80 3ijq s LEU 55 Cb -0.48 -2.97 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 3ijq s LEU 55 CO 0.37 -0.01 0.25 -0.54 0.23 0.00 0.00 176.35 176.64 3ijq s LYS 56 N 0.37 3.55 0.28 1.70 -0.14 -1.26 -1.06 119.74 123.18 3ijq s LYS 56 Ca 0.33 -0.58 -0.29 0.00 -1.36 0.00 0.00 55.97 54.07 3ijq s LYS 56 Cb -0.18 -3.79 -0.09 0.00 -1.68 0.00 0.00 37.83 32.09 3ijq s LYS 56 CO 0.17 -0.43 1.00 -0.51 -0.76 0.00 0.00 175.35 174.82 3ijq s LEU 57 N 1.76 4.53 0.30 3.17 1.43 -0.64 0.03 118.68 129.26 3ijq s LEU 57 Ca 0.07 2.04 -0.01 0.00 -1.03 0.00 0.00 54.13 55.19 3ijq s LEU 57 Cb -0.17 -3.72 0.46 0.00 0.03 0.00 0.00 46.19 42.78 3ijq s LEU 57 CO 0.11 -0.02 1.95 0.03 0.23 0.00 0.00 176.35 178.65 3ijq h ARG 58 N 3.76 1.02 -4.37 1.70 3.08 -1.05 -3.44 114.38 115.07 3ijq h ARG 58 Ca -0.46 -0.08 -0.18 0.00 0.07 0.00 0.00 59.98 59.33 3ijq h ARG 58 Cb 1.20 -0.22 -0.15 0.00 0.08 0.00 0.00 29.97 30.89 3ijq h ARG 58 CO 0.67 0.71 -0.60 -1.01 -1.07 0.00 0.00 179.97 178.67 3ijq s HIS 59 N -5.79 0.84 -0.06 3.04 3.76 -1.26 -5.05 115.29 110.76 3ijq s HIS 59 Ca -0.11 -1.19 -0.33 0.00 -0.15 0.00 0.00 55.06 53.28 3ijq s HIS 59 Cb 0.17 -0.43 -0.11 0.00 1.11 0.00 0.00 32.58 33.32 3ijq s HIS 59 CO 0.79 -0.56 1.91 0.28 -0.85 0.00 0.00 174.74 176.31 3ijq n VAL 60 N -0.13 0.63 -3.68 -0.90 0.31 -1.26 -4.78 118.33 108.52 3ijq n VAL 60 Ca -0.05 -0.12 -0.36 0.00 -0.01 0.00 0.00 64.34 63.81 3ijq n VAL 60 Cb 0.64 -1.99 -0.08 0.00 -0.91 0.00 0.00 33.84 31.50 3ijq n VAL 60 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 3ijq s PHE 61 N 4.25 3.38 -0.05 3.52 5.36 0.18 -4.90 117.98 129.71 3ijq s PHE 61 Ca 0.92 0.33 0.03 0.00 -0.96 0.00 0.00 56.93 57.25 3ijq s PHE 61 Cb -0.63 -2.22 0.01 0.00 -0.34 0.00 0.00 43.02 39.83 3ijq s PHE 61 CO 0.49 0.21 -0.13 0.99 -1.46 0.00 0.00 175.22 175.32 3ijq s THR 62 N 0.62 1.18 -0.05 0.12 2.01 -1.26 -0.01 115.64 118.25 3ijq s THR 62 Ca 0.09 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 61.56 3ijq s THR 62 Cb -0.12 -1.05 0.02 0.00 0.01 0.00 0.00 72.50 71.36 3ijq s THR 62 CO 0.01 0.36 -0.03 0.68 -0.69 0.00 0.00 174.62 174.94 3ijq s VAL 63 N 0.42 0.46 0.00 3.82 -7.23 0.54 -4.98 120.40 113.44 3ijq s VAL 63 Ca -0.10 -0.06 0.00 0.00 -1.81 0.00 0.00 61.98 60.01 3ijq s VAL 63 Cb -0.14 -0.51 0.00 0.00 0.56 0.00 0.00 36.38 36.29 3ijq s VAL 63 CO 0.03 0.22 0.00 0.00 -0.31 0.00 0.00 175.10 175.04 3ijq n ALA 64 N 4.19 0.00 0.07 1.32 0.00 -1.26 0.50 120.51 125.33 3ijq n ALA 64 Ca -0.23 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.24 3ijq n ALA 64 Cb 0.51 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.02 3ijq n ALA 64 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ijq n THR 65 N 0.00 0.54 -3.74 0.00 -2.24 -1.26 -4.98 114.28 102.60 3ijq n THR 65 Ca 0.00 -0.77 -0.37 0.00 -2.27 0.00 0.00 64.05 60.64 3ijq n THR 65 Cb 0.00 0.79 -0.12 0.00 -2.10 0.00 0.00 70.33 68.90 3ijq n THR 65 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3ijq s TYR 66 N -0.79 3.11 0.03 4.78 5.04 0.18 -5.08 117.35 124.62 3ijq s TYR 66 Ca 0.11 -0.61 0.06 0.00 -2.44 0.00 0.00 57.07 54.19 3ijq s TYR 66 Cb 0.06 -2.26 -0.03 0.00 0.35 0.00 0.00 41.96 40.08 3ijq s TYR 66 CO 0.09 -0.44 -0.14 -1.12 -1.34 0.00 0.00 175.55 172.60 3ijq s SER 67 N 1.58 4.09 0.25 4.32 0.01 -1.26 -0.34 113.70 122.36 3ijq s SER 67 Ca 0.05 -0.33 -0.17 0.00 1.31 0.00 0.00 55.95 56.81 3ijq s SER 67 Cb -0.16 -0.77 0.01 0.00 0.21 0.00 0.00 66.02 65.31 3ijq s SER 67 CO 0.03 0.26 0.60 0.00 0.41 0.00 0.00 173.24 174.55 3ijq s ARG 68 N -1.44 1.63 -0.02 12.44 1.70 0.99 -4.97 118.95 129.28 3ijq s ARG 68 Ca 0.16 -1.06 0.03 0.00 -0.47 0.00 0.00 55.73 54.39 3ijq s ARG 68 Cb -0.11 0.54 0.05 0.00 -0.57 0.00 0.00 34.95 34.87 3ijq s ARG 68 CO 0.06 -0.72 0.86 0.25 -1.08 0.00 0.00 175.30 174.67 3ijq n THR 69 N -0.41 0.63 -4.05 4.99 -2.24 -1.26 0.47 114.28 112.41 3ijq n THR 69 Ca -0.04 -0.70 -0.10 0.00 -2.27 0.00 0.00 64.05 60.94 3ijq n THR 69 Cb 0.61 0.54 -0.06 0.00 -2.10 0.00 0.00 70.33 69.31 3ijq n THR 69 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3ijq s THR 70 N -0.80 0.00 -0.19 4.28 -4.23 -1.26 -1.63 115.64 111.81 3ijq s THR 70 Ca 0.06 -1.55 -0.06 0.00 -1.18 0.00 0.00 61.69 58.95 3ijq s THR 70 Cb 0.05 -2.30 0.09 0.00 1.34 0.00 0.00 72.50 71.68 3ijq s THR 70 CO 0.01 0.00 0.39 -0.89 -0.54 0.00 0.00 174.62 173.59 3ijq s THR 71 N -3.99 -0.61 0.27 3.99 2.01 -0.22 -4.88 115.64 112.21 3ijq s THR 71 Ca 0.27 0.18 -0.30 0.00 0.31 0.00 0.00 61.69 62.14 3ijq s THR 71 Cb 0.01 -0.63 -0.13 0.00 0.01 0.00 0.00 72.50 71.76 3ijq s THR 71 CO 0.10 0.07 1.48 -2.65 -0.69 0.00 0.00 174.62 172.94 3ijq n PRO 72 N 5.38 2.34 -3.67 4.92 -0.02 -1.26 -1.30 135.00 141.41 3ijq n PRO 72 Ca -0.08 0.83 -0.14 0.00 -2.02 0.00 0.00 63.50 62.09 3ijq n PRO 72 Cb 0.49 -2.54 -0.08 0.00 -0.02 0.00 0.00 33.50 31.35 3ijq n PRO 72 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3ijq s ASP 73 N 0.34 -0.56 -0.09 2.55 -1.08 -1.25 -0.65 116.67 115.94 3ijq s ASP 73 Ca 0.65 0.97 0.04 0.00 -0.52 0.00 0.00 52.55 53.69 3ijq s ASP 73 Cb -0.57 0.98 0.00 0.00 -1.46 0.00 0.00 42.92 41.87 3ijq s ASP 73 CO 0.50 -0.28 -0.20 -0.69 0.52 0.00 0.00 175.17 175.02 3ijq s VAL 74 N -0.07 1.77 -0.18 1.11 1.01 0.05 0.77 120.40 124.86 3ijq s VAL 74 Ca -0.03 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 60.98 3ijq s VAL 74 Cb -0.03 -1.54 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 3ijq s VAL 74 CO 0.02 0.50 0.21 -1.10 0.00 0.00 0.00 175.10 174.73 3ijq s GLN 75 N 0.41 4.18 0.12 2.72 -1.52 -0.32 -1.16 119.66 124.09 3ijq s GLN 75 Ca -0.17 -0.07 0.09 0.00 -1.95 0.00 0.00 55.36 53.27 3ijq s GLN 75 Cb -0.17 -3.41 -0.04 0.00 -0.22 0.00 0.00 33.01 29.17 3ijq s GLN 75 CO 0.07 0.30 -0.20 0.08 -0.25 0.00 0.00 175.29 175.29 3ijq s VAL 76 N 0.32 2.71 -0.03 1.09 1.01 -0.54 -1.53 120.40 123.43 3ijq s VAL 76 Ca 0.12 -1.55 -0.01 0.00 0.00 0.00 0.00 61.98 60.54 3ijq s VAL 76 Cb -0.12 -2.23 0.03 0.00 0.00 0.00 0.00 36.38 34.06 3ijq s VAL 76 CO 0.01 0.10 0.05 -1.61 0.00 0.00 0.00 175.10 173.66 3ijq s GLU 77 N -2.10 0.00 -0.18 2.72 2.02 0.16 -0.56 118.70 120.76 3ijq s GLU 77 Ca 0.17 0.19 0.01 0.00 0.02 0.00 0.00 54.97 55.36 3ijq s GLU 77 Cb -0.10 -0.18 0.02 0.00 0.10 0.00 0.00 34.13 33.97 3ijq s GLU 77 CO 0.09 -0.13 -0.19 0.42 0.02 0.00 0.00 175.26 175.47 3ijq s ILE 78 N 0.85 2.01 -0.08 -1.63 1.01 -0.41 -0.86 121.20 122.08 3ijq s ILE 78 Ca -0.07 -0.96 -0.04 0.00 0.00 0.00 0.00 60.65 59.58 3ijq s ILE 78 Cb -0.10 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 3ijq s ILE 78 CO -0.03 0.48 0.09 -0.70 0.00 0.00 0.00 174.94 174.78 3ijq s GLU 79 N 1.30 3.23 -0.24 2.79 -6.30 0.48 -1.05 118.70 118.91 3ijq s GLU 79 Ca 0.04 -0.29 -0.08 0.00 -2.50 0.00 0.00 54.97 52.14 3ijq s GLU 79 Cb -0.14 -3.00 0.11 0.00 0.00 0.00 0.00 34.13 31.10 3ijq s GLU 79 CO -0.12 0.73 0.50 -0.47 0.02 0.00 0.00 175.26 175.91 3ijq s TYR 80 N -1.03 -1.00 -1.49 5.30 5.04 -0.24 -1.56 117.35 122.37 3ijq s TYR 80 Ca 0.16 1.78 -0.05 0.00 -2.44 0.00 0.00 57.07 56.53 3ijq s TYR 80 Cb -0.12 0.47 0.01 0.00 0.35 0.00 0.00 41.96 42.67 3ijq s TYR 80 CO 0.06 -0.56 0.13 0.39 -1.34 0.00 0.00 175.55 174.23 3ijq n GLU 81 N 5.41 -1.04 -0.65 4.97 1.02 -1.26 0.40 120.64 129.49 3ijq n GLU 81 Ca -0.09 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3ijq n GLU 81 Cb 0.49 -3.52 0.00 0.00 -0.02 0.00 0.00 31.44 28.40 3ijq n GLU 81 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ijq n GLY 82 N -2.47 1.41 3.79 0.62 0.00 -1.26 -5.01 105.19 102.27 3ijq n GLY 82 Ca -0.30 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 3ijq n GLY 82 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ijq s VAL 83 N -3.35 5.22 -0.12 1.61 1.01 0.16 -5.09 120.40 119.84 3ijq s VAL 83 Ca 0.00 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.11 3ijq s VAL 83 Cb 0.00 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.08 3ijq s VAL 83 CO 0.00 0.56 -0.21 -0.89 0.00 0.00 0.00 175.10 174.57 3ijq s THR 84 N -0.56 2.29 -0.13 3.92 2.01 -1.26 -1.08 115.64 120.83 3ijq s THR 84 Ca 0.12 -0.92 -0.04 0.00 0.31 0.00 0.00 61.69 61.16 3ijq s THR 84 Cb -0.12 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.45 3ijq s THR 84 CO 0.02 0.55 0.01 -0.83 -0.69 0.00 0.00 174.62 173.68 3ijq s GLY 85 N 0.56 1.85 -0.14 4.40 0.00 -0.22 -4.71 107.32 109.06 3ijq s GLY 85 Ca -0.12 -0.78 -0.08 0.00 0.00 0.00 0.00 44.72 43.73 3ijq s GLY 85 CO 0.04 -0.29 0.15 -0.19 0.00 0.00 0.00 173.10 172.82 3ijq s TYR 86 N -0.29 3.54 0.29 1.90 2.02 -1.26 -1.29 117.35 122.26 3ijq s TYR 86 Ca 0.07 0.49 0.04 0.00 -0.37 0.00 0.00 57.07 57.29 3ijq s TYR 86 Cb -0.12 -2.04 -0.06 0.00 -0.40 0.00 0.00 41.96 39.34 3ijq s TYR 86 CO 0.02 0.58 0.02 0.20 -1.57 0.00 0.00 175.55 174.80 3ijq s GLY 87 N -0.54 1.86 -0.04 0.71 0.00 0.28 -3.16 107.32 106.43 3ijq s GLY 87 Ca 0.13 -1.94 -0.26 0.00 0.00 0.00 0.00 44.72 42.65 3ijq s GLY 87 CO 0.02 -1.77 0.58 1.85 0.00 0.00 0.00 173.10 173.78 3ijq s GLU 88 N -3.86 0.95 -0.07 2.90 2.12 -1.25 -1.47 118.70 118.01 3ijq s GLU 88 Ca 0.33 0.13 -0.01 0.00 0.36 0.00 0.00 54.97 55.78 3ijq s GLU 88 Cb 0.07 0.44 0.03 0.00 0.26 0.00 0.00 34.13 34.93 3ijq s GLU 88 CO 0.13 -0.29 -0.01 0.00 -0.54 0.00 0.00 175.26 174.55 3ijq s ALA 89 N -1.24 0.78 -0.10 6.30 0.00 -0.31 -3.46 121.76 123.72 3ijq s ALA 89 Ca -0.12 -0.17 -0.01 0.00 0.00 0.00 0.00 51.96 51.66 3ijq s ALA 89 Cb -0.01 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.33 3ijq s ALA 89 CO 0.08 -0.43 -0.05 0.45 0.00 0.00 0.00 175.76 175.82 3ijq s SER 90 N 1.87 4.75 -0.52 0.00 0.15 -1.26 -0.77 113.70 117.93 3ijq s SER 90 Ca 0.04 -0.04 0.04 0.00 0.70 0.00 0.00 55.95 56.68 3ijq s SER 90 Cb -0.12 -1.42 0.16 0.00 -1.71 0.00 0.00 66.02 62.92 3ijq s SER 90 CO -0.05 0.30 0.36 -0.04 1.20 0.00 0.00 173.24 175.00 3ijq s MET 91 N -0.41 1.53 -0.17 5.44 -1.94 0.18 -4.91 119.30 119.02 3ijq s MET 91 Ca 0.06 -2.48 -0.35 0.00 -1.71 0.00 0.00 55.69 51.21 3ijq s MET 91 Cb -0.12 -2.35 -0.12 0.00 2.01 0.00 0.00 34.83 34.24 3ijq s MET 91 CO 0.02 -1.29 1.91 -2.30 -0.01 0.00 0.00 175.02 173.36 3ijq n PRO 92 N 2.77 1.80 0.00 2.03 -0.02 -1.26 -4.01 135.00 136.31 3ijq n PRO 92 Ca 0.20 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3ijq n PRO 92 Cb 0.39 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3ijq n PRO 92 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3ijq n PRO 93 N 6.71 0.00 -0.14 0.52 -0.04 -1.26 -0.41 135.00 140.38 3ijq n PRO 93 Ca 0.26 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.76 3ijq n PRO 93 Cb 0.26 -0.91 0.06 0.00 -0.04 0.00 0.00 33.50 32.86 3ijq n PRO 93 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3ijq n TYR 94 N -0.05 0.00 -1.28 0.54 0.18 -1.26 -4.73 117.16 110.56 3ijq n TYR 94 Ca 0.00 -0.51 0.08 0.00 1.88 0.00 0.00 57.90 59.35 3ijq n TYR 94 Cb 0.00 -0.08 0.16 0.00 -0.38 0.00 0.00 39.34 39.04 3ijq n TYR 94 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3ijq n LEU 95 N -0.69 2.47 0.00 -3.48 4.77 0.45 -5.02 117.00 115.49 3ijq n LEU 95 Ca 0.06 -3.38 0.00 0.00 -0.03 0.00 0.00 56.01 52.66 3ijq n LEU 95 Cb 0.54 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3ijq n LEU 95 CO 0.00 0.97 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 3ijq n GLY 96 N -1.31 2.66 3.96 -0.72 0.00 -1.26 -5.00 105.19 103.52 3ijq n GLY 96 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 3ijq n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ijq s GLU 97 N -0.01 3.45 0.30 1.61 2.02 -1.26 -5.02 118.70 119.80 3ijq s GLU 97 Ca 0.00 -0.64 -0.00 0.00 0.02 0.00 0.00 54.97 54.35 3ijq s GLU 97 Cb 0.00 -2.83 -0.02 0.00 0.10 0.00 0.00 34.13 31.38 3ijq s GLU 97 CO 0.00 0.36 0.35 0.95 0.02 0.00 0.00 175.26 176.94 3ijq s THR 98 N -2.06 0.00 0.48 3.63 -4.23 -1.26 -4.69 115.64 107.50 3ijq s THR 98 Ca 0.36 -1.78 0.14 0.00 -1.18 0.00 0.00 61.69 59.23 3ijq s THR 98 Cb -0.09 -2.53 0.28 0.00 1.34 0.00 0.00 72.50 71.50 3ijq s THR 98 CO 0.31 0.00 2.09 0.58 -0.54 0.00 0.00 174.62 177.06 3ijq h VAL 99 N 2.22 1.00 0.25 2.29 2.07 -1.94 -1.36 116.25 120.79 3ijq h VAL 99 Ca -0.28 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 3ijq h VAL 99 Cb 1.24 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3ijq h VAL 99 CO 0.40 0.04 -0.12 -0.08 0.02 0.00 0.00 177.57 177.83 3ijq h GLU 100 N 0.21 -0.33 -0.64 1.57 4.81 -1.98 -0.95 114.58 117.27 3ijq h GLU 100 Ca 0.09 0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.46 3ijq h GLU 100 Cb 0.10 0.07 -0.09 0.00 0.63 0.00 0.00 28.75 29.47 3ijq h GLU 100 CO -0.02 -0.06 0.18 0.66 -0.73 0.00 0.00 179.01 179.05 3ijq h SER 101 N -1.01 0.10 0.07 1.04 4.64 -1.91 0.14 113.55 116.62 3ijq h SER 101 Ca -0.03 0.11 -0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3ijq h SER 101 Cb 0.42 0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3ijq h SER 101 CO 0.06 0.05 -0.03 0.58 -0.87 0.00 0.00 176.83 176.61 3ijq h VAL 102 N 0.32 1.09 -0.96 0.95 2.07 -1.34 -0.79 116.25 117.58 3ijq h VAL 102 Ca 0.34 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 67.35 3ijq h VAL 102 Cb 0.50 1.