#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ciq s ILE 3 N 0.00 0.85 -0.10 4.25 2.07 -1.26 -1.05 121.20 125.96 2ciq s ILE 3 Ca 0.00 -0.44 -0.02 0.00 -1.41 0.00 0.00 60.65 58.78 2ciq s ILE 3 Cb 0.00 -0.72 0.03 0.00 0.13 0.00 0.00 42.46 41.90 2ciq s ILE 3 CO 0.00 0.25 0.01 -0.75 -1.91 0.00 0.00 174.94 172.54 2ciq s LYS 4 N -0.14 0.59 -0.14 3.50 2.20 -0.37 -5.00 119.74 120.38 2ciq s LYS 4 Ca 0.02 0.02 -0.04 0.00 -0.36 0.00 0.00 55.97 55.60 2ciq s LYS 4 Cb -0.05 -1.19 -0.03 0.00 -1.51 0.00 0.00 37.83 35.04 2ciq s LYS 4 CO -0.00 -0.37 0.01 -2.00 -0.36 0.00 0.00 175.35 172.63 2ciq s GLU 5 N 1.96 3.54 0.51 4.03 2.12 -1.26 -0.92 118.70 128.68 2ciq s GLU 5 Ca 0.04 -0.41 0.01 0.00 0.36 0.00 0.00 54.97 54.97 2ciq s GLU 5 Cb -0.13 -2.98 -0.01 0.00 0.26 0.00 0.00 34.13 31.27 2ciq s GLU 5 CO -0.06 0.42 0.03 0.99 -0.54 0.00 0.00 175.26 176.10 2ciq s THR 6 N -0.10 1.18 0.36 -1.70 2.01 0.11 -5.02 115.64 112.48 2ciq s THR 6 Ca 0.05 -1.97 0.03 0.00 0.31 0.00 0.00 61.69 60.11 2ciq s THR 6 Cb -0.13 -2.14 0.25 0.00 0.01 0.00 0.00 72.50 70.49 2ciq s THR 6 CO 0.02 0.00 2.00 -0.78 -0.69 0.00 0.00 174.62 175.17 2ciq h ASP 7 N 1.30 0.66 0.00 3.53 -0.00 -2.03 -3.25 116.42 116.62 2ciq h ASP 7 Ca -0.44 -0.03 0.00 0.00 -0.00 0.00 0.00 57.03 56.56 2ciq h ASP 7 Cb 1.32 -0.16 0.00 0.00 -0.00 0.00 0.00 39.33 40.48 2ciq h ASP 7 CO 0.73 0.51 -1.83 0.29 -0.00 0.00 0.00 179.24 178.93 2ciq n LYS 8 N -4.42 0.58 -3.91 0.28 4.76 -1.26 -4.93 118.16 109.25 2ciq n LYS 8 Ca 0.05 -0.17 -0.08 0.00 -2.87 0.00 0.00 58.31 55.24 2ciq n LYS 8 Cb 0.07 -1.45 -0.04 0.00 -1.84 0.00 0.00 35.03 31.78 2ciq n LYS 8 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2ciq s GLU 9 N -3.29 1.62 -0.02 1.97 -1.05 -1.23 -1.39 118.70 115.32 2ciq s GLU 9 Ca -0.07 -1.10 0.05 0.00 -0.15 0.00 0.00 54.97 53.71 2ciq s GLU 9 Cb 0.12 0.53 -0.01 0.00 -0.44 0.00 0.00 34.13 34.33 2ciq s GLU 9 CO 0.78 -0.71 -0.17 0.08 0.95 0.00 0.00 175.26 176.20 2ciq s VAL 10 N -3.96 1.35 -0.08 1.83 1.01 -0.14 -0.71 120.40 119.69 2ciq s VAL 10 Ca 0.16 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.43 2ciq s VAL 10 Cb -0.03 -1.12 0.02 0.00 0.00 0.00 0.00 36.38 35.25 2ciq s VAL 10 CO 0.07 0.38 -0.09 -0.69 0.00 0.00 0.00 175.10 174.77 2ciq s VAL 11 N -0.37 1.01 -0.10 2.92 1.01 -0.10 -0.62 120.40 124.16 2ciq s VAL 11 Ca 0.06 -0.35 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 2ciq s VAL 11 Cb -0.07 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.29 2ciq s VAL 11 CO -0.00 0.35 0.01 -0.76 0.00 0.00 0.00 175.10 174.69 2ciq s LEU 12 N 1.17 3.60 0.04 3.92 1.43 -0.24 -1.24 118.68 127.36 2ciq s LEU 12 Ca -0.05 0.12 0.07 0.00 -1.03 0.00 0.00 54.13 53.24 2ciq s LEU 12 Cb -0.14 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 2ciq s LEU 12 CO -0.02 0.34 -0.20 0.42 0.23 0.00 0.00 176.35 177.12 2ciq s THR 13 N -0.65 1.63 0.11 5.49 -4.23 -0.22 -1.23 115.64 116.54 2ciq s THR 13 Ca 0.11 -1.15 -0.30 0.00 -1.18 0.00 0.00 61.69 59.17 2ciq s THR 13 Cb -0.12 -1.41 -0.06 0.00 1.34 0.00 0.00 72.50 72.25 2ciq s THR 13 CO 0.02 0.22 0.96 -2.28 -0.54 0.00 0.00 174.62 173.01 2ciq s HIS 14 N -0.76 3.81 0.49 3.99 2.46 -0.29 -1.08 115.29 123.90 2ciq s HIS 14 Ca 0.07 1.80 0.26 0.00 0.47 0.00 0.00 55.06 57.66 2ciq s HIS 14 Cb -0.09 -3.05 1.51 0.00 -0.13 0.00 0.00 32.58 30.82 2ciq s HIS 14 CO 0.01 0.20 2.13 -1.00 -2.47 0.00 0.00 174.74 173.62 2ciq h PRO 15 N 5.60 0.00 0.00 2.88 0.13 -1.92 -2.07 132.00 136.62 2ciq h PRO 15 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2ciq h PRO 15 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2ciq h PRO 15 CO 0.72 0.08 -0.29 0.00 -0.23 0.00 0.00 178.00 178.28 2ciq h ALA 16 N 1.92 0.84 -0.89 -0.56 0.00 -1.99 -3.44 119.26 115.14 2ciq h ALA 16 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2ciq h ALA 16 Cb 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 17.79 17.78 2ciq h ALA 16 CO 0.01 0.00 -0.30 0.34 0.00 0.00 0.00 179.25 179.30 2ciq s ASP 17 N -5.38 -1.41 0.09 0.00 -1.08 -0.79 -5.03 116.67 103.08 2ciq s ASP 17 Ca 0.06 0.30 0.11 0.00 -0.52 0.00 0.00 52.55 52.50 2ciq s ASP 17 Cb 0.09 1.95 0.51 0.00 -1.46 0.00 0.00 42.92 44.01 2ciq s ASP 17 CO 0.68 -0.26 1.34 -1.84 0.52 0.00 0.00 175.17 175.62 2ciq n GLU 18 N 5.39 0.05 0.00 4.34 0.28 -1.18 -1.33 120.64 128.19 2ciq n GLU 18 Ca 0.04 0.45 0.14 0.00 -0.16 0.00 0.00 57.16 57.63 2ciq n GLU 18 Cb 0.54 -1.63 0.63 0.00 1.43 0.00 0.00 31.44 32.41 2ciq n GLU 18 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2ciq n THR 19 N -1.73 0.00 -3.44 3.84 -2.24 -1.26 -4.58 114.28 104.86 2ciq n THR 19 Ca 0.01 -0.04 -0.39 0.00 -2.27 0.00 0.00 64.05 61.36 2ciq n THR 19 Cb 0.08 -0.21 -0.10 0.00 -2.10 0.00 0.00 70.33 68.01 2ciq n THR 19 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2ciq s THR 20 N -2.55 5.21 0.14 4.28 2.01 -0.44 -0.97 115.64 123.31 2ciq s THR 20 Ca 0.27 0.44 -0.12 0.00 0.31 0.00 0.00 61.69 62.59 2ciq s THR 20 Cb 0.20 -3.67 0.01 0.00 0.01 0.00 0.00 72.50 69.05 2ciq s THR 20 CO 0.48 0.16 0.33 -0.94 -0.69 0.00 0.00 174.62 173.97 2ciq s SER 21 N 1.67 -0.06 -0.01 3.53 1.04 -0.25 -1.13 113.70 118.49 2ciq s SER 21 Ca 0.13 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2ciq s SER 21 Cb -0.16 0.44 0.01 0.00 0.10 0.00 0.00 66.02 66.41 2ciq s SER 21 CO 0.10 -0.87 0.00 0.54 0.98 0.00 0.00 173.24 174.00 2ciq s VAL 22 N -3.88 0.02 -0.15 5.02 0.11 -0.37 -0.95 120.40 120.20 2ciq s VAL 22 Ca 0.09 0.05 -0.03 0.00 -2.93 0.00 0.00 61.98 59.16 2ciq s VAL 22 Cb 0.03 -0.06 -0.02 0.00 -1.53 0.00 0.00 36.38 34.79 2ciq s VAL 22 CO -0.06 0.04 -0.06 -1.00 -3.33 0.00 0.00 175.10 170.69 2ciq s HIS 23 N 0.33 2.98 -0.15 1.54 3.76 -0.51 -1.08 115.29 122.16 2ciq s HIS 23 Ca -0.03 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.52 