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.66 3ijq h VAL 102 CO -0.39 0.13 0.63 0.24 0.02 0.00 0.00 177.57 178.20 3ijq h MET 103 N -0.33 1.20 -0.29 1.57 2.07 -0.58 0.23 114.93 118.80 3ijq h MET 103 Ca -0.01 -0.07 -0.09 0.00 -2.07 0.00 0.00 59.70 57.46 3ijq h MET 103 Cb 0.29 -0.27 -0.01 0.00 -1.87 0.00 0.00 31.60 29.74 3ijq h MET 103 CO 0.02 0.80 -0.17 -0.91 1.07 0.00 0.00 176.91 177.71 3ijq h ASN 104 N 1.24 0.64 0.24 1.22 -0.26 -0.68 -2.24 115.58 115.75 3ijq h ASN 104 Ca 0.38 -0.42 -0.01 0.00 -0.56 0.00 0.00 56.30 55.68 3ijq h ASN 104 Cb -0.04 -0.18 -0.00 0.00 -1.06 0.00 0.00 38.32 37.04 3ijq h ASN 104 CO -0.11 0.93 -0.13 0.15 -1.06 0.00 0.00 177.43 177.21 3ijq h PHE 105 N 0.36 -0.33 -0.36 1.19 3.57 -0.72 -1.90 116.94 118.75 3ijq h PHE 105 Ca 0.06 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.66 3ijq h PHE 105 Cb 0.70 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.54 3ijq h PHE 105 CO 0.06 -0.20 0.32 -0.07 -2.23 0.00 0.00 178.31 176.19 3ijq h LEU 106 N -0.34 0.00 -0.62 0.59 3.38 -0.94 0.30 115.31 117.67 3ijq h LEU 106 Ca -0.03 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3ijq h LEU 106 Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3ijq h LEU 106 CO 0.04 0.00 -0.39 0.11 0.09 0.00 0.00 178.44 178.29 3ijq h LYS 107 N 0.00 0.00 0.00 1.13 1.57 -0.72 -2.67 116.57 115.88 3ijq h LYS 107 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3ijq h LYS 107 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 3ijq h LYS 107 CO -0.00 0.39 0.00 1.63 -0.57 0.00 0.00 179.45 180.90 3ijq n LYS 108 N -3.39 0.22 -3.07 3.15 5.02 0.10 -4.77 118.16 115.42 3ijq n LYS 108 Ca 0.01 0.02 -0.40 0.00 -2.02 0.00 0.00 58.31 55.91 3ijq n LYS 108 Cb 0.58 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.03 3ijq n LYS 108 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3ijq s VAL 109 N -2.77 4.98 -0.32 -0.18 1.01 -1.01 -5.04 120.40 117.07 3ijq s VAL 109 Ca 0.21 1.25 -0.05 0.00 0.00 0.00 0.00 61.98 63.39 3ijq s VAL 109 Cb 0.19 -3.98 0.03 0.00 0.00 0.00 0.00 36.38 32.63 3ijq s VAL 109 CO 0.47 0.06 0.07 0.21 0.00 0.00 0.00 175.10 175.92 3ijq s ASN 110 N 1.28 5.15 -0.02 3.32 2.47 -1.26 -4.93 114.94 120.96 3ijq s ASN 110 Ca 0.30 -1.06 0.13 0.00 0.42 0.00 0.00 52.86 52.65 3ijq s ASN 110 Cb -0.16 -1.83 -0.20 0.00 -1.45 0.00 0.00 41.25 37.61 3ijq s ASN 110 CO 0.10 -0.28 0.33 0.18 -3.72 0.00 0.00 177.10 173.71 3ijq n LEU 111 N 4.78 0.09 0.19 3.21 4.77 -1.26 -4.43 117.00 124.35 3ijq n LEU 111 Ca -0.13 -0.07 0.14 0.00 -0.03 0.00 0.00 56.01 55.91 3ijq n LEU 111 Cb 0.45 0.00 0.65 0.00 -2.33 0.00 0.00 43.42 42.20 3ijq n LEU 111 CO 0.30 0.02 0.91 -0.33 -1.33 0.00 0.00 177.39 176.97 3ijq h GLU 112 N 0.00 0.00 0.00 3.23 5.08 -1.91 0.24 114.58 121.21 3ijq h GLU 112 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ijq h GLU 112 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3ijq h GLU 112 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 3ijq n GLN 113 N -2.48 0.05 -3.73 2.33 10.64 -1.26 -4.61 117.38 118.32 3ijq n GLN 113 Ca -0.00 0.06 -0.37 0.00 -1.83 0.00 0.00 57.00 54.86 3ijq n GLN 113 Cb 0.15 -1.50 -0.12 0.00 -0.86 0.00 0.00 30.24 27.90 3ijq n GLN 113 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3ijq s PHE 114 N -2.94 3.11 -1.16 2.61 0.08 0.83 -4.96 117.98 115.55 3ijq s PHE 114 Ca 0.14 -0.31 0.23 0.00 0.12 0.00 0.00 56.93 57.11 3ijq s PHE 114 Cb 0.17 -2.26 0.19 0.00 -0.57 0.00 0.00 43.02 40.55 3ijq s PHE 114 CO 0.45 -0.31 1.20 -1.13 -0.10 0.00 0.00 175.22 175.33 3ijq n SER 115 N 4.90 0.88 -3.76 1.36 3.41 -1.26 -3.47 113.62 115.69 3ijq n SER 115 Ca -0.16 -0.72 -0.29 0.00 -0.26 0.00 0.00 58.87 57.44 3ijq n SER 115 Cb 0.52 0.56 -0.16 0.00 -0.26 0.00 0.00 64.21 64.86 3ijq n SER 115 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3ijq s ASP 116 N -2.91 3.45 0.55 4.04 2.15 -1.26 -4.89 116.67 117.81 3ijq s ASP 116 Ca 0.12 -1.17 0.24 0.00 0.43 0.00 0.00 52.55 52.17 3ijq s ASP 116 Cb 0.17 -0.76 1.48 0.00 -0.30 0.00 0.00 42.92 43.51 3ijq s ASP 116 CO 0.74 -0.34 2.09 -0.65 -0.17 0.00 0.00 175.17 176.84 3ijq h PRO 117 N 8.15 0.00 0.00 4.34 0.11 -2.00 -2.64 132.00 139.97 3ijq h PRO 117 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3ijq h PRO 117 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3ijq h PRO 117 CO 0.40 0.00 0.00 0.74 -0.21 0.00 0.00 178.00 178.93 3ijq h PHE 118 N 0.00 0.00 0.00 0.65 0.04 -1.95 -3.34 116.94 112.34 3ijq h PHE 118 Ca 0.10 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 60.23 3ijq h PHE 118 Cb 0.47 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.63 3ijq h PHE 118 CO 0.00 0.00 3.36 1.04 -0.60 0.00 0.00 178.31 182.11 3ijq n GLN 119 N -2.99 3.07 0.05 1.51 6.02 -1.00 -4.61 117.38 119.44 3ijq n GLN 119 Ca -0.00 -2.22 -0.00 0.00 -0.01 0.00 0.00 57.00 54.76 3ijq n GLN 119 Cb 0.23 -2.93 0.29 0.00 1.02 0.00 0.00 30.24 28.85 3ijq n GLN 119 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3ijq h LEU 120 N 8.66 0.38 0.45 1.08 3.38 -1.87 -1.13 115.31 126.26 3ijq h LEU 120 Ca 0.70 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.55 3ijq h LEU 120 Cb 0.41 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3ijq h LEU 120 CO 1.80 0.56 -0.22 -0.08 0.09 0.00 0.00 178.44 180.59 3ijq h GLU 121 N 0.37 -0.58 -0.17 1.13 4.57 -1.95 -1.34 114.58 116.60 3ijq h GLU 121 Ca 0.07 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.28 3ijq h GLU 121 Cb 0.48 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 3ijq h GLU 121 CO 0.03 -0.30 0.07 -0.44 -1.18 0.00 0.00 179.01 177.19 3ijq h ASP 122 N -0.79 0.22 0.27 1.04 5.19 -1.93 -2.03 116.42 118.39 3ijq h ASP 122 Ca -0.06 -0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.20 3ijq h ASP 122 Cb 0.55 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.00 3ijq h ASP 122 CO 0.10 0.30 -0.13 0.40 -3.12 0.00 0.00 179.24 176.79 3ijq h ILE 123 N 0.13 0.76 0.00 0.35 2.04 -1.26 -1.10 117.51 118.44 3ijq h ILE 123 Ca 0.06 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 3ijq h ILE 123 Cb 0.14 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 3ijq h ILE 123 CO -0.01 0.04 -0.13 -0.07 0.00 0.00 0.00 178.15 177.98 3ijq h LEU 124 N -0.47 0.00 -0.33 1.44 3.38 -1.31 -0.09 115.31 117.93 3ijq h LEU 124 Ca -0.04 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.74 3ijq h LEU 124 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3ijq h LEU 124 CO 0.06 0.13 -0.70 -1.28 0.09 0.00 0.00 178.44 176.74 3ijq h SER 125 N 0.00 0.70 -0.54 -0.43 0.87 -1.17 -1.03 113.55 111.95 3ijq h SER 125 Ca -0.00 -0.44 -0.12 0.00 -1.23 0.00 0.00 61.79 60.00 3ijq h SER 125 Cb 0.51 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 3ijq h SER 125 CO 0.02 1.20 -0.12 0.22 -0.53 0.00 0.00 176.83 177.61 3ijq h TYR 126 N 0.42 1.17 -0.55 2.24 3.20 -0.22 -2.26 116.97 120.97 3ijq h TYR 126 Ca -0.03 -0.25 -0.08 0.00 3.14 0.00 0.00 58.73 61.51 3ijq h TYR 126 Cb 1.29 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 39.26 3ijq h TYR 126 CO 0.06 1.08 0.04 0.28 -1.64 0.00 0.00 178.16 177.98 3ijq h VAL 127 N 0.92 1.26 0.00 1.81 2.07 -0.93 -2.81 116.25 118.57 3ijq h VAL 127 Ca 0.14 -1.06 -0.06 0.00 0.82 0.00 0.00 66.70 66.54 3ijq h VAL 127 Cb 0.70 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 3ijq h VAL 127 CO 0.05 0.38 -0.27 -0.78 0.02 0.00 0.00 177.57 176.98 3ijq h ASP 128 N 0.84 0.00 1.39 0.57 3.58 -1.06 -2.63 116.42 119.10 3ijq h ASP 128 Ca 0.16 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.61 3ijq h ASP 128 Cb 0.49 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.54 3ijq h ASP 128 CO 0.02 0.27 0.00 0.77 -2.88 0.00 0.00 179.24 177.42 3ijq h SER 129 N 0.00 0.00 0.31 2.28 4.64 -1.14 -3.22 113.55 116.42 3ijq h SER 129 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ijq h SER 129 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 3ijq h SER 129 CO 0.03 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.17 3ijq n LEU 130 N -2.72 0.00 -3.62 5.97 4.77 -0.99 -4.83 117.00 115.58 3ijq n LEU 130 Ca 0.03 0.43 -0.03 0.00 -0.03 0.00 0.00 56.01 56.42 3ijq n LEU 130 Cb 0.39 -0.43 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 3ijq n LEU 130 CO 0.29 -0.28 1.11 -0.94 -1.33 0.00 0.00 177.39 176.24 3ijq s SER 131 N -2.87 -0.07 0.38 -1.43 1.04 -1.22 -5.05 113.70 104.49 3ijq s SER 131 Ca 0.07 -0.01 0.21 0.00 0.48 0.00 0.00 55.95 56.70 3ijq s SER 131 Cb 0.07 0.07 0.47 0.00 0.10 0.00 0.00 66.02 66.73 3ijq s SER 131 CO 0.19 -0.12 1.63 1.55 0.98 0.00 0.00 173.24 177.46 3ijq h PRO 132 N 2.00 0.00 0.00 4.02 0.13 -1.88 -3.47 132.00 132.80 3ijq h PRO 132 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3ijq h PRO 132 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3ijq h PRO 132 CO 0.21 0.27 0.00 1.63 -0.23 0.00 0.00 178.00 179.89 3ijq n LYS 133 N -3.24 0.00 -4.22 0.86 4.76 -1.26 -4.98 118.16 110.08 3ijq n LYS 133 Ca 0.02 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.11 3ijq n LYS 133 Cb 0.57 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.72 3ijq n LYS 133 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 3ijq n ASP 134 N 0.00 -2.33 -0.33 4.39 8.00 -1.26 -4.85 116.55 120.16 3ijq n ASP 134 Ca 0.00 -1.06 -0.01 0.00 0.71 0.00 0.00 54.79 54.44 3ijq n ASP 134 Cb 0.00 -2.60 0.13 0.00 -0.02 0.00 0.00 41.12 38.63 3ijq n ASP 134 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 3ijq h THR 135 N -1.51 1.13 -0.14 -3.53 1.35 -1.88 -1.06 112.91 107.26 3ijq h THR 135 Ca -0.60 -0.38 -0.01 0.00 -0.55 0.00 0.00 66.41 64.87 3ijq h THR 135 Cb 1.38 -0.08 -0.01 0.00 -1.73 0.00 0.00 68.15 67.71 3ijq h THR 135 CO 0.76 0.20 0.07 0.00 -0.25 0.00 0.00 175.52 176.31 3ijq h ALA 136 N 1.38 0.19 -0.91 6.62 0.00 -1.76 0.47 119.26 125.25 3ijq h ALA 136 Ca 0.37 