2ciq s HIS 23 Cb -0.04 -1.93 0.02 0.00 1.11 0.00 0.00 32.58 31.74 2ciq s HIS 23 CO -0.01 -0.07 -0.14 0.42 -0.85 0.00 0.00 174.74 174.10 2ciq s ILE 24 N 0.35 1.57 0.12 0.60 1.01 0.21 -1.61 121.20 123.45 2ciq s ILE 24 Ca -0.05 -0.66 -0.30 0.00 0.00 0.00 0.00 60.65 59.64 2ciq s ILE 24 Cb -0.15 -1.49 -0.06 0.00 0.01 0.00 0.00 42.46 40.77 2ciq s ILE 24 CO 0.04 0.43 1.09 -0.22 0.00 0.00 0.00 174.94 176.27 2ciq s LEU 25 N 1.48 4.45 0.30 2.97 2.96 -0.31 -0.97 118.68 129.57 2ciq s LEU 25 Ca 0.04 1.98 -0.00 0.00 -0.22 0.00 0.00 54.13 55.93 2ciq s LEU 25 Cb -0.13 -3.59 0.48 0.00 0.50 0.00 0.00 46.19 43.45 2ciq s LEU 25 CO -0.10 -0.26 1.89 0.11 -1.32 0.00 0.00 176.35 176.66 2ciq h LYS 26 N 5.79 0.83 -6.16 1.98 1.57 -1.56 -0.88 116.57 118.14 2ciq h LYS 26 Ca -0.43 -0.12 -0.57 0.00 -1.87 0.00 0.00 60.65 57.66 2ciq h LYS 26 Cb 1.21 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 2ciq h LYS 26 CO 0.75 0.68 1.35 -0.47 -0.57 0.00 0.00 179.45 181.19 2ciq s TYR 27 N -5.40 1.37 0.00 -1.35 5.04 -1.26 -1.34 117.35 114.41 2ciq s TYR 27 Ca -0.10 0.25 0.00 0.00 -2.44 0.00 0.00 57.07 54.78 2ciq s TYR 27 Cb 0.16 -4.04 0.00 0.00 0.35 0.00 0.00 41.96 38.43 2ciq s TYR 27 CO 0.79 -4.30 0.00 0.41 -1.34 0.00 0.00 175.55 171.11 2ciq n GLY 28 N 5.22 0.87 4.18 8.97 0.00 0.11 -3.22 105.19 121.31 2ciq n GLY 28 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 2ciq n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ciq n ALA 29 N 1.00 -2.26 -2.81 4.61 0.00 -0.50 -4.51 120.51 116.04 2ciq n ALA 29 Ca 0.00 -0.47 -0.44 0.00 0.00 0.00 0.00 53.44 52.53 2ciq n ALA 29 Cb 0.00 -1.67 -0.07 0.00 0.00 0.00 0.00 19.45 17.72 2ciq n ALA 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2ciq s THR 30 N -3.99 4.97 0.09 0.00 2.01 -0.36 -4.85 115.64 113.51 2ciq s THR 30 Ca 0.21 -0.66 -0.32 0.00 0.31 0.00 0.00 61.69 61.23 2ciq s THR 30 Cb -0.11 -4.26 -0.11 0.00 0.01 0.00 0.00 72.50 68.03 2ciq s THR 30 CO 0.98 -0.76 1.83 0.52 -0.69 0.00 0.00 174.62 176.50 2ciq n VAL 31 N 5.51 0.40 -0.05 3.82 0.31 -1.26 -1.17 118.33 125.89 2ciq n VAL 31 Ca -0.08 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2ciq n VAL 31 Cb 0.45 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 2ciq n VAL 31 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ciq n TYR 32 N 5.73 0.00 -3.76 3.52 0.18 -0.63 -0.40 117.16 121.80 2ciq n TYR 32 Ca 0.19 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.84 2ciq n TYR 32 Cb 0.36 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.21 2ciq n TYR 32 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2ciq s SER 33 N -0.51 -0.35 -0.13 9.48 0.15 -1.23 -4.53 113.70 116.57 2ciq s SER 33 Ca 0.00 0.67 -0.04 0.00 0.70 0.00 0.00 55.95 57.28 2ciq s SER 33 Cb 0.00 0.67 0.06 0.00 -1.71 0.00 0.00 66.02 65.04 2ciq s SER 33 CO 0.00 -0.12 0.11 0.86 1.20 0.00 0.00 173.24 175.29 2ciq s TRP 34 N 0.26 0.04 -0.13 3.44 -0.00 -1.26 -1.42 118.94 119.88 2ciq s TRP 34 Ca -0.01 0.02 -0.03 0.00 -0.00 0.00 0.00 56.10 56.08 2ciq s TRP 34 Cb -0.03 -0.54 -0.03 0.00 -0.00 0.00 0.00 33.47 32.87 2ciq s TRP 34 CO -0.00 -0.42 -0.03 0.15 -0.00 0.00 0.00 176.95 176.65 2ciq s LYS 35 N 2.19 3.46 -0.33 5.86 1.02 -0.12 -0.37 119.74 131.45 2ciq s LYS 35 Ca 0.04 -0.49 -0.05 0.00 0.02 0.00 0.00 55.97 55.49 2ciq s LYS 35 Cb -0.15 -2.87 0.05 0.00 -0.52 0.00 0.00 37.83 34.34 2ciq s LYS 35 CO -0.08 0.38 0.08 -1.17 -0.92 0.00 0.00 175.35 173.65 2ciq s LEU 36 N -0.01 4.25 -1.51 3.17 2.96 0.01 -1.09 118.68 126.46 2ciq s LEU 36 Ca 0.01 -1.22 -0.07 0.00 -0.22 0.00 0.00 54.13 52.63 2ciq s LEU 36 Cb -0.13 -1.82 0.06 0.00 0.50 0.00 0.00 46.19 44.79 2ciq s LEU 36 CO 0.02 -0.32 0.59 0.29 -1.32 0.00 0.00 176.35 175.61 2ciq n LYS 37 N 4.75 -3.53 0.00 1.98 5.02 -1.22 -1.23 118.16 123.93 2ciq n LYS 37 Ca -0.12 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.59 2ciq n LYS 37 Cb 0.44 -4.81 0.00 0.00 -0.02 0.00 0.00 35.03 30.64 2ciq n LYS 37 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2ciq n SER 38 N -2.88 0.00 -4.62 4.39 7.64 -0.14 -4.94 113.62 113.08 2ciq n SER 38 Ca -0.16 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.32 2ciq n SER 38 Cb 0.61 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.74 2ciq n SER 38 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2ciq s GLU 39 N -0.43 4.06 0.12 1.43 2.12 -0.37 -4.99 118.70 120.64 2ciq s GLU 39 Ca 0.00 0.35 -0.31 0.00 0.36 0.00 0.00 54.97 55.37 2ciq s GLU 39 Cb 0.00 -3.66 -0.08 0.00 0.26 0.00 0.00 34.13 30.65 2ciq s GLU 39 CO 0.00 -0.38 1.38 -2.00 -0.54 0.00 0.00 175.26 173.72 2ciq s GLU 40 N 2.36 4.33 -0.04 4.30 2.56 -1.26 -0.81 118.70 130.13 2ciq s GLU 40 Ca 0.22 2.07 0.18 0.00 0.00 0.00 0.00 54.97 57.44 2ciq s GLU 40 Cb -0.16 -3.24 -0.28 0.00 2.00 0.00 0.00 34.13 32.45 2ciq s GLU 40 CO 0.09 -0.41 0.37 1.04 -0.56 0.00 0.00 175.26 175.79 2ciq n GLN 41 N 3.80 0.63 -4.27 4.30 1.13 0.51 -4.87 117.38 118.61 2ciq n GLN 41 Ca 0.11 -0.15 -0.31 0.00 -1.94 0.00 0.00 57.00 54.71 2ciq n GLN 41 Cb 0.42 -1.44 -0.09 0.00 0.11 0.00 0.00 30.24 29.24 2ciq n GLN 41 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2ciq s LEU 42 N -4.40 3.33 0.03 1.08 1.43 -1.26 -1.27 118.68 117.63 2ciq s LEU 42 Ca -0.07 -0.16 -0.20 0.00 -1.03 0.00 0.00 54.13 52.67 2ciq s LEU 42 Cb 0.11 -2.00 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 2ciq s LEU 42 CO 0.76 0.23 0.58 0.86 0.23 0.00 0.00 176.35 179.01 2ciq s TRP 43 N -1.16 3.74 -0.03 0.29 -0.00 -0.49 -4.55 118.94 116.73 2ciq s TRP 43 Ca 0.21 1.23 0.01 0.00 -0.00 0.00 0.00 56.10 57.55 2ciq s TRP 43 Cb -0.11 -2.56 0.03 0.00 -0.00 0.00 0.00 33.47 30.82 2ciq s TRP 43 CO 0.13 0.46 -0.01 -1.17 -0.00 0.00 0.00 176.95 176.36 2ciq s LEU 44 N -0.60 1.19 0.42 5.86 2.96 -1.26 -1.17 118.68 