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3ijq h ALA 136 Cb 0.04 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3ijq h ALA 136 CO -0.13 -0.25 0.60 0.00 0.00 0.00 0.00 179.25 179.47 3ijq h ALA 137 N 0.93 1.16 -0.42 0.00 0.00 -1.83 -1.85 119.26 117.25 3ijq h ALA 137 Ca 0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3ijq h ALA 137 Cb 0.13 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3ijq h ALA 137 CO -0.01 0.56 0.04 0.87 0.00 0.00 0.00 179.25 180.71 3ijq h LYS 138 N 1.24 0.71 -0.32 0.00 1.57 -0.80 -2.72 116.57 116.25 3ijq h LYS 138 Ca 0.33 -0.21 0.05 0.00 -1.87 0.00 0.00 60.65 58.96 3ijq h LYS 138 Cb -0.14 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.08 3ijq h LYS 138 CO -0.07 0.77 0.22 0.00 -0.57 0.00 0.00 179.45 179.80 3ijq h ALA 139 N 0.91 2.05 -0.50 3.86 0.00 0.47 -1.36 119.26 124.70 3ijq h ALA 139 Ca 0.12 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3ijq h ALA 139 Cb 0.43 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3ijq h ALA 139 CO 0.01 -0.12 0.10 0.00 0.00 0.00 0.00 179.25 179.24 3ijq h ALA 140 N 1.83 0.66 -0.35 0.00 0.00 -1.03 0.16 119.26 120.53 3ijq h ALA 140 Ca 0.14 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3ijq h ALA 140 Cb 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3ijq h ALA 140 CO -0.02 0.37 -0.19 0.28 0.00 0.00 0.00 179.25 179.69 3ijq h VAL 141 N 0.69 1.29 -0.11 0.00 2.07 -1.29 -1.91 116.25 116.99 3ijq h VAL 141 Ca 0.15 -1.32 0.02 0.00 0.82 0.00 0.00 66.70 66.37 3ijq h VAL 141 Cb 0.37 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 3ijq h VAL 141 CO 0.01 0.43 -0.01 -0.78 0.02 0.00 0.00 177.57 177.24 3ijq h ASP 142 N 0.53 -0.05 -0.28 0.57 3.58 -1.03 -0.91 116.42 118.83 3ijq h ASP 142 Ca 0.08 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.55 3ijq h ASP 142 Cb 0.74 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.82 3ijq h ASP 142 CO 0.06 -0.01 0.17 0.40 -2.88 0.00 0.00 179.24 176.98 3ijq h ILE 143 N 0.03 1.10 -0.64 2.25 2.04 -0.62 -1.21 117.51 120.46 3ijq h ILE 143 Ca 0.05 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 3ijq h ILE 143 Cb 0.06 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 3ijq h ILE 143 CO -0.09 0.10 0.32 0.00 0.00 0.00 0.00 178.15 178.47 3ijq h ALA 144 N 1.07 0.82 -0.92 1.87 0.00 -1.22 -1.38 119.26 119.49 3ijq h ALA 144 Ca 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3ijq h ALA 144 Cb 0.01 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 3ijq h ALA 144 CO -0.02 0.38 0.53 -0.07 0.00 0.00 0.00 179.25 180.07 3ijq h LEU 145 N 0.88 1.13 -0.52 0.00 3.38 -0.83 -0.93 115.31 118.42 3ijq h LEU 145 Ca 0.22 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 3ijq h LEU 145 Cb 0.10 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3ijq h LEU 145 CO -0.03 0.89 -0.28 0.45 0.09 0.00 0.00 178.44 179.56 3ijq h HIS 146 N 1.28 1.05 -0.02 1.13 3.86 -0.93 -0.49 115.15 121.04 3ijq h HIS 146 Ca 0.33 -0.27 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3ijq h HIS 146 Cb -0.01 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.22 3ijq h HIS 146 CO 0.01 1.07 0.01 0.22 0.86 0.00 0.00 177.93 180.10 3ijq h ASP 147 N 0.77 0.02 0.11 2.45 3.58 -0.89 0.11 116.42 122.57 3ijq h ASP 147 Ca 0.09 -0.02 0.02 0.00 0.42 0.00 0.00 57.03 57.53 3ijq h ASP 147 Cb 0.85 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.86 3ijq h ASP 147 CO 0.07 0.04 -0.23 0.25 -2.88 0.00 0.00 179.24 176.49 3ijq h LEU 148 N 0.00 -0.66 -0.98 2.28 5.85 -1.04 -0.63 115.31 120.13 3ijq h LEU 148 Ca 0.01 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.84 3ijq h LEU 148 Cb 0.02 0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.25 3ijq h LEU 148 CO -0.00 -0.32 0.64 0.58 -0.34 0.00 0.00 178.44 179.00 3ijq h VAL 149 N -0.43 1.18 -0.57 1.05 2.07 -0.92 -0.25 116.25 118.38 3ijq h VAL 149 Ca 0.03 -0.43 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 3ijq h VAL 149 Cb 0.46 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 3ijq h VAL 149 CO -0.13 0.23 0.19 1.23 0.02 0.00 0.00 177.57 179.10 3ijq h GLY 150 N 1.24 0.94 1.01 2.17 0.00 -0.44 -0.80 103.07 107.19 3ijq h GLY 150 Ca 0.39 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 3ijq h GLY 150 CO -0.12 0.51 0.39 0.50 0.00 0.00 0.00 176.54 177.83 3ijq h LYS 151 N 0.80 1.03 -0.18 4.80 1.57 -0.37 0.49 116.57 124.71 3ijq h LYS 151 Ca 0.19 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 3ijq h LYS 151 Cb 0.27 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3ijq h LYS 151 CO -0.01 0.78 -0.26 -0.07 -0.57 0.00 0.00 179.45 179.32 3ijq h LEU 152 N 1.02 0.34 0.00 2.94 3.38 -0.79 -2.39 115.31 119.80 3ijq h LEU 152 Ca 0.26 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3ijq h LEU 152 Cb 0.05 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3ijq h LEU 152 CO -0.04 0.60 -0.29 -0.07 0.09 0.00 0.00 178.44 178.73 3ijq h LEU 153 N 0.30 0.00 -0.31 1.67 3.38 -0.48 -3.48 115.31 116.39 3ijq h LEU 153 Ca 0.05 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 3ijq h LEU 153 Cb 0.63 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.39 3ijq h LEU 153 CO 0.04 0.01 -0.14 0.61 0.09 0.00 0.00 178.44 179.05 3ijq n GLY 154 N 1.16 0.45 3.30 0.83 0.00 0.16 -5.05 105.19 106.03 3ijq n GLY 154 Ca 0.03 -0.56 -0.14 0.00 0.00 0.00 0.00 46.02 45.35 3ijq n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ijq s ALA 155 N -2.73 -0.99 0.59 4.61 0.00 -0.52 -4.87 121.76 117.85 3ijq s ALA 155 Ca 0.08 0.52 -0.16 0.00 0.00 0.00 0.00 51.96 52.40 3ijq s ALA 155 Cb -0.03 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 3ijq s ALA 155 CO 0.10 -0.29 1.05 -2.14 0.00 0.00 0.00 175.76 174.48 3ijq s PRO 156 N -1.34 3.35 0.39 0.00 0.02 -1.26 -1.41 135.00 134.75 3ijq s PRO 156 Ca -0.13 1.20 0.16 0.00 0.02 0.00 0.00 61.00 62.25 3ijq s PRO 156 Cb -0.04 -2.04 0.80 0.00 0.02 0.00 0.00 34.50 33.25 3ijq s PRO 156 CO 0.05 -0.78 1.83 -1.49 -0.33 0.00 0.00 177.00 176.28 3ijq h TRP 157 N 0.49 0.00 -0.22 6.54 4.06 -1.71 -1.68 115.95 123.42 3ijq h TRP 157 Ca -0.47 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.47 3ijq h TRP 157 Cb 1.22 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.37 3ijq h TRP 157 CO 0.59 0.35 0.07 0.10 -3.56 0.00 0.00 178.44 175.99 3ijq h TYR 158 N 0.00 0.30 0.10 0.49 -0.00 -1.86 0.14 116.97 116.14 3ijq h TYR 158 Ca -0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 58.73 58.51 3ijq h TYR 158 Cb 0.68 -0.10 0.02 0.00 0.00 0.00 0.00 36.73 37.33 3ijq h TYR 158 CO 0.00 0.26 -0.88 -0.22 -0.00 0.00 0.00 178.16 177.32 3ijq h LYS 159 N 0.31 0.42 -0.79 0.10 3.64 -1.69 0.24 116.57 118.80 3ijq h LYS 159 Ca 0.08 -0.59 0.01 0.00 -1.27 0.00 0.00 60.65 58.88 3ijq h LYS 159 Cb 0.09 0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 3ijq h LYS 159 CO -0.01 1.24 0.52 0.82 -2.27 0.00 0.00 179.45 179.76 3ijq h ILE 160 N -0.12 1.20 0.00 2.00 2.04 -0.85 0.10 117.51 121.88 3ijq h ILE 160 Ca -0.14 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.36 3ijq h ILE 160 Cb 1.63 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 3ijq h ILE 160 CO 0.17 0.19 0.00 0.79 0.00 0.00 0.00 178.15 179.30 3ijq n TRP 161 N -4.42 0.00 -1.75 1.37 8.01 0.44 -4.91 117.44 116.17 3ijq n TRP 161 Ca 0.09 0.00 -0.08 0.00 -1.31 0.00 0.00 57.50 56.20 3ijq n TRP 161 Cb 0.03 -0.03 -0.02 0.00 -2.01 0.00 0.00 31.31 29.28 3ijq n TRP 161 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3ijq n GLY 162 N 0.95 0.47 3.94 6.99 0.00 0.36 -5.04 105.19 112.86 3ijq n GLY 162 Ca 0.22 -0.60 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 3ijq n GLY 162 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ijq s LEU 163 N -2.16 3.81 -0.46 0.99 1.43 0.81 -5.00 118.68 118.09 3ijq s LEU 163 Ca 0.00 0.43 -0.17 0.00 -1.03 0.00 0.00 54.13 53.37 3ijq s LEU 163 Cb 0.00 -3.31 0.05 0.00 0.03 0.00 0.00 46.19 42.96 3ijq s LEU 163 CO 0.00 -0.51 0.46 0.21 0.23 0.00 0.00 176.35 176.74 3ijq s ASN 164 N -4.12 6.18 0.63 2.29 3.84 -1.26 -4.59 114.94 117.90 3ijq s ASN 164 Ca 0.44 -1.02 0.36 0.00 0.21 0.00 0.00 52.86 52.86 3ijq s ASN 164 Cb -0.10 -2.22 1.96 0.00 -0.55 0.00 0.00 41.25 40.34 3ijq s ASN 164 CO 0.38 -0.68 2.10 0.07 -2.79 0.00 0.00 177.10 176.18 3ijq h LYS 165 N 8.81 0.00 0.00 0.43 2.10 -1.97 0.15 116.57 126.08 3ijq h LYS 165 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 3ijq h LYS 165 Cb 1.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.44 3ijq h LYS 165 CO 0.87 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.71 3ijq n GLU 166 N -2.90 0.00 -0.75 0.07 -0.58 -1.26 -2.92 120.64 112.30 3ijq n GLU 166 Ca -0.02 0.11 0.08 0.00 -0.42 0.00 0.00 57.16 56.91 3ijq n GLU 166 Cb 0.20 -1.50 0.38 0.00 -0.57 0.00 0.00 31.44 29.94 3ijq n GLU 166 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3ijq n LYS 167 N -1.51 4.28 -1.88 3.49 5.02 0.53 -4.96 118.16 123.14 3ijq n LYS 167 Ca 0.05 -2.95 -0.37 0.00 -2.02 0.00 0.00 58.31 53.03 3ijq n LYS 167 Cb 0.26 -2.08 0.05 0.00 -0.02 0.00 0.00 35.03 33.24 3ijq n LYS 167 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3ijq s THR 168 N -2.30 2.33 0.73 -0.18 -4.23 -1.15 -4.43 115.64 106.40 3ijq s THR 168 Ca 0.52 0.21 -0.05 0.00 -1.18 0.00 0.00 61.69 61.19 3ijq s THR 168 Cb 0.37 -3.09 0.10 0.00 1.34 0.00 0.00 72.50 71.22 3ijq s THR 168 CO 0.20 -0.04 1.02 -2.16 -0.54 0.00 0.00 174.62 173.10 3ijq s PRO 169 N -3.30 1.84 0.26 3.99 0.04 -1.26 -4.75 135.00 131.82 3ijq s PRO 169 Ca 0.79 -0.63 -0.22 0.00 0.04 0.00 0.00 61.00 60.98 3ijq s PRO 169 Cb -0.34 -2.22 -0.09 0.00 0.04 0.00 0.00 34.50 31.89 3ijq s PRO 169 CO 0.37 -1.41 0.80 -1.12 0.04 0.00 0.00 177.00 175.68 3ijq s SER 170 N -4.63 7.14 0.11 6.66 0.01 -1.26 -1.16 113.70 120.57 3ijq s SER 170 Ca 0.64 1.55 0.03 0.00 1.31 0.00 0.00 55.95 59.48 3ijq s SER 170 Cb -0.08 -2.47 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 3ijq s SER 170 CO 0.45 -0.01 0.16 0.28 0.41 0.00 0.00 173.24 174.53 3ijq s THR 171 N -1.58 4.83 0.80 1.44 -1.32 -0.92 -4.13 115.64 114.77 3ijq s THR 171 Ca 0.46 -0.77 -0.08 0.00 -1.21 0.00 0.00 61.69 60.08 3ijq s THR 171 Cb -0.17 -3.41 0.13 0.00 -1.51 0.00 0.00 72.50 67.54 3ijq s THR 171 CO 0.22 0.02 1.12 0.42 -2.21 0.00 0.00 174.62 174.18 3ijq s THR 172 N -1.59 2.13 -0.12 5.08 -4.23 -0.69 -4.51 115.64 111.71 3ijq s THR 172 Ca 0.32 -0.27 -0.13 0.00 -1.18 0.00 0.00 61.69 60.43 3ijq s THR 172 Cb -0.11 -2.86 0.03 0.00 1.34 0.00 0.00 72.50 70.90 3ijq s THR 172 CO 0.25 0.00 0.37 0.12 -0.54 0.00 0.00 174.62 174.81 3ijq s PHE 173 N -3.45 -0.38 0.08 3.99 5.36 -1.24 -4.59 117.98 117.74 3ijq s PHE 173 Ca 0.67 0.91 -0.21 0.00 -0.96 0.00 0.00 56.93 57.35 3ijq s PHE 173 Cb -0.07 0.14 -0.07 0.00 -0.34 0.00 0.00 43.02 42.68 3ijq s PHE 173 CO 0.48 -0.22 0.61 0.99 -1.46 0.00 0.00 175.22 175.62 3ijq s THR 174 N 0.01 4.70 -0.55 0.12 2.01 -1.26 0.31 115.64 121.00 3ijq s THR 174 Ca -0.02 1.31 -0.06 0.00 0.31 0.00 0.00 61.69 63.23 3ijq s THR 174 Cb -0.03 -3.95 0.14 0.00 0.01 0.00 0.00 72.50 68.67 3ijq s THR 174 CO 0.01 0.52 0.39 -0.63 -0.69 0.00 0.00 174.62 174.23 3ijq s ILE 175 N -0.95 4.03 1.13 1.82 -1.09 -0.59 -4.93 121.20 120.62 3ijq s ILE 175 Ca 0.31 -2.28 -0.13 0.00 -2.23 0.00 0.00 60.65 56.32 3ijq s ILE 175 Cb -0.20 -3.64 0.24 0.00 -1.58 0.00 0.00 42.46 37.28 3ijq s ILE 175 CO 0.20 -0.82 0.91 0.61 -1.23 0.00 0.00 174.94 174.61 3ijq n GLY 176 N 4.30 -1.82 3.77 6.18 0.00 -1.26 -4.70 105.19 111.65 3ijq n GLY 176 Ca 0.00 -1.05 -0.40 0.00 0.00 0.00 0.00 46.02 44.58 3ijq n GLY 176 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ijq s ILE 177 N -2.42 4.40 0.00 -0.61 1.09 -1.26 -4.88 121.20 117.52 3ijq s ILE 177 Ca 0.67 1.75 0.00 0.00 -1.10 0.00 0.00 60.65 61.97 3ijq s ILE 177 Cb -0.24 -4.16 0.00 0.00 -1.06 0.00 0.00 42.46 37.00 3ijq s ILE 177 CO 0.64 0.49 0.00 -0.67 -0.10 0.00 0.00 174.94 175.30 3ijq n ASP 178 N 1.83 0.00 -4.86 3.58 -0.08 -1.26 -5.05 116.55 110.72 3ijq n ASP 178 Ca -0.04 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.90 3ijq n ASP 178 Cb 0.49 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.89 3ijq n ASP 178 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 3ijq s THR 179 N -1.78 4.81 0.24 5.18 -4.23 -1.26 -4.77 115.64 113.84 3ijq s THR 179 Ca 0.00 0.75 -0.09 0.00 -1.18 0.00 0.00 61.69 61.16 3ijq s THR 179 Cb 0.00 -3.66 0.36 0.00 1.34 0.00 0.00 72.50 70.54 3ijq s THR 179 CO 0.00 -0.01 1.40 -2.65 -0.54 0.00 0.00 174.62 172.81 3ijq n PRO 180 N 0.07 -0.11 -0.03 3.99 -0.02 -1.26 0.76 135.00 138.40 3ijq n PRO 180 Ca -0.00 1.39 -0.10 0.00 -2.02 0.00 0.00 63.50 62.77 3ijq n PRO 180 Cb 0.52 -2.08 -0.04 0.00 -0.02 0.00 0.00 33.50 31.89 3ijq n PRO 180 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3ijq h ASP 181 N 0.00 0.10 -0.22 2.55 3.32 -1.98 0.13 116.42 120.32 3ijq h ASP 181 Ca 0.40 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.43 3ijq h ASP 181 Cb 0.62 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 3ijq h ASP 181 CO -0.91 0.08 0.02 0.58 -1.72 0.00 0.00 179.24 177.29 3ijq h VAL 182 N 0.16 1.24 0.13 -1.35 2.07 -0.96 0.11 116.25 117.65 3ijq h VAL 182 Ca 0.07 -0.80 0.02 0.00 0.82 0.00 0.00 66.70 66.81 3ijq h VAL 182 Cb 0.02 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3ijq h VAL 182 CO -0.05 0.25 -0.26 0.58 0.02 0.00 0.00 177.57 178.11 3ijq h VAL 183 N 0.16 0.43 0.00 2.57 2.07 0.52 -0.52 116.25 121.48 3ijq h VAL 183 Ca 0.07 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 3ijq h VAL 183 Cb 0.35 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 3ijq h VAL 183 CO 0.01 0.00 -0.03 0.03 0.02 0.00 0.00 177.57 177.60 3ijq h ARG 184 N -0.48 0.00 0.00 1.57 3.08 -0.70 -2.04 114.38 115.82 3ijq h ARG 184 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3ijq h ARG 184 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 3ijq h ARG 184 CO -0.14 0.03 0.00 0.00 -1.07 0.00 0.00 179.97 178.79 3ijq n ALA 185 N -2.13 -0.10 -0.34 0.04 0.00 0.36 -2.76 120.51 115.57 3ijq n ALA 185 Ca -0.01 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.62 3ijq n ALA 185 Cb 0.21 0.00 0.41 0.00 0.00 0.00 0.00 19.45 20.07 3ijq n ALA 185 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3ijq h LYS 186 N 0.00 0.52 -0.89 0.00 1.79 -1.36 0.55 116.57 117.18 3ijq h LYS 186 Ca 0.00 -0.03 0.15 0.00 -2.18 0.00 0.00 60.65 58.58 3ijq h LYS 186 Cb 0.00 -0.12 -0.07 0.00 -1.58 0.00 0.00 32.23 30.46 3ijq h LYS 186 CO 0.00 0.35 0.58 1.15 -1.08 0.00 0.00 179.45 180.44 3ijq h THR 187 N 0.54 0.83 0.00 -0.16 2.02 -1.47 0.08 112.91 114.75 3ijq h THR 187 Ca 0.65 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.60 3ijq h THR 187 Cb 1.30 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.79 3ijq h THR 187 CO -0.48 0.13 -0.60 0.11 0.37 0.00 0.00 175.52 175.05 3ijq h LYS 188 N 0.69 0.00 0.00 6.66 1.57 0.23 -2.69 116.57 123.02 3ijq h LYS 188 Ca 0.45 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.16 3ijq h LYS 188 Cb 0.74 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 3ijq h LYS 188 CO -0.21 0.00 -0.36 0.93 -0.57 0.00 0.00 179.45 179.24 3ijq h GLU 189 N 0.00 0.00 0.00 3.15 5.08 0.30 -3.36 114.58 119.75 3ijq h GLU 189 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ijq h GLU 189 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 3ijq h GLU 189 CO 0.00 0.36 -0.13 0.00 -1.00 0.00 0.00 179.01 178.24 3ijq h ALA 191 N 0.00 1.02 0.00 0.00 0.00 -1.63 -0.47 119.26 118.18 3ijq h ALA 191 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ijq h ALA 191 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3ijq h ALA 191 CO 0.00 -0.02 0.00 0.78 0.00 0.00 0.00 179.25 180.01 3ijq h GLY 192 N 0.00 0.00 -0.72 0.00 0.00 -1.84 -3.28 103.07 97.23 3ijq h GLY 192 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ijq h GLY 192 CO 0.00 0.00 -0.34 1.04 0.00 0.00 0.00 176.54 177.24 3ijq n LEU 193 N -2.32 1.61 -4.30 3.11 4.77 -0.20 -4.97 117.00 114.71 3ijq n LEU 193 Ca 0.05 -0.76 -0.17 0.00 -0.03 0.00 0.00 56.01 55.10 3ijq n LEU 193 Cb 0.43 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.42 3ijq n LEU 193 CO 0.30 0.31 -0.43 -0.36 -1.33 0.00 0.00 177.39 175.88 3ijq s PHE 194 N -1.90 1.50 -1.32 -1.77 0.08 -1.15 -3.12 117.98 110.31 3ijq s PHE 194 Ca 0.13 -0.65 0.17 0.00 0.12 0.00 0.00 56.93 56.70 3ijq s PHE 194 Cb 0.13 -0.73 -0.05 0.00 -0.57 0.00 0.00 43.02 41.80 3ijq s PHE 194 CO 0.41 0.23 0.83 0.09 -0.10 0.00 0.00 175.22 176.67 3ijq n ASN 195 N -0.23 1.41 -3.63 1.36 5.03 -1.26 -4.88 115.26 113.06 3ijq n ASN 195 Ca -0.10 -1.21 -0.15 0.00 0.87 0.00 0.00 54.58 54.00 3ijq n ASN 195 Cb 0.60 0.62 -0.07 0.00 -1.02 0.00 0.00 39.78 39.91 3ijq n ASN 195 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 3ijq s ILE 196 N -2.13 0.00 0.06 2.41 2.07 -1.26 -4.19 121.20 118.16 3ijq s ILE 196 Ca 0.12 -0.03 0.08 0.00 -1.41 0.00 0.00 60.65 59.41 3ijq s ILE 196 Cb 0.13 -0.91 -0.03 0.00 0.13 0.00 0.00 42.46 41.78 3ijq s ILE 196 CO 0.49 -0.01 -0.22 -0.76 -1.91 0.00 0.00 174.94 172.53 3ijq s LEU 197 N -0.11 2.44 -0.12 8.50 1.43 -0.94 -3.70 118.68 126.18 3ijq s LEU 197 Ca -0.03 -0.52 -0.06 0.00 -1.03 0.00 0.00 54.13 52.49 3ijq s LEU 197 Cb -0.03 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.73 3ijq s LEU 197 CO 0.03 0.24 0.09 -0.75 0.23 0.00 0.00 176.35 176.20 3ijq s LYS 198 N -1.48 3.37 -0.05 1.70 2.20 0.15 -1.02 119.74 124.61 3ijq s LYS 198 Ca 0.14 -0.23 -0.01 0.00 -0.36 0.00 0.00 55.97 55.50 3ijq s LYS 198 Cb -0.10 -3.08 0.03 0.00 -1.51 0.00 0.00 37.83 33.17 3ijq s LYS 198 CO 0.05 0.70 0.02 0.08 -0.36 0.00 0.00 175.35 175.84 3ijq s VAL 199 N -0.83 0.12 -0.69 4.02 1.01 -0.21 -1.54 120.40 122.29 3ijq s VAL 199 Ca 0.13 0.23 -0.27 0.00 0.00 0.00 0.00 61.98 62.07 3ijq s VAL 199 Cb -0.12 -0.30 0.03 0.00 0.00 0.00 0.00 36.38 35.99 3ijq s VAL 199 CO 0.03 0.19 1.26 -0.54 0.00 0.00 0.00 175.10 176.04 3ijq s LYS 200 N 1.77 3.29 0.00 2.72 3.01 -1.26 -1.12 119.74 128.15 3ijq s LYS 200 Ca 0.01 -0.08 0.00 0.00 -1.01 0.00 0.00 55.97 54.89 3ijq s LYS 200 Cb -0.13 -4.13 0.00 0.00 -1.01 0.00 0.00 37.83 32.56 3ijq s LYS 200 CO -0.03 -2.01 0.00 1.28 0.51 0.00 0.00 175.35 175.10 3ijq n LEU 201 N 9.12 0.00 -0.74 3.17 4.77 -0.89 -4.77 117.00 127.67 3ijq n LEU 201 Ca 0.05 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.94 3ijq n LEU 201 Cb 0.49 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 3ijq n LEU 201 CO 0.71 0.00 -0.09 0.61 -1.33 0.00 0.00 177.39 177.29 3ijq n GLY 202 N 5.00 0.75 0.00 -0.72 0.00 -1.26 -4.57 105.19 104.40 3ijq n GLY 202 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 3ijq n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ijq n ARG 203 N -2.50 1.98 0.02 1.61 5.12 -1.26 -4.60 116.66 117.03 3ijq n ARG 203 Ca -0.09 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.70 3ijq n ARG 203 Cb 0.36 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.52 3ijq n ARG 203 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 3ijq h ASP 204 N 0.00 0.20 -0.88 0.55 3.32 -2.00 -3.35 116.42 114.26 3ijq h ASP 204 Ca 0.00 -0.34 -0.59 0.00 0.02 0.00 0.00 57.03 56.12 3ijq h ASP 204 Cb 0.00 -0.07 -0.25 0.00 0.22 0.00 0.00 39.33 39.24 3ijq h ASP 204 CO 0.00 1.30 0.76 -0.46 -1.72 0.00 0.00 179.24 179.11 3ijq n ASN 205 N -3.29 7.37 0.00 6.45 6.94 -1.26 -4.70 115.26 126.77 3ijq n ASN 205 Ca -0.17 -3.59 0.00 0.00 -0.02 0.00 0.00 54.58 50.79 3ijq n ASN 205 Cb 1.04 -1.01 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 3ijq n ASN 205 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3ijq n ASP 206 N -0.56 0.00 -0.33 0.53 8.00 -1.26 -2.08 116.55 120.86 3ijq n ASP 206 Ca 0.54 0.67 0.30 0.00 0.71 0.00 0.00 54.79 57.01 3ijq n ASP 206 Cb 0.63 -0.47 0.56 0.00 -0.02 0.00 0.00 41.12 41.81 3ijq n ASP 206 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3ijq h LYS 207 N 0.00 0.10 0.00 -1.24 1.57 -1.92 0.24 116.57 115.32 3ijq h LYS 207 Ca 0.00 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.62 3ijq h LYS 207 Cb 0.00 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3ijq h LYS 207 CO 0.00 0.06 -0.93 1.05 -0.57 0.00 0.00 179.45 179.07 3ijq h GLU 208 N 0.10 0.00 -0.55 3.15 4.11 -1.92 -3.10 114.58 116.36 3ijq h GLU 208 Ca 0.82 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 60.21 3ijq h GLU 208 Cb 2.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.31 3ijq h GLU 208 CO -0.71 0.51 0.20 1.98 0.07 0.00 0.00 179.01 181.05 3ijq h MET 209 N 0.00 0.84 0.03 1.06 4.05 0.05 0.12 114.93 121.08 3ijq h MET 209 Ca -0.07 -0.17 -0.00 0.00 -0.28 0.00 0.00 59.70 59.18 3ijq h MET 209 Cb 1.54 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 32.21 3ijq h MET 209 CO 0.07 0.75 -0.01 0.82 0.23 0.00 0.00 176.91 178.76 3ijq h ILE 210 N 0.76 1.10 -0.35 1.77 1.08 -1.52 -2.05 117.51 118.30 3ijq h ILE 210 Ca 0.18 -0.39 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 3ijq h ILE 210 Cb 0.23 1.36 -0.02 0.00 -3.07 0.00 0.00 36.82 35.33 3ijq h ILE 210 CO -0.01 0.10 0.22 -0.33 -0.69 0.00 0.00 178.15 177.44 3ijq h GLU 211 N -0.21 0.46 0.78 2.37 5.08 -1.45 0.96 114.58 122.57 3ijq h GLU 211 Ca -0.00 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 3ijq h GLU 211 Cb 0.20 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.35 3ijq h GLU 211 CO 0.01 0.31 -0.37 1.15 -1.00 0.00 0.00 179.01 179.10 3ijq h THR 212 N 0.47 0.10 -0.51 1.13 2.02 -0.73 -0.47 112.91 114.92 3ijq h THR 212 Ca 0.13 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 3ijq h THR 212 Cb -0.04 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.46 3ijq h THR 212 CO -0.03 0.01 0.27 0.40 0.37 0.00 0.00 175.52 176.54 3ijq h ILE 213 N -1.21 1.18 0.00 3.11 2.04 -1.09 -1.93 117.51 119.61 3ijq h ILE 213 Ca -0.11 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3ijq h ILE 213 Cb 0.82 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 3ijq h ILE 213 CO 0.18 0.20 0.00 -0.09 0.00 0.00 0.00 178.15 178.43 3ijq h ARG 214 N 0.68 0.00 -0.03 2.37 9.65 0.99 -1.27 114.38 126.78 3ijq h ARG 214 Ca 0.18 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.87 3ijq h ARG 214 Cb 0.07 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.65 3ijq h ARG 214 CO -0.03 0.00 -0.82 0.66 2.80 0.00 0.00 179.97 182.59 3ijq h SER 215 N 0.00 0.38 -0.35 -3.80 4.64 -0.24 -3.27 113.55 110.90 3ijq h SER 215 Ca 0.00 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3ijq h SER 215 Cb 0.03 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 3ijq h SER 215 CO 0.00 1.04 0.00 1.33 -0.87 0.00 0.00 176.83 178.33 3ijq n VAL 216 N -3.75 2.40 -3.60 0.95 0.24 -0.53 -5.00 118.33 109.04 3ijq n VAL 216 Ca -0.04 -1.74 -0.05 0.00 -2.04 0.00 0.00 64.34 60.47 3ijq n VAL 216 Cb 0.76 -0.25 -0.03 0.00 -1.47 0.00 0.00 33.84 32.85 3ijq n VAL 216 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3ijq s THR 217 N -2.78 0.00 -0.08 3.34 -1.32 -0.87 -4.77 115.64 109.15 3ijq s THR 217 Ca 0.46 0.00 0.12 0.00 -1.21 0.00 0.00 61.69 61.06 3ijq s THR 217 Cb 0.36 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.53 3ijq s THR 217 CO 0.11 0.00 1.08 -0.90 -2.21 0.00 0.00 174.62 172.70 3ijq n ASP 218 N 0.23 1.91 -4.74 8.08 5.75 -1.26 -4.32 116.55 122.20 3ijq n ASP 218 Ca -0.02 -2.65 -0.41 0.00 -0.01 0.00 0.00 54.79 51.69 3ijq n ASP 218 Cb 0.58 -0.30 -0.03 0.00 -1.03 0.00 0.00 41.12 40.35 3ijq n ASP 218 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3ijq s LEU 219 N -2.04 4.42 0.66 -2.12 1.43 -1.26 -4.97 118.68 114.81 3ijq s LEU 219 Ca 0.20 2.38 -0.17 0.00 -1.03 0.00 0.00 54.13 55.52 3ijq s LEU 219 Cb 0.18 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.76 3ijq s LEU 219 CO 0.02 -0.50 0.84 -0.81 0.23 0.00 0.00 176.35 176.12 3ijq n PRO 220 N 2.56 0.60 -4.77 1.29 -0.04 -1.26 -4.75 135.00 128.63 3ijq n PRO 220 Ca 0.06 0.25 -0.25 0.00 -0.04 0.00 0.00 63.50 63.52 3ijq n PRO 220 Cb 0.43 -2.07 -0.15 0.00 -0.04 0.00 0.00 33.50 31.67 3ijq n PRO 220 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3ijq s ILE 221 N -1.71 1.43 -0.11 0.52 1.01 -1.08 -2.22 121.20 119.04 3ijq s ILE 221 Ca 0.73 -0.86 0.02 0.00 0.00 0.00 0.00 60.65 60.53 3ijq s ILE 221 Cb -0.38 -1.21 -0.01 0.00 0.01 0.00 0.00 42.46 40.87 3ijq s ILE 221 CO 0.51 0.33 -0.16 0.00 0.00 0.00 0.00 174.94 175.61 3ijq s ALA 222 N -0.53 2.51 -0.01 9.38 0.00 -0.19 -0.63 121.76 132.30 3ijq s ALA 222 Ca 0.07 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 51.15 3ijq s ALA 222 Cb -0.07 -1.