126.08 2ciq s LEU 44 Ca 0.30 -0.05 -0.26 0.00 -0.22 0.00 0.00 54.13 53.90 2ciq s LEU 44 Cb -0.19 -0.27 -0.10 0.00 0.50 0.00 0.00 46.19 46.13 2ciq s LEU 44 CO 0.18 -0.09 1.35 -0.24 -1.32 0.00 0.00 176.35 176.23 2ciq n SER 45 N 4.13 2.97 0.13 3.68 2.88 -0.76 -4.87 113.62 121.78 2ciq n SER 45 Ca -0.26 1.13 0.12 0.00 -1.33 0.00 0.00 58.87 58.53 2ciq n SER 45 Cb 0.50 -1.55 0.49 0.00 -0.75 0.00 0.00 64.21 62.91 2ciq n SER 45 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2ciq n THR 46 N -0.09 0.83 -0.62 2.46 -2.24 -0.70 -1.96 114.28 111.95 2ciq n THR 46 Ca 0.05 0.23 0.07 0.00 -2.27 0.00 0.00 64.05 62.14 2ciq n THR 46 Cb 0.40 -1.16 0.23 0.00 -2.10 0.00 0.00 70.33 67.70 2ciq n THR 46 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ciq n ALA 47 N -1.77 2.71 -1.77 6.98 0.00 -1.26 -5.00 120.51 120.39 2ciq n ALA 47 Ca 0.02 -1.75 -0.40 0.00 0.00 0.00 0.00 53.44 51.31 2ciq n ALA 47 Cb 0.23 -0.65 0.01 0.00 0.00 0.00 0.00 19.45 19.03 2ciq n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ciq s ALA 48 N -1.98 3.28 -0.11 0.00 0.00 -0.83 -4.75 121.76 117.37 2ciq s ALA 48 Ca 0.36 1.38 -0.21 0.00 0.00 0.00 0.00 51.96 53.49 2ciq s ALA 48 Cb 0.26 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 2ciq s ALA 48 CO 0.14 -1.03 0.62 0.15 0.00 0.00 0.00 175.76 175.64 2ciq s LYS 49 N -2.33 4.35 -0.03 0.00 -0.14 -1.26 -4.93 119.74 115.41 2ciq s LYS 49 Ca 0.58 0.70 0.11 0.00 -1.36 0.00 0.00 55.97 56.00 2ciq s LYS 49 Cb -0.42 -3.48 0.31 0.00 -1.68 0.00 0.00 37.83 32.56 2ciq s LYS 49 CO 0.54 0.01 1.25 1.28 -0.76 0.00 0.00 175.35 177.67 2ciq n LEU 50 N 4.08 2.96 -1.16 3.17 4.77 -1.26 -4.36 117.00 125.20 2ciq n LEU 50 Ca -0.03 -2.17 0.12 0.00 -0.03 0.00 0.00 56.01 53.91 2ciq n LEU 50 Cb 0.51 -0.26 0.22 0.00 -2.33 0.00 0.00 43.42 41.56 2ciq n LEU 50 CO 0.45 0.70 0.71 -0.90 -1.33 0.00 0.00 177.39 177.02 2ciq n ASP 51 N 0.23 3.48 0.00 -1.43 5.75 -1.26 -4.94 116.55 118.38 2ciq n ASP 51 Ca 0.12 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.90 2ciq n ASP 51 Cb 0.48 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.32 2ciq n ASP 51 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ciq n GLY 52 N 1.52 0.69 0.15 6.12 0.00 -1.26 -4.93 105.19 107.48 2ciq n GLY 52 Ca 0.20 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.23 2ciq n GLY 52 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ciq h SER 53 N 0.00 0.00 -5.00 1.61 4.64 -1.92 -3.47 113.55 109.42 2ciq h SER 53 Ca 0.00 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.45 2ciq h SER 53 Cb 0.00 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 61.98 2ciq h SER 53 CO 0.00 0.55 0.45 -1.59 -0.87 0.00 0.00 176.83 175.37 2ciq s LYS 54 N -3.50 1.08 0.74 4.77 -2.85 -1.26 -5.16 119.74 113.55 2ciq s LYS 54 Ca -0.00 -0.51 -0.16 0.00 -1.00 0.00 0.00 55.97 54.30 2ciq s LYS 54 Cb 0.12 0.42 0.01 0.00 -2.06 0.00 0.00 37.83 36.32 2ciq s LYS 54 CO 0.74 -0.49 0.92 -2.30 0.10 0.00 0.00 175.35 174.32 2ciq n PRO 55 N -0.37 0.42 -2.41 1.78 -0.02 -1.26 -4.83 135.00 128.31 2ciq n PRO 55 Ca -0.08 0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.18 2ciq n PRO 55 Cb 0.61 -2.19 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 2ciq n PRO 55 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ciq s VAL 56 N -1.88 4.12 -1.10 -1.45 1.01 -1.26 -4.67 120.40 115.16 2ciq s VAL 56 Ca 0.72 1.47 -0.16 0.00 0.00 0.00 0.00 61.98 64.01 2ciq s VAL 56 Cb -0.33 -3.95 0.15 0.00 0.00 0.00 0.00 36.38 32.25 2ciq s VAL 56 CO 0.52 0.02 1.33 -0.60 0.00 0.00 0.00 175.10 176.37 2ciq s ARG 57 N 2.01 3.89 0.00 2.72 6.06 -1.26 -4.77 118.95 127.60 2ciq s ARG 57 Ca 0.58 -2.21 0.00 0.00 -2.50 0.00 0.00 55.73 51.60 2ciq s ARG 57 Cb -0.27 -5.04 0.00 0.00 0.06 0.00 0.00 34.95 29.71 2ciq s ARG 57 CO 0.24 -1.80 0.00 0.41 -2.50 0.00 0.00 175.30 171.65 2ciq n GLY 58 N 4.76 1.01 7.00 8.12 0.00 -1.26 -1.83 105.19 122.99 2ciq n GLY 58 Ca 0.32 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.40 2ciq n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ciq n GLY 59 N -1.06 2.28 2.43 -0.02 0.00 -0.32 -4.01 105.19 104.49 2ciq n GLY 59 Ca 0.00 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 2ciq n GLY 59 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ciq n ILE 60 N 0.00 0.66 -1.72 -0.61 5.41 0.46 -1.33 119.36 122.23 2ciq n ILE 60 Ca 0.00 -4.47 -0.38 0.00 1.00 0.00 0.00 62.75 58.89 2ciq n ILE 60 Cb 0.00 -2.00 0.05 0.00 -0.71 0.00 0.00 39.64 36.98 2ciq n ILE 60 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2ciq n PRO 61 N 1.56 1.55 -3.74 0.38 -0.02 -1.25 -4.19 135.00 129.29 2ciq n PRO 61 Ca 0.25 0.57 -0.35 0.00 -2.02 0.00 0.00 63.50 61.95 2ciq n PRO 61 Cb 0.45 -2.51 -0.08 0.00 -0.02 0.00 0.00 33.50 31.34 2ciq n PRO 61 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2ciq s LEU 62 N -3.26 4.24 -0.32 2.45 1.43 -1.26 -1.04 118.68 120.91 2ciq s LEU 62 Ca 0.73 0.29 -0.06 0.00 -1.03 0.00 0.00 54.13 54.05 2ciq s LEU 62 Cb -0.42 -2.11 0.03 0.00 0.03 0.00 0.00 46.19 43.72 2ciq s LEU 62 CO 0.48 0.21 0.09 -0.69 0.23 0.00 0.00 176.35 176.67 2ciq s VAL 63 N 0.15 3.80 -0.25 -1.59 1.01 0.00 -3.04 120.40 120.48 2ciq s VAL 63 Ca 0.10 -0.97 -0.26 0.00 0.00 0.00 0.00 61.98 60.84 2ciq s VAL 63 Cb -0.11 -3.07 0.11 0.00 0.00 0.00 0.00 36.38 33.31 2ciq s VAL 63 CO -0.01 -0.07 0.97 0.12 0.00 0.00 0.00 175.10 176.12 2ciq s PHE 64 N 1.43 -0.51 -1.81 5.22 5.36 -1.22 -1.63 117.98 124.83 2ciq s PHE 64 Ca -0.00 1.16 0.18 0.00 -0.96 0.00 0.00 56.93 57.31 2ciq s PHE 64 Cb -0.19 0.37 0.56 0.00 -0.34 0.00 0.00 43.02 43.43 2ciq s PHE 64 CO 0.02 -0.29 1.47 -0.35 -1.46 0.00 0.00 175.22 174.61 2ciq n PRO 65 N 1.95 2.65 -4.23 10.12 -0.04 -1.26 -0.72 135.00 143.46 2ciq n PRO 65 Ca -0.13 -2.28 -0.20 0.00 -0.04 0.00 0.00 63.50 