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.96 3ijq s ALA 222 CO -0.00 0.32 -0.16 0.14 0.00 0.00 0.00 175.76 176.05 3ijq s VAL 223 N 0.14 2.90 -0.40 0.00 -7.23 -0.63 -1.04 120.40 114.15 3ijq s VAL 223 Ca -0.08 -0.94 -0.02 0.00 -1.81 0.00 0.00 61.98 59.12 3ijq s VAL 223 Cb -0.15 -2.17 0.11 0.00 0.56 0.00 0.00 36.38 34.72 3ijq s VAL 223 CO 0.05 0.48 0.18 -0.62 -0.31 0.00 0.00 175.10 174.88 3ijq s ASP 224 N -1.05 5.19 0.30 4.85 -1.08 -0.28 -0.97 116.67 123.64 3ijq s ASP 224 Ca 0.13 -2.00 0.11 0.00 -0.52 0.00 0.00 52.55 50.27 3ijq s ASP 224 Cb -0.11 -1.80 0.48 0.00 -1.46 0.00 0.00 42.92 40.03 3ijq s ASP 224 CO 0.03 -0.51 1.68 0.00 0.52 0.00 0.00 175.17 176.89 3ijq h ALA 225 N 8.00 1.11 -5.50 3.66 0.00 -1.42 -2.36 119.26 122.75 3ijq h ALA 225 Ca -0.12 -0.48 -0.34 0.00 0.00 0.00 0.00 54.91 53.97 3ijq h ALA 225 Cb 1.05 -0.09 0.15 0.00 0.00 0.00 0.00 17.79 18.90 3ijq h ALA 225 CO 0.67 0.66 -0.70 0.09 0.00 0.00 0.00 179.25 179.98 3ijq n ASN 226 N -3.91 -3.57 -1.20 0.00 3.02 -0.95 -1.88 115.26 106.77 3ijq n ASN 226 Ca -0.01 -0.56 -0.16 0.00 -0.03 0.00 0.00 54.58 53.82 3ijq n ASN 226 Cb 0.54 -4.85 -0.07 0.00 -0.61 0.00 0.00 39.78 34.80 3ijq n ASN 226 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ijq n GLN 227 N -4.26 -1.15 0.00 3.52 6.02 0.38 -4.91 117.38 116.98 3ijq n GLN 227 Ca -0.17 1.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.87 3ijq n GLN 227 Cb 0.62 -5.24 0.00 0.00 1.02 0.00 0.00 30.24 26.65 3ijq n GLN 227 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ijq n GLY 228 N -0.92 -2.89 3.55 1.08 0.00 -0.79 -3.17 105.19 102.05 3ijq n GLY 228 Ca -0.16 0.07 -0.56 0.00 0.00 0.00 0.00 46.02 45.37 3ijq n GLY 228 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3ijq n TRP 229 N -0.96 1.75 -0.06 1.61 8.01 -1.07 -4.81 117.44 121.91 3ijq n TRP 229 Ca 0.00 0.52 -0.04 0.00 -1.31 0.00 0.00 57.50 56.67 3ijq n TRP 229 Cb 0.00 -2.44 -0.02 0.00 -2.01 0.00 0.00 31.31 26.83 3ijq n TRP 229 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 3ijq h LYS 230 N 9.10 0.00 -6.64 -0.99 1.79 -1.88 -3.37 116.57 114.58 3ijq h LYS 230 Ca -0.34 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.61 3ijq h LYS 230 Cb 1.34 0.00 0.05 0.00 -1.58 0.00 0.00 32.23 32.04 3ijq h LYS 230 CO 1.00 0.13 0.92 0.34 -1.08 0.00 0.00 179.45 180.76 3ijq s ASP 231 N -5.72 6.50 0.26 0.86 2.15 -1.26 -4.89 116.67 114.56 3ijq s ASP 231 Ca -0.08 2.73 0.05 0.00 0.43 0.00 0.00 52.55 55.68 3ijq s ASP 231 Cb 0.01 -2.60 0.33 0.00 -0.30 0.00 0.00 42.92 40.35 3ijq s ASP 231 CO 0.15 -0.88 1.61 0.08 -0.17 0.00 0.00 175.17 175.97 3ijq h ARG 232 N 6.58 0.24 -0.00 4.34 0.11 -1.94 -1.75 114.38 121.95 3ijq h ARG 232 Ca -0.43 -0.14 -0.22 0.00 0.10 0.00 0.00 59.98 59.28 3ijq h ARG 232 Cb 1.20 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.30 3ijq h ARG 232 CO 0.91 0.71 -0.93 0.37 0.10 0.00 0.00 179.97 181.13 3ijq h GLN 233 N 0.19 0.40 -0.23 0.08 -0.00 -1.96 -2.66 115.11 110.93 3ijq h GLN 233 Ca 0.00 -0.43 -0.05 0.00 -0.00 0.00 0.00 58.65 58.17 3ijq h GLN 233 Cb 0.99 0.12 -0.01 0.00 0.00 0.00 0.00 27.48 28.58 3ijq h GLN 233 CO 0.08 1.10 -0.09 -0.92 0.00 0.00 0.00 178.83 178.99 3ijq h TYR 234 N 0.23 0.38 0.11 3.99 3.20 -1.90 -2.59 116.97 120.38 3ijq h TYR 234 Ca -0.08 -0.04 -0.28 0.00 3.14 0.00 0.00 58.73 61.47 3ijq h TYR 234 Cb 1.57 -0.11 0.02 0.00 1.54 0.00 0.00 36.73 39.75 3ijq h TYR 234 CO 0.06 0.46 -1.20 0.00 -1.64 0.00 0.00 178.16 175.84 3ijq h ALA 235 N 1.56 0.10 -0.86 1.82 0.00 -1.29 -3.11 119.26 117.48 3ijq h ALA 235 Ca 0.07 -0.80 -0.03 0.00 0.00 0.00 0.00 54.91 54.15 3ijq h ALA 235 Cb 0.38 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 3ijq h ALA 235 CO 0.02 0.81 0.43 1.25 0.00 0.00 0.00 179.25 181.76 3ijq h LEU 236 N 0.19 1.12 -0.75 0.00 5.85 -1.23 -2.29 115.31 118.20 3ijq h LEU 236 Ca -0.15 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.36 3ijq h LEU 236 Cb 1.88 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 42.60 3ijq h LEU 236 CO 0.21 0.93 0.05 0.44 -0.34 0.00 0.00 178.44 179.73 3ijq h ASP 237 N 1.23 0.97 -0.02 1.25 3.32 -1.54 -2.95 116.42 118.67 3ijq h ASP 237 Ca 0.30 -0.24 0.03 0.00 0.02 0.00 0.00 57.03 57.14 3ijq h ASP 237 Cb 0.09 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.34 3ijq h ASP 237 CO -0.04 0.99 -0.24 0.24 -1.72 0.00 0.00 179.24 178.48 3ijq h MET 238 N 0.94 -0.35 -0.60 3.56 2.86 -1.35 0.47 114.93 120.45 3ijq h MET 238 Ca 0.18 0.02 0.17 0.00 -2.06 0.00 0.00 59.70 58.01 3ijq h MET 238 Cb 0.47 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 3ijq h MET 238 CO 0.02 -0.23 0.43 0.82 1.06 0.00 0.00 176.91 179.00 3ijq h ILE 239 N -0.36 0.72 -0.08 -1.22 2.04 -1.35 0.36 117.51 117.62 3ijq h ILE 239 Ca 0.07 -0.02 -0.13 0.00 1.00 0.00 0.00 64.86 65.78 3ijq h ILE 239 Cb 0.45 0.67 0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3ijq h ILE 239 CO -0.22 0.01 -0.45 0.45 0.00 0.00 0.00 178.15 177.94 3ijq h HIS 240 N 0.05 0.60 -0.48 1.37 3.86 -0.91 -1.86 115.15 117.78 3ijq h HIS 240 Ca 0.29 -0.27 -0.13 0.00 -1.16 0.00 0.00 60.37 59.10 3ijq h HIS 240 Cb 1.08 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.45 3ijq h HIS 240 CO -0.00 1.04 -0.20 2.35 0.86 0.00 0.00 177.93 181.98 3ijq h TRP 241 N -0.01 1.12 -0.17 2.45 7.01 0.88 -2.71 115.95 124.52 3ijq h TRP 241 Ca -0.03 -0.27 -0.02 0.00 2.11 0.00 0.00 58.89 60.68 3ijq h TRP 241 Cb 1.10 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.89 3ijq h TRP 241 CO 0.12 1.09 0.01 -0.07 -2.79 0.00 0.00 178.44 176.80 3ijq h LEU 242 N 0.83 0.28 -2.47 0.65 3.38 -0.45 -1.70 115.31 115.83 3ijq h LEU 242 Ca 0.11 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3ijq h LEU 242 Cb 0.77 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 3ijq h LEU 242 CO 0.06 0.50 0.06 0.50 0.09 0.00 0.00 178.44 179.66 3ijq h LYS 243 N 0.05 0.00 0.00 1.13 3.64 -1.33 0.61 116.57 120.68 3ijq h LYS 243 Ca 0.05 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.30 3ijq h LYS 243 Cb 0.35 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 3ijq h LYS 243 CO 0.01 0.00 -0.62 1.49 -2.27 0.00 0.00 179.45 178.06 3ijq h GLU 244 N 0.00 0.00 -0.81 1.90 4.81 -1.07 -3.13 114.58 116.27 3ijq h GLU 244 Ca 0.02 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 59.00 3ijq h GLU 244 Cb 0.15 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 29.38 3ijq h GLU 244 CO -0.00 0.62 0.32 1.63 -0.73 0.00 0.00 179.01 180.85 3ijq n LYS 245 N -3.35 3.36 -1.10 1.92 4.76 0.20 -4.92 118.16 119.04 3ijq n LYS 245 Ca 0.01 -2.89 -0.04 0.00 -2.87 0.00 0.00 58.31 52.53 3ijq n LYS 245 Cb 0.74 -2.16 -0.02 0.00 -1.84 0.00 0.00 35.03 31.75 3ijq n LYS 245 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ijq n GLY 246 N -0.27 0.66 3.78 0.72 0.00 -0.89 -4.91 105.19 104.28 3ijq n GLY 246 Ca 0.42 -0.80 -0.38 0.00 0.00 0.00 0.00 46.02 45.26 3ijq n GLY 246 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ijq s ILE 247 N -2.11 4.34 -0.26 -0.61 1.09 -0.49 -2.63 121.20 120.53 3ijq s ILE 247 Ca 0.00 1.69 0.03 0.00 -1.10 0.00 0.00 60.65 61.27 3ijq s ILE 247 Cb 0.00 -4.09 -0.00 0.00 -1.06 0.00 0.00 42.46 37.31 3ijq s ILE 247 CO 0.00 0.40 0.37 1.33 -0.10 0.00 0.00 174.94 176.94 3ijq n VAL 248 N 1.25 0.00 -3.66 2.92 0.24 0.20 -4.25 118.33 115.03 3ijq n VAL 248 Ca -0.03 -0.47 -0.13 0.00 -2.04 0.00 0.00 64.34 61.67 3ijq n VAL 248 Cb 0.49 1.03 -0.08 0.00 -1.47 0.00 0.00 33.84 33.82 3ijq n VAL 248 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 3ijq s MET 249 N -0.74 0.73 -0.15 7.34 -2.45 -1.25 -4.42 119.30 118.36 3ijq s MET 249 Ca 0.02 0.92 0.00 0.00 -1.25 0.00 0.00 55.69 55.39 3ijq s MET 249 Cb 0.02 0.32 -0.01 0.00 1.25 0.00 0.00 34.83 36.42 3ijq s MET 249 CO 0.07 -0.10 -0.14 0.42 1.05 0.00 0.00 175.02 176.32 3ijq s ILE 250 N 0.54 2.78 -0.21 10.11 -1.09 -0.85 -1.60 121.20 130.87 3ijq s ILE 250 Ca -0.02 -0.73 -0.03 0.00 -2.23 0.00 0.00 60.65 57.63 3ijq s ILE 250 Cb -0.05 -2.18 -0.01 0.00 -1.58 0.00 0.00 42.46 38.65 3ijq s ILE 250 CO -0.02 0.51 -0.05 -0.70 -1.23 0.00 0.00 174.94 173.45 3ijq s GLU 251 N 0.73 3.39 -0.86 2.79 2.12 -0.14 -0.72 118.70 126.01 3ijq s GLU 251 Ca -0.06 -0.63 -0.04 0.00 0.36 0.00 0.00 54.97 54.60 3ijq s GLU 251 Cb -0.15 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.27 3ijq s GLU 251 CO 0.01 -0.14 0.64 0.94 -0.54 0.00 0.00 175.26 176.18 3ijq n GLN 252 N 4.62 -1.38 0.32 4.30 -0.06 0.14 -1.50 117.38 123.82 3ijq n GLN 252 Ca -0.18 0.85 -0.18 0.00 -2.00 0.00 0.00 57.00 55.49 3ijq n GLN 252 Cb 0.51 -3.21 -0.09 0.00 -4.06 0.00 0.00 30.24 23.39 3ijq n GLN 252 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 3ijq h PRO 253 N -0.41 -0.97 -5.57 3.69 0.13 -1.86 0.12 132.00 127.13 3ijq h PRO 253 Ca -0.50 0.07 -0.61 0.00 -0.87 0.00 0.00 66.00 64.08 3ijq h PRO 253 Cb 1.31 0.22 -0.13 0.00 0.13 0.00 0.00 31.00 32.53 3ijq h PRO 253 CO 0.37 -0.65 -0.60 0.00 -0.23 0.00 0.00 178.00 176.90 3ijq s MET 254 N -5.92 1.93 0.74 0.86 0.23 -1.26 -2.10 119.30 113.77 3ijq s MET 254 Ca -0.18 -2.10 -0.17 0.00 -1.03 0.00 0.00 55.69 52.21 3ijq s MET 254 Cb 0.04 -1.51 -0.12 0.00 -1.53 0.00 0.00 34.83 31.71 3ijq s MET 254 CO 0.61 -0.09 -0.16 -2.30 -2.03 0.00 0.00 175.02 171.05 3ijq n PRO 255 N -0.94 0.06 0.10 3.16 -0.02 -1.19 -4.33 135.00 131.84 3ijq n PRO 255 Ca -0.05 0.03 -0.04 0.00 -2.02 0.00 0.00 63.50 61.42 3ijq n PRO 255 Cb 0.67 -1.24 0.05 0.00 -0.02 0.00 0.00 33.50 32.96 3ijq n PRO 255 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3ijq h LYS 256 N -0.48 0.00 0.00 -0.52 2.10 -1.94 -3.16 116.57 112.57 3ijq h LYS 256 Ca -0.43 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.22 3ijq h LYS 256 Cb 1.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.70 3ijq h LYS 256 CO 0.36 0.78 0.00 0.39 -2.00 0.00 0.00 179.45 178.98 3ijq n GLU 257 N -3.61 0.76 -2.49 0.07 4.71 -1.26 -3.12 120.64 115.69 3ijq n GLU 257 Ca -0.01 0.00 -0.15 0.00 -0.01 0.00 0.00 57.16 57.00 3ijq n GLU 257 Cb 0.75 -1.16 0.03 0.00 -1.01 0.00 0.00 31.44 30.05 3ijq n GLU 257 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 3ijq n GLN 258 N -0.66 2.51 -0.25 3.49 6.02 -1.19 -4.86 117.38 122.45 3ijq n GLN 258 Ca 0.06 -3.86 0.23 0.00 -0.01 0.00 0.00 57.00 53.42 3ijq n GLN 258 Cb 0.03 -1.86 0.58 0.00 1.02 0.00 0.00 30.24 30.00 3ijq n GLN 258 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3ijq h LEU 259 N 2.56 0.29 -0.23 1.08 5.85 -1.74 -1.16 115.31 121.97 3ijq h LEU 259 Ca 0.11 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.92 3ijq h LEU 259 Cb 1.26 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 3ijq h LEU 259 CO 0.56 0.10 -0.08 0.44 -0.34 0.00 0.00 178.44 179.11 3ijq h ASP 260 N 0.28 -0.28 -0.49 1.25 3.32 -1.91 0.61 116.42 119.20 3ijq h ASP 260 Ca 0.49 0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.56 3ijq h ASP 260 Cb 1.43 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 41.14 3ijq h ASP 260 CO -0.15 -0.11 0.09 0.44 -1.72 0.00 0.00 179.24 177.79 3ijq h ASP 261 N -0.04 0.78 0.28 6.45 5.19 -1.64 -1.45 116.42 125.99 3ijq h ASP 261 Ca 0.12 -0.26 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 3ijq h ASP 261 Cb 0.21 -0.21 -0.03 0.00 0.18 0.00 0.00 39.33 39.49 3ijq h ASP 261 CO -0.26 0.84 -0.34 0.40 -3.12 0.00 0.00 179.24 176.76 3ijq h ILE 262 N 0.69 0.29 -0.89 0.35 2.04 -0.90 0.11 117.51 119.19 3ijq h ILE 262 Ca 0.15 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.20 3ijq h ILE 262 Cb 0.38 0.29 -0.11 0.00 -0.74 0.00 0.00 36.82 36.65 3ijq h ILE 262 CO 0.01 0.00 0.45 0.00 0.00 0.00 0.00 178.15 178.61 3ijq h ALA 263 N -0.15 1.41 0.32 1.87 0.00 0.33 0.17 119.26 123.22 3ijq h ALA 263 Ca -0.01 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3ijq h ALA 263 Cb 0.63 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3ijq h ALA 263 CO -0.10 -0.19 -0.28 2.35 0.00 0.00 0.00 179.25 181.03 3ijq h TRP 264 N 0.55 -0.74 -0.12 0.00 7.01 -0.14 -1.89 115.95 120.62 3ijq h TRP 264 Ca 0.52 0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.55 3ijq h TRP 264 Cb 0.87 0.28 -0.03 0.00 -2.10 0.00 0.00 29.16 28.19 3ijq h TRP 264 CO -0.09 -0.41 -0.04 0.28 -2.79 0.00 0.00 178.44 175.39 3ijq h VAL 265 N -0.62 0.85 -0.76 2.65 2.07 0.97 -3.14 116.25 118.27 3ijq h VAL 265 Ca -0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.55 3ijq h VAL 265 Cb 0.55 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 3ijq h VAL 265 CO -0.03 0.00 0.46 0.74 0.02 0.00 0.00 177.57 178.76 3ijq h THR 266 N -0.02 1.04 0.00 2.57 2.02 -0.61 0.22 112.91 118.13 3ijq h THR 266 Ca 0.06 -0.30 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 3ijq h THR 266 Cb 0.11 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.62 3ijq h THR 266 CO -0.14 0.16 -0.01 1.56 0.37 0.00 0.00 175.52 177.46 3ijq h GLN 267 N 0.86 0.00 0.00 6.66 4.20 -1.29 -2.65 115.11 122.89 3ijq h GLN 267 Ca 0.33 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.04 3ijq h GLN 267 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 3ijq h GLN 267 CO -0.16 0.01 0.00 0.00 -0.67 0.00 0.00 178.83 178.01 3ijq n GLN 268 N -3.33 2.08 -2.55 1.46 10.64 -0.89 -5.06 117.38 119.74 3ijq n GLN 268 Ca -0.03 -1.21 -0.40 0.00 -1.83 0.00 0.00 57.00 53.54 3ijq n GLN 268 Cb 0.10 -0.89 -0.05 0.00 -0.86 0.00 0.00 30.24 28.54 3ijq n GLN 268 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 3ijq s SER 269 N -0.72 7.33 0.32 2.61 0.15 0.74 -4.94 113.70 119.19 3ijq s SER 269 Ca 0.00 2.17 0.25 0.00 0.70 0.00 0.00 55.95 59.07 3ijq s SER 269 Cb 0.00 -2.62 0.60 0.00 -1.71 0.00 0.00 66.02 62.29 3ijq s SER 269 CO 0.00 -0.09 1.70 1.55 1.20 0.00 0.00 173.24 177.60 3ijq h PRO 270 N 3.81 0.00 -6.76 5.44 0.13 -1.89 -3.45 132.00 129.27 3ijq h PRO 270 Ca -0.46 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 63.99 3ijq h PRO 270 Cb 1.21 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.14 3ijq h PRO 270 CO 0.67 0.00 -0.84 -0.51 -0.23 0.00 0.00 178.00 177.09 3ijq s LEU 271 N -5.31 2.43 0.22 1.56 1.43 -1.26 -5.11 118.68 112.64 3ijq s LEU 271 Ca 0.09 -0.77 -0.30 0.00 -1.03 0.00 0.00 54.13 52.12 3ijq s LEU 271 Cb 0.09 -1.25 -0.09 0.00 0.03 0.00 0.00 46.19 44.97 3ijq s LEU 271 CO 0.63 0.15 1.23 -2.16 0.23 0.00 0.00 176.35 176.43 3ijq s PRO 272 N -2.34 4.46 -0.18 1.29 0.04 -1.26 -4.85 135.00 132.16 3ijq s PRO 272 Ca 0.17 1.97 -0.04 0.00 0.04 0.00 0.00 61.00 63.14 3ijq s PRO 272 Cb -0.09 -3.20 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 3ijq s PRO 272 CO 0.08 -0.11 -0.02 0.08 0.04 0.00 0.00 177.00 177.07 3ijq s VAL 273 N -0.30 3.88 -0.03 -0.36 1.01 -1.26 -2.02 120.40 121.33 3ijq s VAL 273 Ca 0.52 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.16 3ijq s VAL 273 Cb -0.35 -2.73 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 3ijq s VAL 273 CO 0.40 0.46 -0.00 -0.36 0.00 0.00 0.00 175.10 175.59 3ijq s PHE 274 N 0.74 3.09 -0.07 5.22 0.08 0.10 -0.42 117.98 126.72 3ijq s PHE 274 Ca -0.01 0.11 -0.12 0.00 0.12 0.00 0.00 56.93 57.03 3ijq s PHE 274 Cb -0.14 -1.71 -0.05 0.00 -0.57 0.00 0.00 43.02 40.55 3ijq s PHE 274 CO 0.02 0.45 0.29 0.00 -0.10 0.00 0.00 175.22 175.88 3ijq s ALA 275 N -1.01 3.75 0.08 5.36 0.00 -0.17 0.29 121.76 130.06 3ijq s ALA 275 Ca 0.17 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.71 3ijq s ALA 275 Cb -0.11 -2.23 0.00 0.00 0.00 0.00 0.00 23.12 20.78 3ijq s ALA 275 CO 0.07 0.47 0.00 -3.47 0.00 0.00 0.00 175.76 172.83 3ijq n ASP 276 N 2.18 0.26 0.22 0.00 -0.08 -1.26 -0.57 116.55 117.30 3ijq n ASP 276 Ca -0.16 0.12 0.09 0.00 -1.51 0.00 0.00 54.79 53.34 3ijq n ASP 276 Cb 0.53 -0.02 0.46 0.00 2.34 0.00 0.00 41.12 44.43 3ijq n ASP 276 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3ijq h GLU 277 N 0.00 0.00 0.00 -0.67 3.07 -1.95 -2.99 114.58 112.04 3ijq h GLU 277 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3ijq h GLU 277 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3ijq h GLU 277 CO 0.00 0.25 0.00 0.43 -1.40 0.00 0.00 179.01 178.29 3ijq n SER 278 N -3.46 0.00 -3.84 1.42 7.64 -1.26 -4.79 113.62 109.33 3ijq n SER 278 Ca -0.00 0.19 -0.09 0.00 1.01 0.00 0.00 58.87 59.97 3ijq n SER 278 Cb 0.43 -0.34 -0.07 0.00 -1.01 0.00 0.00 64.21 63.22 3ijq n SER 278 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 3ijq s LEU 279 N -2.68 1.23 0.00 -3.43 2.34 -1.13 -5.00 118.68 110.00 3ijq s LEU 279 Ca 0.12 -0.63 0.00 0.00 0.06 0.00 0.00 54.13 53.69 3ijq s LEU 279 Cb 0.10 1.17 0.00 0.00 -0.56 0.00 0.00 46.19 46.90 3ijq s LEU 279 CO 0.24 -0.77 0.00 0.00 -1.06 0.00 0.00 176.35 174.76 3ijq n GLN 280 N -0.10 0.00 -4.55 1.48 1.13 -1.26 -4.86 117.38 109.22 3ijq n GLN 280 Ca -0.14 0.00 -0.27 0.00 -1.94 0.00 0.00 57.00 54.65 3ijq n GLN 280 Cb 0.63 -0.12 -0.08 0.00 0.11 0.00 0.00 30.24 30.78 3ijq n GLN 280 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3ijq s ARG 281 N -2.00 1.98 0.18 -1.09 0.52 -1.26 -3.23 118.95 114.05 3ijq s ARG 281 Ca 0.00 -2.22 -0.18 0.00 -0.52 0.00 0.00 55.73 52.81 3ijq s ARG 281 Cb 0.00 -0.69 0.13 0.00 0.52 0.00 0.00 34.95 34.90 3ijq s ARG 281 CO 0.00 -0.49 1.63 1.25 0.02 0.00 0.00 175.30 177.71 3ijq h LEU 282 N 1.71 -0.68 -1.06 2.53 5.85 -1.89 -1.49 115.31 120.28 3ijq h LEU 282 Ca -0.36 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.53 3ijq h LEU 282 Cb 1.28 0.38 0.00 0.00 0.37 0.00 0.00 40.66 42.69 3ijq h LEU 282 CO 0.58 -0.23 0.15 0.61 -0.34 0.00 0.00 178.44 179.21 3ijq n GLY 283 N -1.39 -0.71 0.12 3.75 0.00 -1.26 -1.45 105.19 104.25 3ijq n GLY 283 Ca 0.03 0.15 0.10 0.00 0.00 0.00 0.00 46.02 46.31 3ijq n GLY 283 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ijq n ASP 284 N -2.09 1.21 0.26 1.61 8.00 -0.56 -4.61 116.55 120.36 3ijq n ASP 284 Ca -0.01 -1.07 -0.15 0.00 0.71 0.00 0.00 54.79 54.26 3ijq n ASP 284 Cb 0.18 0.82 -0.08 0.00 -0.02 0.00 0.00 41.12 42.01 3ijq n ASP 284 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3ijq h VAL 285 N 0.58 0.50 -0.94 2.53 2.07 -1.29 -3.19 116.25 116.51 3ijq h VAL 285 Ca 0.00 -0.23 0.20 0.00 0.82 0.00 0.00 66.70 67.49 3ijq h VAL 285 Cb 0.56 0.60 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 3ijq h VAL 285 CO 0.00 0.04 0.61 0.00 0.02 0.00 0.00 177.57 178.24 3ijq h ALA 286 N -0.34 2.09 0.00 1.67 0.00 -1.82 -1.09 119.26 119.77 3ijq h ALA 286 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ijq h ALA 286 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3ijq h ALA 286 CO 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 179.25 178.96 3ijq n ALA 287 N -2.48 1.85 -0.09 0.00 0.00 -1.21 -2.27 120.51 116.32 3ijq n ALA 287 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3ijq n ALA 287 Cb 0.68 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.13 3ijq n ALA 287 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ijq n LEU 288 N -0.12 0.20 -4.64 0.00 4.77 -0.41 -4.98 117.00 111.82 3ijq n LEU 288 Ca 0.00 -0.44 -0.40 0.00 -0.03 0.00 0.00 56.01 55.14 3ijq n LEU 288 Cb 0.06 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.18 3ijq n LEU 288 CO 0.00 0.05 0.65 1.17 -1.33 0.00 0.00 177.39 177.93 3ijq n LYS 289 N -0.48 1.34 0.00 3.23 4.81 -0.96 -1.43 118.16 124.67 3ijq n LYS 289 Ca 0.00 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 3ijq n LYS 289 Cb 0.02 -2.18 0.00 0.00 0.02 0.00 0.00 35.03 32.89 3ijq n LYS 289 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ijq n GLY 290 N 1.12 1.97 0.13 3.14 0.00 -1.26 -4.60 105.19 105.68 3ijq n GLY 290 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 3ijq n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ijq h ALA 291 N 0.00 0.34 -2.21 4.61 0.00 -1.58 -3.44 119.26 116.99 3ijq h ALA 291 Ca 0.00 -1.24 -0.60 0.00 0.00 0.00 0.00 54.91 53.07 3ijq h ALA 291 Cb 0.00 0.47 -0.14 0.00 0.00 0.00 0.00 17.79 18.12 3ijq h ALA 291 CO 0.00 1.21 -0.76 -0.06 0.00 0.00 0.00 179.25 179.64 3ijq s PHE 292 N -2.59 2.26 0.04 0.00 0.08 -0.60 -3.67 117.98 113.50 3ijq s PHE 292 Ca -0.14 -0.35 0.04 0.00 0.12 0.00 0.00 56.93 56.60 3ijq s PHE 292 Cb 0.06 -0.98 -0.24 0.00 -0.57 0.00 0.00 43.02 41.29 3ijq s PHE 292 CO 0.83 0.70 0.98 1.15 -0.10 0.00 0.00 175.22 178.78 3ijq h THR 293 N 2.29 1.31 -2.52 0.64 2.02 -1.07 -3.45 112.91 112.12 3ijq h THR 293 Ca -0.40 -3.01 0.14 0.00 0.77 0.00 0.00 66.41 63.91 3ijq h THR 293 Cb 1.26 2.73 -0.05 0.00 -1.74 0.00 0.00 68.15 70.34 3ijq h THR 293 CO 0.60 0.81 0.49 -0.83 0.37 0.00 0.00 175.52 176.96 3ijq s GLY 294 N -4.88 -0.01 0.14 2.16 0.00 -0.97 -0.18 107.32 103.58 3ijq s GLY 294 Ca -0.04 -0.18 0.10 0.00 0.00 0.00 0.00 44.72 44.60 3ijq s GLY 294 CO 0.84 0.93 -0.22 -0.26 0.00 0.00 0.00 173.10 174.39 3ijq s ILE 295 N -2.74 2.57 -0.19 0.90 -4.36 0.45 -1.00 121.20 116.84 3ijq s ILE 295 Ca 0.16 -1.72 -0.07 0.00 -0.26 0.00 0.00 60.65 58.76 3ijq s ILE 295 Cb -0.02 -2.19 -0.04 0.00 1.25 0.00 0.00 42.46 41.46 3ijq s ILE 295 CO 0.05 0.03 0.06 0.21 0.24 0.00 0.00 174.94 175.52 3ijq s ASN 296 N -2.30 5.47 -0.11 4.36 2.47 0.26 -1.09 114.94 124.00 3ijq s ASN 296 Ca 0.18 0.01 -0.02 0.00 0.42 0.00 0.00 52.86 53.45 3ijq s ASN 296 Cb -0.10 -1.94 -0.03 0.00 -1.45 0.00 0.00 41.25 37.73 3ijq s ASN 296 CO 0.09 0.13 -0.03 -0.63 -3.72 0.00 0.00 177.10 172.95 3ijq s ILE 297 N 0.61 4.01 -0.08 -5.21 1.01 0.77 -4.78 121.20 117.52 3ijq s ILE 297 Ca 0.03 -0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.33 3ijq s ILE 297 Cb -0.13 -2.71 0.03 0.00 