60.86 2ciq n PRO 65 Cb 0.56 -1.56 -0.16 0.00 -0.04 0.00 0.00 33.50 32.30 2ciq n PRO 65 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2ciq s VAL 66 N -1.32 0.59 -0.05 0.52 0.11 -1.26 -0.35 120.40 118.64 2ciq s VAL 66 Ca 0.42 -0.19 -0.22 0.00 -2.93 0.00 0.00 61.98 59.06 2ciq s VAL 66 Cb 0.23 -0.58 -0.04 0.00 -1.53 0.00 0.00 36.38 34.45 2ciq s VAL 66 CO 0.26 0.22 0.63 0.12 -3.33 0.00 0.00 175.10 173.01 2ciq s PHE 67 N 0.65 3.61 0.00 1.54 5.36 -1.26 -3.15 117.98 124.72 2ciq s PHE 67 Ca -0.09 1.19 0.00 0.00 -0.96 0.00 0.00 56.93 57.07 2ciq s PHE 67 Cb -0.12 -2.70 0.00 0.00 -0.34 0.00 0.00 43.02 39.85 2ciq s PHE 67 CO 0.00 0.20 0.00 0.41 -1.46 0.00 0.00 175.22 174.37 2ciq n GLY 68 N 2.88 -0.68 3.46 13.12 0.00 -1.26 -4.69 105.19 118.02 2ciq n GLY 68 Ca -0.04 -1.14 -0.35 0.00 0.00 0.00 0.00 46.02 44.48 2ciq n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ciq s LYS 69 N 0.00 3.66 0.14 1.61 2.47 -1.26 -1.27 119.74 125.09 2ciq s LYS 69 Ca 0.00 -0.49 -0.15 0.00 -1.56 0.00 0.00 55.97 53.77 2ciq s LYS 69 Cb 0.00 -3.15 -0.07 0.00 -1.46 0.00 0.00 37.83 33.15 2ciq s LYS 69 CO 0.00 -0.01 0.56 1.21 0.16 0.00 0.00 175.35 177.26 2ciq s ASN 70 N 1.10 6.86 -0.03 1.43 3.84 -1.26 -4.99 114.94 121.88 2ciq s ASN 70 Ca 0.03 1.11 0.05 0.00 0.21 0.00 0.00 52.86 54.25 2ciq s ASN 70 Cb -0.14 -2.30 -0.07 0.00 -0.55 0.00 0.00 41.25 38.19 2ciq s ASN 70 CO 0.02 0.12 0.05 -0.24 -2.79 0.00 0.00 177.10 174.26 2ciq n SER 71 N 0.90 3.82 -0.00 -4.21 2.88 -1.26 -4.28 113.62 111.47 2ciq n SER 71 Ca -0.06 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.53 2ciq n SER 71 Cb 0.52 0.82 -0.06 0.00 -0.75 0.00 0.00 64.21 64.74 2ciq n SER 71 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2ciq n THR 72 N -2.01 0.00 -3.18 2.46 -2.24 -1.26 -4.88 114.28 103.17 2ciq n THR 72 Ca -0.06 -0.26 -0.39 0.00 -2.27 0.00 0.00 64.05 61.07 2ciq n THR 72 Cb 0.48 0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 69.49 2ciq n THR 72 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ciq s ASP 73 N -2.20 6.99 0.24 3.42 2.15 -1.26 -4.97 116.67 121.04 2ciq s ASP 73 Ca 0.02 1.18 -0.04 0.00 0.43 0.00 0.00 52.55 54.14 2ciq s ASP 73 Cb 0.07 -2.37 0.44 0.00 -0.30 0.00 0.00 42.92 40.76 2ciq s ASP 73 CO 0.40 0.08 1.75 -0.08 -0.17 0.00 0.00 175.17 177.15 2ciq h GLU 74 N 5.74 0.53 0.01 4.34 4.57 -2.00 -1.71 114.58 126.06 2ciq h GLU 74 Ca -0.45 -0.03 -0.38 0.00 -1.18 0.00 0.00 59.36 57.32 2ciq h GLU 74 Cb 1.20 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.62 2ciq h GLU 74 CO 0.70 0.35 -2.16 0.72 -1.18 0.00 0.00 179.01 177.44 2ciq n HIS 75 N -4.92 0.39 0.25 0.92 8.25 -1.26 -4.35 115.22 114.51 2ciq n HIS 75 Ca 0.14 0.14 0.08 0.00 -0.26 0.00 0.00 57.72 57.82 2ciq n HIS 75 Cb 0.37 -1.04 0.63 0.00 1.12 0.00 0.00 29.99 31.07 2ciq n HIS 75 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2ciq h LEU 76 N -0.69 0.00 -1.10 2.41 3.38 -1.90 -1.18 115.31 116.23 2ciq h LEU 76 Ca -0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.41 2ciq h LEU 76 Cb 1.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.39 2ciq h LEU 76 CO -0.25 0.06 0.00 0.77 0.09 0.00 0.00 178.44 179.11 2ciq h SER 77 N 0.00 0.00 1.58 -0.43 4.64 -1.49 -2.30 113.55 115.55 2ciq h SER 77 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ciq h SER 77 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2ciq h SER 77 CO 0.01 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.08 2ciq h LYS 78 N 0.00 0.00 -6.87 4.77 1.57 -1.41 -3.46 116.57 111.17 2ciq h LYS 78 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 2ciq h LYS 78 Cb 0.26 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.58 2ciq h LYS 78 CO 0.00 0.00 0.13 -0.51 -0.57 0.00 0.00 179.45 178.50 2ciq s LEU 79 N -4.95 3.79 0.92 2.94 1.43 -0.86 -5.03 118.68 116.91 2ciq s LEU 79 Ca 0.09 1.13 -0.12 0.00 -1.03 0.00 0.00 54.13 54.21 2ciq s LEU 79 Cb 0.10 -4.02 0.14 0.00 0.03 0.00 0.00 46.19 42.44 2ciq s LEU 79 CO 0.61 -0.43 1.10 -2.16 0.23 0.00 0.00 176.35 175.70 2ciq s PRO 80 N -3.97 1.06 0.12 1.29 0.04 -1.26 -4.75 135.00 127.52 2ciq s PRO 80 Ca 0.51 0.61 -0.35 0.00 0.04 0.00 0.00 61.00 61.81 2ciq s PRO 80 Cb -0.10 -1.80 -0.16 0.00 0.04 0.00 0.00 34.50 32.48 2ciq s PRO 80 CO 0.33 -2.33 1.40 0.94 0.04 0.00 0.00 177.00 177.39 2ciq n GLN 81 N -3.91 1.49 -1.01 4.56 7.27 -1.26 -1.80 117.38 122.72 2ciq n GLN 81 Ca 0.06 0.54 -0.00 0.00 0.07 0.00 0.00 57.00 57.67 2ciq n GLN 81 Cb 0.57 -2.21 -0.00 0.00 2.41 0.00 0.00 30.24 31.01 2ciq n GLN 81 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2ciq n HIS 82 N 2.68 0.00 -2.56 3.69 8.25 -0.40 -4.90 115.22 121.98 2ciq n HIS 82 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 2ciq n HIS 82 Cb 0.23 -0.75 0.00 0.00 1.12 0.00 0.00 29.99 30.59 2ciq n HIS 82 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ciq n GLY 83 N -1.57 -0.50 0.00 -1.41 0.00 -0.75 -3.44 105.19 97.52 2ciq n GLY 83 Ca -0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2ciq n GLY 83 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2ciq n LEU 84 N 0.00 0.22 -0.18 0.99 -0.00 0.10 -4.61 117.00 113.52 2ciq n LEU 84 Ca 0.00 -0.50 -0.05 0.00 -0.00 0.00 0.00 56.01 55.46 2ciq n LEU 84 Cb 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 43.42 43.54 2ciq n LEU 84 CO 0.00 0.06 0.94 0.00 -0.00 0.00 0.00 177.39 178.39 2ciq h ALA 85 N 0.00 1.06 -0.00 1.47 0.00 -1.55 -3.02 119.26 117.22 2ciq h ALA 85 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2ciq h ALA 85 Cb 0.03 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2ciq h ALA 85 CO 0.00 0.61 -0.08 2.89 0.00 0.00 0.00 179.25 182.67 2ciq n ARG 86 N -4.24 0.18 -0.37 0.00 1.85 -1.17 -3.26 116.66 109.66 2ciq n ARG 86 Ca 0.04 -0.03 0.08 0.00 -1.00 0.00 0.00 57.85 