0.01 0.00 0.00 42.46 39.66 3ijq s ILE 297 CO 0.01 0.55 -0.03 -0.54 0.00 0.00 0.00 174.94 174.93 3ijq s LYS 298 N -0.29 0.95 0.28 2.79 1.02 -1.26 -0.49 119.74 122.73 3ijq s LYS 298 Ca 0.05 -0.04 0.02 0.00 0.02 0.00 0.00 55.97 56.02 3ijq s LYS 298 Cb -0.12 -1.16 0.65 0.00 -0.52 0.00 0.00 37.83 36.68 3ijq s LYS 298 CO 0.02 -0.26 1.72 -0.07 -0.92 0.00 0.00 175.35 175.85 3ijq h LEU 299 N 8.11 0.41 -2.53 3.17 3.38 -1.90 0.62 115.31 126.58 3ijq h LEU 299 Ca -0.25 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3ijq h LEU 299 Cb 1.13 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3ijq h LEU 299 CO 0.34 0.09 0.00 0.24 0.09 0.00 0.00 178.44 179.19 3ijq h MET 300 N 0.49 0.00 0.01 1.13 2.86 -1.93 -2.08 114.93 115.41 3ijq h MET 300 Ca 0.52 0.00 -0.36 0.00 -2.06 0.00 0.00 59.70 57.80 3ijq h MET 300 Cb 0.90 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.50 3ijq h MET 300 CO -0.46 0.00 -2.29 1.63 1.06 0.00 0.00 176.91 176.85 3ijq n LYS 301 N -3.04 0.68 -0.17 1.72 5.02 0.16 -2.22 118.16 120.31 3ijq n LYS 301 Ca -0.02 0.08 0.11 0.00 -2.02 0.00 0.00 58.31 56.46 3ijq n LYS 301 Cb 0.13 -1.57 0.26 0.00 -0.02 0.00 0.00 35.03 33.83 3ijq n LYS 301 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ijq n THR 303 N 1.13 0.00 0.00 0.00 -2.24 -1.00 -4.67 114.28 107.50 3ijq n THR 303 Ca 0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 3ijq n THR 303 Cb 0.52 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.25 3ijq n THR 303 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ijq n GLY 304 N -2.87 -0.00 0.16 3.38 0.00 -0.82 -3.46 105.19 101.57 3ijq n GLY 304 Ca -0.01 -2.29 -0.06 0.00 0.00 0.00 0.00 46.02 43.66 3ijq n GLY 304 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3ijq h MET 305 N 7.54 0.20 -0.28 1.61 2.86 -1.88 -1.15 114.93 123.83 3ijq h MET 305 Ca 0.00 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.66 3ijq h MET 305 Cb 0.00 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 3ijq h MET 305 CO 0.00 0.13 0.08 -0.09 1.06 0.00 0.00 176.91 178.09 3ijq h ARG 306 N 0.20 0.18 -0.34 1.72 2.43 -1.92 0.12 114.38 116.78 3ijq h ARG 306 Ca 0.17 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.18 3ijq h ARG 306 Cb 0.19 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 3ijq h ARG 306 CO -0.22 0.12 -0.37 1.49 -1.51 0.00 0.00 179.97 179.49 3ijq h GLU 307 N 0.19 0.79 -0.66 0.20 4.81 -1.82 -2.66 114.58 115.44 3ijq h GLU 307 Ca 0.13 -0.40 0.05 0.00 -0.13 0.00 0.00 59.36 59.01 3ijq h GLU 307 Cb 0.11 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 3ijq h GLU 307 CO -0.15 1.03 0.37 0.00 -0.73 0.00 0.00 179.01 179.54 3ijq h ALA 308 N 0.93 0.87 -0.51 2.92 0.00 -0.56 0.26 119.26 123.16 3ijq h ALA 308 Ca 0.06 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3ijq h ALA 308 Cb 0.92 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 3ijq h ALA 308 CO 0.08 0.07 0.08 2.35 0.00 0.00 0.00 179.25 181.84 3ijq h TRP 309 N 0.71 0.84 -0.44 0.00 -0.00 -0.69 -0.55 115.95 115.82 3ijq h TRP 309 Ca 0.29 -0.09 -0.14 0.00 -0.00 0.00 0.00 58.89 58.95 3ijq h TRP 309 Cb 0.14 -0.24 -0.01 0.00 -0.00 0.00 0.00 29.16 29.05 3ijq h TRP 309 CO -0.07 0.73 -0.27 0.87 -0.00 0.00 0.00 178.44 179.71 3ijq h LYS 310 N 0.77 0.94 -0.65 2.65 1.57 -0.89 -2.28 116.57 118.69 3ijq h LYS 310 Ca 0.16 -0.42 -0.03 0.00 -1.87 0.00 0.00 60.65 58.50 3ijq h LYS 310 Cb 0.35 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 3ijq h LYS 310 CO 0.01 1.08 0.30 0.52 -0.57 0.00 0.00 179.45 180.79 3ijq h MET 311 N 0.80 0.92 -0.35 3.15 2.86 0.24 0.29 114.93 122.84 3ijq h MET 311 Ca 0.09 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 3ijq h MET 311 Cb 0.84 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 3ijq h MET 311 CO 0.07 0.72 0.02 0.28 1.06 0.00 0.00 176.91 179.06 3ijq h VAL 312 N 0.92 1.25 -0.29 -2.22 2.07 -0.89 -1.32 116.25 115.78 3ijq h VAL 312 Ca 0.22 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 3ijq h VAL 312 Cb 0.11 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3ijq h VAL 312 CO -0.03 0.31 0.16 0.74 0.02 0.00 0.00 177.57 178.77 3ijq h THR 313 N 0.43 1.12 0.22 2.57 2.02 -0.93 -2.33 112.91 116.00 3ijq h THR 313 Ca 0.10 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 3ijq h THR 313 Cb 0.42 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3ijq h THR 313 CO 0.01 0.12 -0.10 0.25 0.37 0.00 0.00 175.52 176.17 3ijq h LEU 314 N 0.35 -0.24 -0.34 2.58 5.85 -0.84 0.08 115.31 122.75 3ijq h LEU 314 Ca 0.10 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.89 3ijq h LEU 314 Cb 0.05 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.09 3ijq h LEU 314 CO -0.02 -0.17 -0.03 0.00 -0.34 0.00 0.00 178.44 177.88 3ijq h ALA 315 N 0.50 0.29 -0.73 1.25 0.00 -1.19 0.57 119.26 119.94 3ijq h ALA 315 Ca -0.03 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3ijq h ALA 315 Cb 0.22 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3ijq h ALA 315 CO 0.05 -0.42 0.23 0.45 0.00 0.00 0.00 179.25 179.56 3ijq h HIS 316 N 0.06 1.17 -0.36 0.00 3.86 -1.32 0.40 115.15 118.97 3ijq h HIS 316 Ca 0.17 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 3ijq h HIS 316 Cb 0.24 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.35 3ijq h HIS 316 CO -0.27 0.93 0.14 0.00 0.86 0.00 0.00 177.93 179.59 3ijq h ALA 317 N 1.12 1.58 -0.33 2.45 0.00 -0.18 -1.12 119.26 122.77 3ijq h ALA 317 Ca 0.24 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ijq h ALA 317 Cb 0.30 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3ijq h ALA 317 CO -0.01 0.33 0.00 1.28 0.00 0.00 0.00 179.25 180.85 3ijq n LEU 318 N -4.39 1.79 0.00 0.00 4.77 0.12 -4.91 117.00 114.37 3ijq n LEU 318 Ca 0.02 -0.89 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 3ijq n LEU 318 Cb 0.14 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3ijq n LEU 318 CO 0.37 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 3ijq n GLY 319 N 1.04 0.49 3.95 -0.72 0.00 -0.43 -4.93 105.19 104.59 3ijq n GLY 319 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 3ijq n GLY 319 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ijq s MET 320 N -0.13 3.31 0.48 1.61 -1.94 0.13 -4.97 119.30 117.79 3ijq s MET 320 Ca 0.00 -0.47 0.04 0.00 -1.71 0.00 0.00 55.69 53.54 3ijq s MET 320 Cb 0.00 -2.65 0.02 0.00 2.01 0.00 0.00 34.83 34.21 3ijq s MET 320 CO 0.00 0.01 0.68 1.03 -0.01 0.00 0.00 175.02 176.73 3ijq s ARG 321 N -4.37 2.72 0.04 2.03 1.81 0.75 -3.61 118.95 118.32 3ijq s ARG 321 Ca 0.43 -0.93 0.03 0.00 -1.72 0.00 0.00 55.73 53.53 3ijq s ARG 321 Cb -0.10 -2.61 -0.02 0.00 -0.45 0.00 0.00 34.95 31.77 3ijq s ARG 321 CO 0.36 -0.48 -0.09 0.08 -0.68 0.00 0.00 175.30 174.49 3ijq s VAL 322 N -2.57 0.66 0.04 3.52 1.01 -1.26 -0.41 120.40 121.40 3ijq s VAL 322 Ca 0.55 -1.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 3ijq s VAL 322 Cb -0.10 -0.69 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 3ijq s VAL 322 CO 0.36 -0.27 0.10 0.00 0.00 0.00 0.00 175.10 175.28 3ijq s MET 323 N -1.42 0.60 -0.00 2.72 0.23 -0.25 0.23 119.30 121.41 3ijq s MET 323 Ca -0.07 -0.78 0.07 0.00 -1.03 0.00 0.00 55.69 53.88 3ijq s MET 323 Cb -0.09 0.23 -0.02 0.00 -1.53 0.00 0.00 34.83 33.43 3ijq s MET 323 CO 0.01 -0.15 -0.21 0.54 -2.03 0.00 0.00 175.02 173.18 3ijq s VAL 324 N -2.71 1.67 0.00 5.16 0.11 -0.85 -0.16 120.40 123.63 3ijq s VAL 324 Ca -0.04 -0.98 0.00 0.00 -2.93 0.00 0.00 61.98 58.03 3ijq s VAL 324 Cb -0.01 -1.41 0.00 0.00 -1.53 0.00 0.00 36.38 33.44 3ijq s VAL 324 CO -0.05 0.41 0.00 0.61 -3.33 0.00 0.00 175.10 172.74 3ijq n GLY 325 N 2.38 5.11 3.80 6.54 0.00 0.35 -0.68 105.19 122.70 3ijq n GLY 325 Ca -0.16 -1.87 -0.04 0.00 0.00 0.00 0.00 46.02 43.96 3ijq n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ijq s MET 327 N -2.93 2.31 -0.01 0.00 -1.94 -1.26 -4.95 119.30 110.53 3ijq s MET 327 Ca 0.15 -1.87 -0.30 0.00 -1.71 0.00 0.00 55.69 51.96 3ijq s MET 327 Cb -0.02 -2.22 -0.06 0.00 2.01 0.00 0.00 34.83 34.53 3ijq s MET 327 CO 0.04 -0.55 1.65 0.95 -0.01 0.00 0.00 175.02 177.10 3ijq s THR 328 N -2.69 3.41 0.21 2.05 -4.23 -1.26 -4.48 115.64 108.65 3ijq s THR 328 Ca 0.41 0.64 -0.09 0.00 -1.18 0.00 0.00 61.69 61.47 3ijq s THR 328 Cb -0.03 -3.41 -0.01 0.00 1.34 0.00 0.00 72.50 70.39 3ijq s THR 328 CO 0.25 -0.04 0.33 -1.61 -0.54 0.00 0.00 174.62 173.02 3ijq s GLU 329 N 3.53 1.33 1.03 3.99 2.02 -1.26 -4.87 118.70 124.48 3ijq s GLU 329 Ca 0.74 -1.30 -0.17 0.00 0.02 0.00 0.00 54.97 54.25 3ijq s GLU 329 Cb -0.35 0.39 0.23 0.00 0.10 0.00 0.00 34.13 34.50 3ijq s GLU 329 CO 0.31 -0.51 1.30 0.95 0.02 0.00 0.00 175.26 177.33 3ijq s THR 330 N -4.03 1.91 -1.50 3.63 -4.23 -1.26 -2.15 115.64 108.01 3ijq s THR 330 Ca 0.24 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 60.91 3ijq s THR 330 Cb 0.02 -2.90 0.30 0.00 1.34 0.00 0.00 72.50 71.27 3ijq s THR 330 CO 0.06 0.00 1.46 -1.20 -0.54 0.00 0.00 174.62 174.40 3ijq n SER 331 N -4.03 0.00 0.14 3.99 7.64 -1.26 -2.95 113.62 117.15 3ijq n SER 331 Ca 0.16 -0.01 -0.06 0.00 1.01 0.00 0.00 58.87 59.97 3ijq n SER 331 Cb 0.59 -0.25 -0.03 0.00 -1.01 0.00 0.00 64.21 63.51 3ijq n SER 331 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ijq h ALA 333 N -1.68 1.43 -0.42 0.00 0.00 -1.91 -1.80 119.26 114.88 3ijq h ALA 333 Ca -0.04 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 3ijq h ALA 333 Cb 0.29 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3ijq h ALA 333 CO 0.06 0.40 -0.08 0.82 0.00 0.00 0.00 179.25 180.45 3ijq h ILE 334 N 0.39 1.27 -0.13 0.00 1.08 -1.61 -2.45 117.51 116.07 3ijq h ILE 334 Ca 0.08 -1.16 -0.16 0.00 -0.39 0.00 0.00 64.86 63.23 3ijq h ILE 334 Cb 0.34 1.17 -0.01 0.00 -3.07 0.00 0.00 36.82 35.25 3ijq h ILE 334 CO 0.01 0.39 -0.60 0.28 -0.69 0.00 0.00 178.15 177.55 3ijq h SER 335 N 0.61 0.47 -0.06 1.72 0.02 -1.18 -1.48 113.55 113.65 3ijq h SER 335 Ca 0.11 -0.27 0.01 0.00 -0.84 0.00 0.00 61.79 60.80 3ijq h SER 335 Cb 0.60 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 3ijq h SER 335 CO 0.04 0.96 0.01 0.00 -1.14 0.00 0.00 176.83 176.69 3ijq h ALA 336 N 1.05 0.05 -0.28 3.77 0.00 -1.24 -2.55 119.26 120.06 3ijq h ALA 336 Ca -0.00 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3ijq h ALA 336 Cb 1.13 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3ijq h ALA 336 CO 0.10 -0.47 -0.25 0.00 0.00 0.00 0.00 179.25 178.64 3ijq h ALA 337 N 1.04 1.04 0.00 0.00 0.00 -1.40 -2.65 119.26 117.30 3ijq h ALA 337 Ca 0.03 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 3ijq h ALA 337 Cb 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3ijq h ALA 337 CO -0.04 0.58 -0.02 0.77 0.00 0.00 0.00 179.25 180.55 3ijq h SER 338 N 0.49 0.00 -0.05 0.00 0.02 -0.91 -2.60 113.55 110.51 3ijq h SER 338 Ca 0.07 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.03 3ijq h SER 338 Cb 0.69 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.23 3ijq h SER 338 CO 0.05 0.02 0.06 1.56 -1.14 0.00 0.00 176.83 177.38 3ijq h GLN 339 N 0.00 0.00 -0.16 3.45 1.08 -1.08 -1.45 115.11 116.95 3ijq h GLN 339 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3ijq h GLN 339 Cb 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 3ijq h GLN 339 CO 0.00 0.00 0.00 1.97 -0.95 0.00 0.00 178.83 179.85 3ijq n PHE 340 N -3.71 0.23 0.29 2.96 1.16 -0.98 -3.49 117.46 113.92 3ijq n PHE 340 Ca -0.02 -0.53 0.15 0.00 -1.87 0.00 0.00 57.45 55.19 3ijq n PHE 340 Cb 0.15 -0.05 0.90 