56.94 2ciq n ARG 86 Cb 0.26 -1.50 0.18 0.00 -1.05 0.00 0.00 32.46 30.35 2ciq n ARG 86 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 2ciq n ASN 87 N -1.38 1.99 -4.35 2.89 2.04 -1.15 -4.31 115.26 110.98 2ciq n ASN 87 Ca 0.09 -3.54 -0.30 0.00 -0.44 0.00 0.00 54.58 50.40 2ciq n ASN 87 Cb 0.31 -0.48 -0.14 0.00 -2.53 0.00 0.00 39.78 36.93 2ciq n ASN 87 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 2ciq s SER 88 N -3.07 3.20 -0.32 0.53 0.01 -1.17 -4.58 113.70 108.30 2ciq s SER 88 Ca 0.35 -0.62 -0.23 0.00 1.31 0.00 0.00 55.95 56.76 2ciq s SER 88 Cb 0.33 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 66.29 2ciq s SER 88 CO -0.03 0.24 0.76 -0.89 0.41 0.00 0.00 173.24 173.74 2ciq s THR 89 N -0.86 4.80 0.53 1.44 2.01 -1.26 0.06 115.64 122.35 2ciq s THR 89 Ca 0.12 1.04 -0.11 0.00 0.31 0.00 0.00 61.69 63.06 2ciq s THR 89 Cb -0.10 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.22 2ciq s THR 89 CO 0.03 -0.28 0.92 0.26 -0.69 0.00 0.00 174.62 174.85 2ciq s TRP 90 N 2.94 3.55 -0.15 4.92 0.52 -0.45 -4.74 118.94 125.53 2ciq s TRP 90 Ca 0.31 1.18 -0.18 0.00 0.02 0.00 0.00 56.10 57.43 2ciq s TRP 90 Cb -0.14 -2.59 -0.04 0.00 -1.15 0.00 0.00 33.47 29.55 2ciq s TRP 90 CO 0.14 -0.42 0.47 -2.00 0.02 0.00 0.00 176.95 175.16 2ciq s GLU 91 N -4.59 4.29 -0.17 4.98 2.12 -0.20 -4.76 118.70 120.37 2ciq s GLU 91 Ca 0.54 0.41 -0.29 0.00 0.36 0.00 0.00 54.97 55.98 2ciq s GLU 91 Cb -0.10 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.79 2ciq s GLU 91 CO 0.43 0.07 1.39 0.12 -0.54 0.00 0.00 175.26 176.72 2ciq s PHE 92 N 0.93 2.57 -0.66 5.30 5.36 -1.26 -0.51 117.98 129.71 2ciq s PHE 92 Ca 0.25 0.77 0.24 0.00 -0.96 0.00 0.00 56.93 57.22 2ciq s PHE 92 Cb -0.15 -3.69 0.24 0.00 -0.34 0.00 0.00 43.02 39.08 2ciq s PHE 92 CO 0.10 -2.28 1.22 1.28 -1.46 0.00 0.00 175.22 174.08 2ciq n LEU 93 N 7.05 0.65 0.00 6.12 4.77 -0.02 -4.95 117.00 130.62 2ciq n LEU 93 Ca 0.15 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 2ciq n LEU 93 Cb 0.45 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2ciq n LEU 93 CO 0.59 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 2ciq n GLY 94 N 1.36 1.17 3.82 -0.72 0.00 -1.22 -4.92 105.19 104.68 2ciq n GLY 94 Ca 0.03 -2.29 -0.36 0.00 0.00 0.00 0.00 46.02 43.39 2ciq n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ciq s GLN 95 N -1.18 4.24 -0.00 1.61 -2.07 -1.26 -1.39 119.66 119.60 2ciq s GLN 95 Ca 0.00 0.85 0.07 0.00 -1.82 0.00 0.00 55.36 54.46 2ciq s GLN 95 Cb 0.00 -2.89 -0.09 0.00 -1.09 0.00 0.00 33.01 28.94 2ciq s GLN 95 CO 0.00 0.41 0.22 0.25 -1.32 0.00 0.00 175.29 174.84 2ciq n THR 96 N 0.76 0.00 -3.69 3.63 -2.24 0.10 -4.95 114.28 107.89 2ciq n THR 96 Ca -0.03 -0.25 -0.14 0.00 -2.27 0.00 0.00 64.05 61.36 2ciq n THR 96 Cb 0.51 0.68 -0.08 0.00 -2.10 0.00 0.00 70.33 69.34 2ciq n THR 96 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ciq s LYS 97 N -2.04 0.72 -0.10 -0.78 1.02 -1.12 -4.94 119.74 112.49 2ciq s LYS 97 Ca 0.00 0.20 0.13 0.00 0.02 0.00 0.00 55.97 56.33 2ciq s LYS 97 Cb 0.05 0.34 -0.24 0.00 -0.52 0.00 0.00 37.83 37.46 2ciq s LYS 97 CO 0.28 -0.18 0.44 0.39 -0.92 0.00 0.00 175.35 175.36 2ciq n GLU 98 N 1.71 0.66 -3.34 1.68 -0.58 -1.26 -1.33 120.64 118.17 2ciq n GLU 98 Ca -0.18 0.19 -0.09 0.00 -0.42 0.00 0.00 57.16 56.66 2ciq n GLU 98 Cb 0.56 -1.69 -0.08 0.00 -0.57 0.00 0.00 31.44 29.66 2ciq n GLU 98 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2ciq s ASN 99 N -5.94 0.32 0.31 1.62 2.47 -1.26 -2.89 114.94 109.57 2ciq s ASN 99 Ca -0.08 0.07 -0.28 0.00 0.42 0.00 0.00 52.86 52.99 2ciq s ASN 99 Cb 0.07 1.09 -0.10 0.00 -1.45 0.00 0.00 41.25 40.87 2ciq s ASN 99 CO 0.82 -0.31 1.15 -2.16 -3.72 0.00 0.00 177.10 172.88 2ciq s PRO 100 N 2.54 4.47 -0.02 0.43 0.04 -1.26 -5.06 135.00 136.14 2ciq s PRO 100 Ca 0.12 1.89 -0.34 0.00 0.04 0.00 0.00 61.00 62.71 2ciq s PRO 100 Cb -0.15 -3.06 -0.12 0.00 0.04 0.00 0.00 34.50 31.21 2ciq s PRO 100 CO -0.19 0.03 1.82 -2.30 0.04 0.00 0.00 177.00 176.40 2ciq n PRO 101 N 0.89 2.23 -4.29 0.56 -0.02 -1.14 -4.66 135.00 128.58 2ciq n PRO 101 Ca 0.00 0.82 -0.19 0.00 -2.02 0.00 0.00 63.50 62.11 2ciq n PRO 101 Cb 0.44 -2.65 -0.15 0.00 -0.02 0.00 0.00 33.50 31.12 2ciq n PRO 101 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2ciq s THR 102 N 3.37 0.63 0.15 3.45 2.01 -0.44 -1.30 115.64 123.51 2ciq s THR 102 Ca 0.89 -0.29 0.04 0.00 0.31 0.00 0.00 61.69 62.64 2ciq s THR 102 Cb -0.67 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.23 2ciq s THR 102 CO 0.48 0.20 -0.08 0.68 -0.69 0.00 0.00 174.62 175.21 2ciq s VAL 103 N 0.15 1.04 0.08 3.82 -7.23 -0.36 -0.73 120.40 117.16 2ciq s VAL 103 Ca -0.02 -2.03 0.07 0.00 -1.81 0.00 0.00 61.98 58.19 2ciq s VAL 103 Cb -0.07 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.95 2ciq s VAL 103 CO 0.00 -0.70 -0.20 -1.10 -0.31 0.00 0.00 175.10 172.79 2ciq s GLN 104 N -3.79 1.16 0.06 4.82 -0.21 -0.49 -0.88 119.66 120.33 2ciq s GLN 104 Ca 0.18 -1.04 0.05 0.00 0.02 0.00 0.00 55.36 54.57 2ciq s GLN 104 Cb 0.04 -1.33 -0.03 0.00 1.00 0.00 0.00 33.01 32.69 2ciq s GLN 104 CO 0.01 0.32 -0.14 -0.06 -2.12 0.00 0.00 175.29 173.29 2ciq s PHE 105 N -1.04 1.23 0.09 0.91 0.08 0.27 -0.84 117.98 118.69 2ciq s PHE 105 Ca 0.06 -0.42 0.05 0.00 0.12 0.00 0.00 56.93 56.73 2ciq s PHE 105 Cb -0.09 -0.70 -0.03 0.00 -0.57 0.00 0.00 43.02 41.62 2ciq s PHE 105 CO 0.03 0.05 -0.12 0.20 -0.10 0.00 0.00 175.22 175.28 2ciq s GLY 106 N -1.54 0.90 -0.03 4.36 0.00 0.33 -1.01 107.32 110.34 2ciq s GLY 106 Ca -0.01 -1.15 -0.04 0.00 0.00 0.00 0.00 44.72 43.53 2ciq s GLY 106 CO 0.02 -1.20 0.09 -2.27 0.00 0.00 0.00 173.10 169.74 2ciq s LEU 107 N -2.22 1.67 0.11 0.66 2.96 -0.72 -1.03 118.68 120.10 2ciq s LEU 107 Ca 0.04 0.10 -0.15 0.00 -0.22 0.00 0.00 54.13 53.89 2ciq s LEU 107 Cb -0.06 0.35 0.03 0.00 0.50 0.00 0.00 46.19 47.02 2ciq s LEU 107 CO 0.02 -0.09 0.37 -1.59 -1.32 0.00 0.00 176.35 173.74 2ciq s LYS 108 N -0.22 1.01 0.38 1.98 -2.85 -1.26 -1.17 119.74 117.60 2ciq s LYS 108 Ca -0.03 -0.69 0.16 0.00 -1.00 0.00 0.00 55.97 54.42 2ciq s LYS 108 Cb -0.02 0.44 1.04 0.00 -2.06 0.00 0.00 37.83 37.23 2ciq s LYS 108 CO 0.00 -0.38 1.76 -1.35 0.10 0.00 0.00 175.35 175.48 2ciq h PRO 109 N 2.53 0.43 -0.18 1.78 0.11 -1.87 -1.39 132.00 133.41 2ciq h PRO 109 Ca -0.34 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.80 2ciq h PRO 109 Cb 1.24 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2ciq h PRO 109 CO 0.48 0.29 0.13 0.93 -0.21 0.00 0.00 178.00 179.61 2ciq h GLU 110 N 0.45 0.02 -0.01 1.05 3.07 -1.96 -2.68 114.58 114.52 2ciq h GLU 110 Ca 0.61 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.46 2ciq h GLU 110 Cb 1.43 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.33 2ciq h GLU 110 CO -0.34 0.01 -0.02 0.44 -1.40 0.00 0.00 179.01 177.71 2ciq n ILE 111 N -4.49 0.00 -1.92 3.13 -5.35 -0.57 -5.04 119.36 105.12 2ciq n ILE 111 Ca 0.01 -0.49 -0.30 0.00 -0.27 0.00 0.00 62.75 61.70 2ciq n ILE 111 Cb 0.25 1.15 0.20 0.00 -1.74 0.00 0.00 39.64 39.50 2ciq n ILE 111 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ciq s ALA 112 N -0.70 2.15 -0.09 -1.28 0.00 -0.93 -4.49 121.76 116.42 2ciq s ALA 112 Ca 0.09 -1.27 -0.31 0.00 0.00 0.00 0.00 51.96 50.47 2ciq s ALA 112 Cb 0.06 -2.75 -0.09 0.00 0.00 0.00 0.00 23.12 20.34 2ciq s ALA 112 CO 0.11 -2.56 2.03 -1.71 0.00 0.00 0.00 175.76 173.62 2ciq n ASN 113 N -3.85 3.60 -0.05 0.00 2.85 -1.26 -4.88 115.26 111.67 2ciq n ASN 113 Ca 0.16 0.71 -0.08 0.00 -0.11 0.00 0.00 54.58 55.26 2ciq n ASN 113 Cb 0.59 -1.47 -0.02 0.00 1.24 0.00 0.00 39.78 40.12 2ciq n ASN 113 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2ciq h PRO 114 N 11.46 0.05 -0.11 1.20 0.11 -1.92 0.17 132.00 142.95 2ciq h PRO 114 Ca -0.46 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.68 2ciq h PRO 114 Cb 1.26 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 2ciq h PRO 114 CO 0.95 0.03 -0.07 0.93 -0.21 0.00 0.00 178.00 179.63 2ciq h GLU 115 N 0.05 -0.07 -0.10 1.05 3.07 -2.01 -2.30 114.58 114.27 2ciq h GLU 115 Ca 0.10 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.84 2ciq h GLU 115 Cb 0.14 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.05 2ciq h GLU 115 CO -0.19 -0.05 -0.48 -0.07 -1.40 0.00 0.00 179.01 176.83 2ciq h LEU 116 N -0.07 0.28 -0.78 1.33 3.38 -1.89 -2.84 115.31 114.71 2ciq h LEU 116 Ca 0.07 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 2ciq h LEU 116 Cb 0.18 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2ciq h LEU 116 CO -0.16 0.72 -0.13 0.74 0.09 0.00 0.00 178.44 179.69 2ciq h THR 117 N 0.21 1.26 -0.49 0.22 2.02 -0.77 -1.42 112.91 113.94 2ciq h THR 117 Ca 0.01 -1.20 -0.04 0.00 0.77 0.00 0.00 66.41 65.94 2ciq h THR 117 Cb 0.93 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 2ciq h THR 117 CO 0.08 0.41 0.12 0.50 0.37 0.00 0.00 175.52 176.99 2ciq h LYS 118 N 0.70 0.74 -0.18 6.66 3.64 -1.19 -2.06 116.57 124.87 2ciq h LYS 118 Ca 0.11 -0.14 -0.16 0.00 -1.27 0.00 0.00 60.65 59.20 2ciq h LYS 118 Cb 0.62 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 2ciq h LYS 118 CO 0.04 0.67 -0.54 -0.07 -2.27 0.00 0.00 179.45 177.28 2ciq h LEU 119 N 0.71 0.60 -6.45 5.20 3.38 -1.24 -3.37 115.31 114.15 2ciq h LEU 119 Ca 0.16 -0.32 -0.59 0.00 0.09 0.00 0.00 57.88 57.22 2ciq h LEU 119 Cb 0.26 -0.17 -0.40 0.00 0.09 0.00 0.00 40.66 40.44 2ciq h LEU 119 CO -0.00 1.02 -0.79 1.87 0.09 0.00 0.00 178.44 180.63 2ciq n TRP 120 N -3.96 1.56 -1.12 1.13 -0.00 -0.58 -4.88 117.44 109.58 2ciq n TRP 120 Ca -0.03 -3.87 -0.16 0.00 -0.00 0.00 0.00 57.50 53.44 2ciq n TRP 120 Cb 0.60 -0.33 -0.13 0.00 -0.00 0.00 0.00 31.31 31.45 2ciq n TRP 120 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2ciq n PRO 121 N 1.77 2.09 -3.29 5.87 -0.04 -0.80 -4.70 135.00 135.90 2ciq n PRO 121 Ca 0.25 -1.36 -0.34 0.00 -0.04 0.00 0.00 63.50 62.01 2ciq n PRO 121 Cb 0.44 -2.01 -0.06 0.00 -0.04 0.00 0.00 33.50 31.82 2ciq n PRO 121 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2ciq s MET 122 N 0.19 3.99 0.04 0.54 -1.94 -1.26 -5.06 119.30 115.81 2ciq s MET 122 Ca 0.63 0.53 -0.26 0.00 -1.71 0.00 0.00 55.69 54.88 2ciq s MET 122 Cb 0.33 -2.78 -0.05 0.00 2.01 0.00 0.00 34.83 34.34 2ciq s MET 122 CO -0.06 0.38 0.80 -0.51 -0.01 0.00 0.00 175.02 175.62 2ciq s ASP 123 N -1.94 7.24 0.18 3.03 1.01 -1.26 -4.79 116.67 120.13 2ciq s ASP 123 Ca 0.43 1.49 -0.23 0.00 0.71 0.00 0.00 52.55 54.95 2ciq s ASP 123 Cb -0.14 -2.49 0.06 0.00 1.01 0.00 0.00 42.92 41.37 2ciq s ASP 123 CO 0.20 -0.03 0.66 -0.72 0.21 0.00 0.00 175.17 175.49 2ciq s TYR 124 N 0.10 -0.43 -0.04 4.23 -0.85 -1.26 -4.06 117.35 115.04 2ciq s TYR 124 Ca 0.41 0.16 0.01 0.00 -0.52 0.00 0.00 57.07 57.12 2ciq s TYR 124 Cb -0.21 0.60 0.02 0.00 0.38 0.00 0.00 41.96 42.75 2ciq s TYR 124 CO 0.24 -0.92 -0.05 -1.17 -1.52 0.00 0.00 175.55 172.13 2ciq s LEU 125 N -2.78 1.37 -0.13 -3.49 2.96 -0.14 -4.32 118.68 112.16 2ciq s LEU 125 Ca 0.04 -0.14 -0.04 0.00 -0.22 0.00 0.00 54.13 53.77 2ciq s LEU 125 Cb -0.02 -0.48 -0.03 0.00 0.50 0.00 0.00 46.19 46.15 2ciq s LEU 125 CO -0.07 -0.04 0.01 -0.76 -1.32 0.00 0.00 176.35 174.16 2ciq s LEU 126 N 0.87 3.54 -0.17 -0.68 1.43 -0.32 -0.66 118.68 122.69 2ciq s LEU 126 Ca -0.12 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 2ciq s LEU 126 Cb -0.15 -1.85 0.03 0.00 0.03 0.00 0.00 46.19 44.26 2ciq s LEU 126 CO 0.01 0.26 -0.10 -0.63 0.23 0.00 0.00 176.35 176.11 2ciq s ILE 127 N -0.15 1.42 -0.19 -0.59 -1.09 -0.41 -1.76 121.20 118.42 2ciq s ILE 127 Ca 0.05 -0.72 -0.11 0.00 -2.23 