0.00 -1.61 0.00 0.00 39.48 38.86 3ijq n PHE 340 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 3ijq h SER 341 N 0.92 0.00 0.27 5.98 4.64 -1.30 -1.72 113.55 122.34 3ijq h SER 341 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ijq h SER 341 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3ijq h SER 341 CO 0.01 0.03 0.00 -2.65 -0.87 0.00 0.00 176.83 173.35 3ijq n PRO 342 N -3.68 0.12 -0.10 4.77 -0.02 -1.26 -1.79 135.00 133.04 3ijq n PRO 342 Ca -0.03 0.52 0.10 0.00 -2.02 0.00 0.00 63.50 62.08 3ijq n PRO 342 Cb 0.13 -1.83 0.15 0.00 -0.02 0.00 0.00 33.50 31.93 3ijq n PRO 342 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ijq n ALA 343 N -1.71 2.42 -2.63 3.55 0.00 -0.65 -4.78 120.51 116.71 3ijq n ALA 343 Ca 0.00 -0.85 -0.21 0.00 0.00 0.00 0.00 53.44 52.38 3ijq n ALA 343 Cb 0.10 -0.73 -0.04 0.00 0.00 0.00 0.00 19.45 18.78 3ijq n ALA 343 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3ijq s VAL 344 N -1.49 3.90 -0.15 0.00 -7.23 -0.74 -4.86 120.40 109.83 3ijq s VAL 344 Ca 0.30 -1.38 -0.05 0.00 -1.81 0.00 0.00 61.98 59.04 3ijq s VAL 344 Cb 0.19 -3.27 -0.24 0.00 0.56 0.00 0.00 36.38 33.61 3ijq s VAL 344 CO 0.27 -0.24 0.26 0.47 -0.31 0.00 0.00 175.10 175.54 3ijq n ASP 345 N -1.30 2.08 -4.22 4.85 9.92 0.13 -4.85 116.55 123.16 3ijq n ASP 345 Ca -0.04 0.14 -0.18 0.00 -0.53 0.00 0.00 54.79 54.18 3ijq n ASP 345 Cb 0.59 -0.76 -0.11 0.00 -0.64 0.00 0.00 41.12 40.19 3ijq n ASP 345 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 3ijq s PHE 346 N -2.55 1.36 -0.06 1.24 0.08 -1.20 -4.95 117.98 111.90 3ijq s PHE 346 Ca -0.24 -0.52 -0.04 0.00 0.12 0.00 0.00 56.93 56.25 3ijq s PHE 346 Cb 0.07 -0.73 0.03 0.00 -0.57 0.00 0.00 43.02 41.82 3ijq s PHE 346 CO 0.74 0.12 0.15 0.00 -0.10 0.00 0.00 175.22 176.13 3ijq s ALA 347 N -1.79 -0.32 -0.64 5.36 0.00 -1.26 -2.00 121.76 121.10 3ijq s ALA 347 Ca 0.05 0.61 0.05 0.00 0.00 0.00 0.00 51.96 52.68 3ijq s ALA 347 Cb -0.07 -0.40 0.19 0.00 0.00 0.00 0.00 23.12 22.85 3ijq s ALA 347 CO 0.03 -0.13 0.54 -3.47 0.00 0.00 0.00 175.76 172.73 3ijq n ASP 348 N 3.81 2.69 -3.27 0.00 2.03 0.15 -1.70 116.55 120.26 3ijq n ASP 348 Ca -0.22 -3.15 -0.29 0.00 0.52 0.00 0.00 54.79 51.65 3ijq n ASP 348 Cb 0.54 -0.71 -0.05 0.00 -0.72 0.00 0.00 41.12 40.18 3ijq n ASP 348 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3ijq n LEU 349 N 1.75 4.48 0.00 -2.67 4.77 -1.26 -3.22 117.00 120.85 3ijq n LEU 349 Ca 0.24 -5.53 0.00 0.00 -0.03 0.00 0.00 56.01 50.68 3ijq n LEU 349 Cb 0.39 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 3ijq n LEU 349 CO 0.28 2.16 0.45 -0.90 -1.33 0.00 0.00 177.39 178.05 3ijq n ASP 350 N 0.35 1.77 -0.26 -1.43 5.75 -1.26 -4.85 116.55 116.62 3ijq n ASP 350 Ca 0.31 -1.81 -0.07 0.00 -0.01 0.00 0.00 54.79 53.21 3ijq n ASP 350 Cb 0.39 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.45 3ijq n ASP 350 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3ijq h GLY 351 N 0.00 -0.39 1.79 6.12 0.00 -1.85 -0.01 103.07 108.73 3ijq h GLY 351 Ca 0.00 0.57 0.03 0.00 0.00 0.00 0.00 47.33 47.93 3ijq h GLY 351 CO 0.00 -0.15 0.08 3.45 0.00 0.00 0.00 176.54 179.92 3ijq h ASN 352 N -0.16 0.00 0.68 0.19 -1.07 -1.68 -0.39 115.58 113.15 3ijq h ASN 352 Ca 0.21 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.55 3ijq h ASN 352 Cb 0.55 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.80 3ijq h ASN 352 CO -0.77 0.00 -0.16 -0.07 0.07 0.00 0.00 177.43 176.50 3ijq h LEU 353 N 0.00 0.00 0.00 6.14 3.38 -1.28 -2.82 115.31 120.72 3ijq h LEU 353 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3ijq h LEU 353 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3ijq h LEU 353 CO -0.00 0.16 -0.18 0.18 0.09 0.00 0.00 178.44 178.69 3ijq n LEU 354 N -3.45 0.47 -4.87 1.67 4.77 -0.16 -4.88 117.00 110.56 3ijq n LEU 354 Ca -0.01 0.41 -0.22 0.00 -0.03 0.00 0.00 56.01 56.17 3ijq n LEU 354 Cb 0.33 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 3ijq n LEU 354 CO 0.31 -0.06 -0.12 0.27 -1.33 0.00 0.00 177.39 176.46 3ijq s ILE 355 N -3.06 4.56 -1.60 -0.08 -4.36 -1.07 -0.48 121.20 115.10 3ijq s ILE 355 Ca 0.11 -1.29 0.13 0.00 -0.26 0.00 0.00 60.65 59.34 3ijq s ILE 355 Cb 0.15 -3.50 0.12 0.00 1.25 0.00 0.00 42.46 40.49 3ijq s ILE 355 CO 0.61 -0.32 0.94 -1.54 0.24 0.00 0.00 174.94 174.87 3ijq n SER 356 N -1.27 2.17 -2.51 4.36 3.41 0.10 -4.65 113.62 115.24 3ijq n SER 356 Ca -0.07 -1.58 -0.15 0.00 -0.26 0.00 0.00 58.87 56.81 3ijq n SER 356 Cb 0.58 -0.02 0.03 0.00 -0.26 0.00 0.00 64.21 64.53 3ijq n SER 356 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3ijq n ASN 357 N 0.74 3.10 -4.77 4.04 6.94 -1.26 -5.02 115.26 119.03 3ijq n ASN 357 Ca 0.08 -3.02 -0.41 0.00 -0.02 0.00 0.00 54.58 51.21 3ijq n ASN 357 Cb 0.34 -0.45 -0.00 0.00 -2.36 0.00 0.00 39.78 37.30 3ijq n ASN 357 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3ijq s ASP 358 N -3.52 6.36 -0.00 0.53 -1.08 -1.26 -4.92 116.67 112.78 3ijq s ASP 358 Ca 0.38 3.02 0.20 0.00 -0.52 0.00 0.00 52.55 55.63 3ijq s ASP 358 Cb 0.40 -2.66 -0.22 0.00 -1.46 0.00 0.00 42.92 38.98 3ijq s ASP 358 CO -0.04 -0.87 0.83 0.54 0.52 0.00 0.00 175.17 176.15 3ijq n ARG 359 N 0.79 0.49 -4.34 4.34 1.74 -1.26 -5.00 116.66 113.41 3ijq n ARG 359 Ca 0.02 -0.01 -0.21 0.00 -0.77 0.00 0.00 57.85 56.89 3ijq n ARG 359 Cb 0.39 -1.43 -0.11 0.00 -1.02 0.00 0.00 32.46 30.29 3ijq n ARG 359 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3ijq s PHE 360 N -2.88 1.83 -0.25 -1.55 0.08 -1.26 -4.54 117.98 109.40 3ijq s PHE 360 Ca 0.07 -0.48 -0.05 0.00 0.12 0.00 0.00 56.93 56.59 3ijq s PHE 360 Cb 0.15 -0.89 0.00 0.00 -0.57 0.00 0.00 43.02 41.71 3ijq s PHE 360 CO 0.81 0.36 0.00 0.21 -0.10 0.00 0.00 175.22 176.50 3ijq s LYS 361 N -3.02 3.19 0.00 0.44 2.20 0.39 -4.60 119.74 118.34 3ijq s LYS 361 Ca 0.18 -0.76 0.00 0.00 -0.36 0.00 0.00 55.97 55.03 3ijq s LYS 361 Cb -0.05 -3.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.13 3ijq s LYS 361 CO 0.07 -0.32 0.00 0.41 -0.36 0.00 0.00 175.35 175.15 3ijq n GLY 362 N 4.80 4.94 3.68 5.54 0.00 -1.26 -0.95 105.19 121.94 3ijq n GLY 362 Ca -0.16 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 3ijq n GLY 362 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3ijq n VAL 363 N 0.00 4.38 -4.42 1.61 0.24 -1.26 -4.85 118.33 114.03 3ijq n VAL 363 Ca 0.00 -0.50 -0.22 0.00 -2.04 0.00 0.00 64.34 61.58 3ijq n VAL 363 Cb 0.00 -1.35 -0.10 0.00 -1.47 0.00 0.00 33.84 30.92 3ijq n VAL 363 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3ijq s GLU 364 N -3.09 1.54 -0.28 7.34 0.41 -0.93 -4.91 118.70 118.78 3ijq s GLU 364 Ca 0.79 -1.73 -0.11 0.00 -0.41 0.00 0.00 54.97 53.52 3ijq s GLU 364 Cb -0.40 -1.37 -0.05 0.00 -1.78 0.00 0.00 34.13 30.53 3ijq s GLU 364 CO 0.43 0.18 0.19 0.08 -0.49 0.00 0.00 175.26 175.65 3ijq s VAL 365 N -2.82 5.29 -0.07 2.63 1.01 -1.26 0.08 120.40 125.27 3ijq s VAL 365 Ca 0.27 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 3ijq s VAL 365 Cb -0.00 -3.52 0.03 0.00 0.00 0.00 0.00 36.38 32.89 3ijq s VAL 365 CO 0.11 0.26 -0.01 -0.69 0.00 0.00 0.00 175.10 174.78 3ijq s VAL 366 N 1.72 0.43 -1.66 2.92 1.01 0.13 -4.71 120.40 120.25 3ijq s VAL 366 Ca 0.07 0.08 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 3ijq s VAL 366 Cb -0.16 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.65 3ijq s VAL 366 CO 0.11 0.27 0.37 0.59 0.00 0.00 0.00 175.10 176.43 3ijq n ASN 367 N 5.08 -6.07 0.00 3.32 3.02 -1.26 -0.41 115.26 118.93 3ijq n ASN 367 Ca -0.08 -0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.29 3ijq n ASN 367 Cb 0.50 -4.96 0.00 0.00 -0.61 0.00 0.00 39.78 34.71 3ijq n ASN 367 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ijq n GLY 368 N -1.33 2.12 3.86 7.41 0.00 -1.18 -4.80 105.19 111.28 3ijq n GLY 368 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 3ijq n GLY 368 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ijq s LYS 369 N -0.03 3.83 0.08 1.61 1.02 0.45 -2.17 119.74 124.53 3ijq s LYS 369 Ca 0.00 0.28 -0.31 0.00 0.02 0.00 0.00 55.97 55.96 3ijq s LYS 369 Cb 0.00 -3.01 -0.07 0.00 -0.52 0.00 0.00 37.83 34.23 3ijq s LYS 369 CO 0.00 0.56 1.33 0.42 -0.92 0.00 0.00 175.35 176.74 3ijq s ILE 370 N -1.37 3.59 -0.22 2.17 -1.09 -0.31 -0.69 121.20 123.28 3ijq s ILE 370 Ca 0.33 1.13 0.02 0.00 -2.23 0.00 0.00 60.65 59.89 3ijq s ILE 370 Cb -0.15 -3.72 0.05 0.00 -1.58 0.00 0.00 42.46 37.06 3ijq s ILE 370 CO 0.18 0.07 -0.12 -0.89 -1.23 0.00 0.00 174.94 172.95 3ijq s THR 371 N 1.28 1.91 0.18 2.92 2.01 0.11 -4.67 115.64 119.38 3ijq s THR 371 Ca 0.63 -1.24 -0.27 0.00 0.31 0.00 0.00 61.69 61.12 3ijq s THR 371 Cb -0.34 -1.96 -0.08 0.00 0.01 0.00 0.00 72.50 70.14 3ijq s THR 371 CO 0.29 0.16 0.84 -0.76 -0.69 0.00 0.00 174.62 174.46 3ijq s LEU 372 N 1.27 4.60 0.00 4.42 1.43 -1.26 -2.18 118.68 126.95 3ijq s LEU 372 Ca -0.03 1.74 0.05 0.00 -1.03 0.00 0.00 54.13 54.86 3ijq s LEU 372 Cb -0.17 -3.40 0.09 0.00 0.03 0.00 0.00 46.19 42.73 3ijq s LEU 372 CO -0.08 0.17 0.69 -0.46 0.23 0.00 0.00 176.35 176.90 3ijq n ASN 373 N 1.71 1.50 -1.30 2.29 0.23 -1.26 -5.03 115.26 113.41 3ijq n ASN 373 Ca -0.04 -2.13 0.10 0.00 -0.53 0.00 0.00 54.58 51.98 3ijq n ASN 373 Cb 0.48 -0.40 0.30 0.00 -2.08 0.00 0.00 39.78 38.09 3ijq n ASN 373 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3ijq n ASP 374 N -2.61 3.77 -4.77 0.53 8.00 -1.26 -4.96 116.55 115.25 3ijq n ASP 374 Ca 0.13 -2.09 -0.40 0.00 0.71 0.00 0.00 54.79 53.14 3ijq n ASP 374 Cb 0.48 -0.47 -0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3ijq n ASP 374 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ijq s LEU 375 N -1.16 4.29 1.08 0.64 1.43 -1.26 -4.65 118.68 119.05 3ijq s LEU 375 Ca 0.45 2.84 -0.12 0.00 -1.03 0.00 0.00 54.13 56.27 3ijq s LEU 375 Cb 0.25 -3.76 0.23 0.00 0.03 0.00 0.00 46.19 42.94 3ijq s LEU 375 CO 0.29 -0.82 1.06 -2.84 0.23 0.00 0.00 176.35 174.27 3ijq s PRO 376 N -2.10 -0.22 6.85 1.29 0.02 -1.26 -3.76 135.00 135.82 3ijq s PRO 376 Ca 0.54 0.76 0.00 0.00 0.02 0.00 0.00 61.00 62.32 3ijq s PRO 376 Cb -0.42 -1.64 0.00 0.00 0.02 0.00 0.00 34.50 32.46 3ijq s PRO 376 CO 0.56 -3.23 0.00 0.41 -0.33 0.00 0.00 177.00 174.41 3ijq n GLY 377 N -0.03 2.10 0.22 0.52 0.00 -0.50 -2.54 105.19 104.96 3ijq n GLY 377 Ca 0.04 -0.40 0.15 0.00 0.00 0.00 0.00 46.02 45.81 3ijq n GLY 377 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ijq n ILE 378 N 0.00 0.01 -2.29 -0.61 -5.35 -1.26 -1.93 119.36 107.93 3ijq n ILE 378 Ca 0.00 -0.12 -0.00 0.00 -0.27 0.00 0.00 62.75 62.36 3ijq n ILE 378 Cb 0.00 -0.05 0.00 0.00 -1.74 0.00 0.00 39.64 37.85 3ijq n ILE 378 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ijq n GLY 379 N 1.07 0.68 3.32 3.28 0.00 -1.05 -3.87 105.19 108.61 3ijq n GLY 379 Ca 0.21 -0.76 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 3ijq n GLY 379 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ijq s VAL 380 N -2.56 1.60 -0.06 1.61 -7.23 -1.26 -4.20 120.40 108.29 3ijq s VAL 380 Ca 0.00 -2.13 0.03 0.00 -1.81 0.00 0.00 61.98 58.08 3ijq s VAL 380 Cb -0.00 -1.96 0.00 0.00 0.56 0.00 0.00 36.38 34.99 3ijq s VAL 380 CO 0.01 -0.60 -0.16 -0.32 -0.31 0.00 0.00 175.10 173.72 3ijq s MET 381 N -3.54 1.91 0.00 4.82 1.75 -0.12 -4.95 119.30 119.17 3ijq s MET 381 Ca 0.20 -0.56 0.32 0.00 -1.25 0.00 0.00 55.69 54.40 3ijq s MET 381 Cb -0.01 -1.58 1.90 0.00 2.84 0.00 0.00 34.83 37.98 3ijq s MET 381 CO 0.05 0.14 2.22 1.17 -0.65 0.00 0.00 175.02 177.95