0.00 0.00 60.65 57.64 2ciq s ILE 127 Cb -0.13 -1.47 -0.05 0.00 -1.58 0.00 0.00 42.46 39.24 2ciq s ILE 127 CO 0.02 0.27 0.16 -0.22 -1.23 0.00 0.00 174.94 173.94 2ciq s LEU 128 N 1.52 4.22 -0.13 2.97 2.96 -0.18 -0.65 118.68 129.38 2ciq s LEU 128 Ca 0.02 0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.22 2ciq s LEU 128 Cb -0.15 -2.14 -0.01 0.00 0.50 0.00 0.00 46.19 44.40 2ciq s LEU 128 CO -0.09 0.17 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.05 2ciq s THR 129 N 0.38 2.63 -0.16 3.68 2.01 0.57 -0.57 115.64 124.18 2ciq s THR 129 Ca 0.10 -0.80 0.01 0.00 0.31 0.00 0.00 61.69 61.30 2ciq s THR 129 Cb -0.11 -2.08 0.00 0.00 0.01 0.00 0.00 72.50 70.32 2ciq s THR 129 CO -0.01 0.53 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.60 2ciq s VAL 130 N 0.52 2.56 -0.13 3.82 1.01 -0.06 -0.62 120.40 127.49 2ciq s VAL 130 Ca -0.11 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.08 2ciq s VAL 130 Cb -0.16 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.16 2ciq s VAL 130 CO 0.04 0.52 -0.19 -0.70 0.00 0.00 0.00 175.10 174.77 2ciq s GLU 131 N 0.86 2.67 -0.44 2.72 2.12 -0.06 -1.23 118.70 125.34 2ciq s GLU 131 Ca -0.05 -0.73 -0.12 0.00 0.36 0.00 0.00 54.97 54.44 2ciq s GLU 131 Cb -0.15 -2.21 0.08 0.00 0.26 0.00 0.00 34.13 32.11 2ciq s GLU 131 CO -0.01 -0.05 0.32 -1.17 -0.54 0.00 0.00 175.26 173.81 2ciq s LEU 132 N 0.93 5.37 0.75 2.70 2.96 -0.42 -1.11 118.68 129.87 2ciq s LEU 132 Ca -0.06 -1.47 -0.05 0.00 -0.22 0.00 0.00 54.13 52.33 2ciq s LEU 132 Cb -0.15 -2.06 0.12 0.00 0.50 0.00 0.00 46.19 44.59 2ciq s LEU 132 CO -0.03 -0.59 1.05 -0.83 -1.32 0.00 0.00 176.35 174.63 2ciq s GLY 133 N 2.35 1.75 0.44 7.98 0.00 -0.16 -3.62 107.32 116.07 2ciq s GLY 133 Ca 0.03 -1.37 0.17 0.00 0.00 0.00 0.00 44.72 43.56 2ciq s GLY 133 CO 0.04 -0.83 1.96 1.48 0.00 0.00 0.00 173.10 175.75 2ciq h SER 134 N -0.73 0.00 0.00 1.64 4.64 -2.00 -3.32 113.55 113.78 2ciq h SER 134 Ca -0.41 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.85 2ciq h SER 134 Cb 1.28 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.23 2ciq h SER 134 CO 0.46 0.23 -0.68 -0.90 -0.87 0.00 0.00 176.83 175.07 2ciq n ASP 135 N -4.09 0.34 -3.69 4.97 5.75 -1.26 -4.86 116.55 113.70 2ciq n ASP 135 Ca -0.02 -1.99 -0.10 0.00 -0.01 0.00 0.00 54.79 52.67 2ciq n ASP 135 Cb 0.29 -0.23 -0.03 0.00 -1.03 0.00 0.00 41.12 40.12 2ciq n ASP 135 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 2ciq s TYR 136 N 0.00 -0.21 -0.08 2.11 -0.85 -1.25 -4.10 117.35 112.97 2ciq s TYR 136 Ca 0.12 -0.12 0.01 0.00 -0.52 0.00 0.00 57.07 56.55 2ciq s TYR 136 Cb 0.13 0.45 0.02 0.00 0.38 0.00 0.00 41.96 42.95 2ciq s TYR 136 CO -0.06 -0.93 -0.09 -1.17 -1.52 0.00 0.00 175.55 171.78 2ciq s LEU 137 N -2.85 1.35 -0.13 -3.49 2.96 -0.29 -0.99 118.68 115.24 2ciq s LEU 137 Ca 0.08 -0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 53.71 2ciq s LEU 137 Cb -0.01 -0.77 -0.02 0.00 0.50 0.00 0.00 46.19 45.89 2ciq s LEU 137 CO -0.04 -0.05 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.08 2ciq s LYS 138 N 1.21 3.40 -0.20 1.98 2.20 -0.26 -0.49 119.74 127.59 2ciq s LYS 138 Ca -0.05 -0.64 0.01 0.00 -0.36 0.00 0.00 55.97 54.93 2ciq s LYS 138 Cb -0.14 -2.69 0.04 0.00 -1.51 0.00 0.00 37.83 33.53 2ciq s LYS 138 CO -0.02 0.25 -0.12 0.95 -0.36 0.00 0.00 175.35 176.05 2ciq s THR 139 N 0.27 1.74 0.13 3.43 -4.23 -0.54 -0.88 115.64 115.57 2ciq s THR 139 Ca -0.08 -1.04 0.08 0.00 -1.18 0.00 0.00 61.69 59.47 2ciq s THR 139 Cb -0.15 -1.78 -0.04 0.00 1.34 0.00 0.00 72.50 71.87 2ciq s THR 139 CO 0.05 0.21 -0.11 0.00 -0.54 0.00 0.00 174.62 174.23 2ciq s ALA 140 N 1.36 2.90 -0.02 3.99 0.00 0.21 -1.28 121.76 128.92 2ciq s ALA 140 Ca -0.01 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.64 2ciq s ALA 140 Cb -0.16 -0.80 0.00 0.00 0.00 0.00 0.00 23.12 22.16 2ciq s ALA 140 CO -0.09 0.58 -0.07 -1.50 0.00 0.00 0.00 175.76 174.68 2ciq s ILE 141 N -1.34 0.62 -0.07 0.00 1.10 -0.32 -0.32 121.20 120.87 2ciq s ILE 141 Ca 0.22 -0.28 0.04 0.00 -0.51 0.00 0.00 60.65 60.12 2ciq s ILE 141 Cb -0.10 -0.56 -0.00 0.00 0.15 0.00 0.00 42.46 41.94 2ciq s ILE 141 CO 0.13 0.20 -0.21 -0.70 -2.11 0.00 0.00 174.94 172.26 2ciq s GLU 142 N 0.17 2.42 -0.12 3.50 2.12 0.17 -1.55 118.70 125.42 2ciq s GLU 142 Ca -0.02 -0.74 0.00 0.00 0.36 0.00 0.00 54.97 54.57 2ciq s GLU 142 Cb -0.07 -1.95 -0.01 0.00 0.26 0.00 0.00 34.13 32.36 2ciq s GLU 142 CO 0.00 0.21 -0.14 0.08 -0.54 0.00 0.00 175.26 174.87 2ciq s VAL 143 N 0.22 2.94 -0.10 3.70 1.01 0.42 -1.29 120.40 127.30 2ciq s VAL 143 Ca -0.11 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.19 2ciq s VAL 143 Cb -0.15 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 2ciq s VAL 143 CO 0.05 0.53 -0.20 -0.70 0.00 0.00 0.00 175.10 174.78 2ciq s GLU 144 N 0.31 3.05 -0.68 2.72 2.12 0.16 -0.72 118.70 125.66 2ciq s GLU 144 Ca -0.11 -0.81 -0.24 0.00 0.36 0.00 0.00 54.97 54.16 2ciq s GLU 144 Cb -0.16 -2.39 0.06 0.00 0.26 0.00 0.00 34.13 31.90 2ciq s GLU 144 CO 0.06 0.25 1.06 1.21 -0.54 0.00 0.00 175.26 177.29 2ciq s ASN 145 N 0.21 6.17 0.00 -1.70 2.47 -0.31 -0.96 114.94 120.82 2ciq s ASN 145 Ca -0.12 -0.81 0.28 0.00 0.42 0.00 0.00 52.86 52.63 2ciq s ASN 145 Cb -0.16 -2.46 1.43 0.00 -1.45 0.00 0.00 41.25 38.61 2ciq s ASN 145 CO 0.07 -1.55 1.95 0.35 -3.72 0.00 0.00 177.10 174.19 2ciq n THR 146 N 6.07 0.02 -2.42 -5.21 -2.24 -1.26 -0.14 114.28 109.10 2ciq n THR 146 Ca -0.02 -0.12 -0.37 0.00 -2.27 0.00 0.00 64.05 61.28 2ciq n THR 146 Cb 0.47 -0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 2ciq n THR 146 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2ciq s SER 147 N -1.92 6.50 0.00 3.42 0.15 -1.26 -4.84 113.70 115.75 2ciq s SER 147 Ca 0.41 2.15 0.24 0.00 0.70 0.00 0.00 55.95 59.45 2ciq s SER 147 Cb 0.20 -2.59 0.26 0.00 -1.71 0.00 0.00 66.02 62.18 2ciq s SER 147 CO 0.33 -0.68 1.26 -1.54 1.20 0.00 0.00 173.24 173.82 2ciq n SER 148 N -0.26 1.96 0.00 5.45 3.41 -1.26 -2.64 113.62 120.28 2ciq n SER 148 Ca 0.06 -1.47 0.00 0.00 -0.26 0.00 0.00 58.87 57.20 2ciq n SER 148 Cb 0.49 0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 2ciq n SER 148 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ciq n SER 149 N 0.11 2.25 -4.60 4.04 3.41 -1.26 -4.87 113.62 112.70 2ciq n SER 149 Ca 0.11 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.38 2ciq n SER 149 Cb 0.46 0.27 -0.11 0.00 -0.26 0.00 0.00 64.21 64.57 2ciq n SER 149 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2ciq s LYS 150 N -1.34 2.89 0.56 4.33 1.02 -1.26 -4.92 119.74 121.01 2ciq s LYS 150 Ca 0.00 -0.51 -0.17 0.00 0.02 0.00 0.00 55.97 55.31 2ciq s LYS 150 Cb 0.00 -2.67 -0.05 0.00 -0.52 0.00 0.00 37.83 34.59 2ciq s LYS 150 CO 0.00 0.63 1.05 -1.83 -0.92 0.00 0.00 175.35 174.28 2ciq s GLU 151 N -0.71 3.50 -0.18 1.68 -1.05 -1.26 -4.12 118.70 116.55 2ciq s GLU 151 Ca 0.11 1.22 -0.02 0.00 -0.15 0.00 0.00 54.97 56.13 2ciq s GLU 151 Cb -0.11 -2.06 -0.01 0.00 -0.44 0.00 0.00 34.13 31.51 2ciq s GLU 151 CO 0.02 -0.66 -0.10 -1.17 0.95 0.00 0.00 175.26 174.29 2ciq s LEU 152 N -4.21 2.70 -0.19 1.83 2.96 0.02 -4.91 118.68 116.88 2ciq s LEU 152 Ca 0.64 -0.41 -0.02 0.00 -0.22 0.00 0.00 54.13 54.12 2ciq s LEU 152 Cb -0.15 -1.65 -0.00 0.00 0.50 0.00 0.00 46.19 44.89 2ciq s LEU 152 CO 0.32 0.06 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.55 2ciq s LYS 153 N 1.01 3.28 0.09 1.98 2.20 -1.26 -0.28 119.74 126.76 2ciq s LYS 153 Ca -0.01 -0.69 -0.26 0.00 -0.36 0.00 0.00 55.97 54.65 2ciq s LYS 153 Cb -0.15 -2.80 0.07 0.00 -1.51 0.00 0.00 37.83 33.45 2ciq s LYS 153 CO -0.01 -0.09 0.62 -0.59 -0.36 0.00 0.00 175.35 174.92 2ciq s PHE 154 N 1.13 -0.58 0.24 4.03 -0.12 -0.70 -4.96 117.98 117.03 2ciq s PHE 154 Ca 0.01 0.60 0.06 0.00 -0.05 0.00 0.00 56.93 57.55 2ciq s PHE 154 Cb -0.14 0.51 -0.03 0.00 -0.63 0.00 0.00 43.02 42.72 2ciq s PHE 154 CO -0.03 -0.77 0.26 -0.80 -0.05 0.00 0.00 175.22 173.83 2ciq s ASN 155 N -2.22 5.85 -0.03 1.98 0.02 0.53 -0.90 114.94 120.17 2ciq s ASN 155 Ca -0.03 -0.12 0.02 0.00 -1.02 0.00 0.00 52.86 51.71 2ciq s ASN 155 Cb -0.01 -1.59 0.01 0.00 0.02 0.00 0.00 41.25 39.68 2ciq s ASN 155 CO -0.05 -0.05 -0.06 0.86 0.02 0.00 0.00 177.10 177.82 2ciq s TRP 156 N -2.06 0.70 -0.08 2.20 -0.11 -1.12 -4.29 118.94 114.18 2ciq s TRP 156 Ca 0.33 -0.17 -0.11 0.00 1.22 0.00 0.00 56.10 57.38 2ciq s TRP 156 Cb -0.08 -0.55 0.02 0.00 -1.50 0.00 0.00 33.47 31.36 2ciq s TRP 156 CO 0.27 -0.11 0.28 -1.17 -4.62 0.00 0.00 176.95 171.59 2ciq s LEU 157 N 0.41 0.96 -0.30 5.86 0.20 -0.64 0.21 118.68 125.38 2ciq s LEU 157 Ca -0.05 0.42 -0.13 0.00 0.69 0.00 0.00 54.13 55.05 2ciq s LEU 157 Cb -0.09 1.00 -0.03 0.00 -0.43 0.00 0.00 46.19 46.64 2ciq s LEU 157 CO 0.00 -0.19 0.28 -0.36 -0.29 0.00 0.00 176.35 175.80 2ciq s PHE 158 N -0.25 3.23 -1.32 5.38 0.08 -0.64 -0.81 117.98 123.64 2ciq s PHE 158 Ca -0.04 0.12 -0.06 0.00 0.12 0.00 0.00 56.93 57.07 2ciq s PHE 158 Cb -0.03 -2.51 0.12 0.00 -0.57 0.00 0.00 43.02 40.03 2ciq s PHE 158 CO 0.01 -0.27 2.33 1.58 -0.10 0.00 0.00 175.22 178.77 2ciq n HIS 159 N 5.21 2.63 -2.26 0.36 -0.00 -0.21 -3.61 115.22 117.34 2ciq n HIS 159 Ca -0.11 -2.82 -0.42 0.00 0.46 0.00 0.00 57.72 54.82 2ciq n HIS 159 Cb 0.51 -1.85 -0.03 0.00 -0.12 0.00 0.00 29.99 28.50 2ciq n HIS 159 CO 0.00 0.00 0.00 0.99 0.46 0.00 0.00 176.34 177.79 2ciq s THR 160 N -0.95 3.91 -0.50 3.57 2.01 -1.26 -3.87 115.64 118.55 2ciq s THR 160 Ca 0.52 1.20 -0.16 0.00 0.31 0.00 0.00 61.69 63.56 2ciq s THR 160 Cb 0.17 -3.77 0.10 0.00 0.01 0.00 0.00 72.50 69.01 2ciq s THR 160 CO -0.08 -0.05 0.45 -0.31 -0.69 0.00 0.00 174.62 173.93 2ciq s TYR 161 N 3.03 3.24 0.24 4.92 2.02 -0.44 -2.59 117.35 127.76 2ciq s TYR 161 Ca 0.62 -1.06 -0.29 0.00 -0.37 0.00 0.00 57.07 55.96 2ciq s TYR 161 Cb -0.28 -3.44 -0.09 0.00 -0.40 0.00 0.00 41.96 37.75 2ciq s TYR 161 CO 0.23 -0.90 0.93 -0.06 -1.57 0.00 0.00 175.55 174.18 2ciq s PHE 162 N 1.66 3.96 -0.11 2.71 0.08 -0.35 -1.40 117.98 124.54 2ciq s PHE 162 Ca 0.04 1.89 -0.19 0.00 0.12 0.00 0.00 56.93 58.79 2ciq s PHE 162 Cb -0.26 -2.96 -0.04 0.00 -0.57 0.00 0.00 43.02 39.19 2ciq s PHE 162 CO 0.05 0.45 0.50 0.50 -0.10 0.00 0.00 175.22 176.62 2ciq s ARG 163 N -1.23 4.34 0.35 0.44 3.52 -0.39 -1.75 118.95 124.22 2ciq s ARG 163 Ca 0.41 0.50 0.03 0.00 -0.13 0.00 0.00 55.73 56.54 2ciq s ARG 163 Cb -0.25 -3.43 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 2ciq s ARG 163 CO 0.31 0.17 0.12 0.96 -0.81 0.00 0.00 175.30 176.06 2ciq s ILE 164 N 0.56 0.63 -0.09 4.11 -4.36 -0.29 -4.86 121.20 116.90 2ciq s ILE 164 Ca 0.27 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.56 2ciq s ILE 164 Cb -0.15 -2.51 -0.28 0.00 1.25 0.00 0.00 42.46 40.76 2ciq s ILE 164 CO 0.11 0.00 0.52 -0.33 0.24 0.00 0.00 174.94 175.48 2ciq h GLU 165 N 2.03 0.31 -1.27 0.37 5.08 -1.85 -3.40 114.58 115.86 2ciq h GLU 165 Ca -0.36 -0.54 0.02 0.00 -1.00 0.00 0.00 59.36 57.48 2ciq h GLU 165 Cb 1.26 0.20 -0.24 0.00 0.50 0.00 0.00 28.75 30.47 2ciq h GLU 165 CO 0.58 1.26 -0.33 0.34 -1.00 0.00 0.00 179.01 179.85 2ciq s ASP 166 N -7.15 -0.91 0.31 1.42 2.15 -1.19 -4.59 116.67 106.71 2ciq s ASP 166 Ca -0.19 0.68 0.03 0.00 0.43 0.00 0.00 52.55 53.49 2ciq s ASP 166 Cb 0.06 1.86 0.61 0.00 -0.30 0.00 0.00 42.92 45.14 2ciq s ASP 166 CO 0.80 -0.27 1.88 -0.29 -0.17 0.00 0.00 175.17 177.12 2ciq h ILE 167 N 6.05 0.97 0.00 4.11 6.09 -1.14 -1.58 117.51 132.01 2ciq h ILE 167 Ca -0.22 -0.32 -0.06 0.00 -1.37 0.00 0.00 64.86 62.89 2ciq h ILE 167 Cb 1.16 -0.04 -0.01 0.00 0.47 0.00 0.00 36.82 38.40 2ciq h ILE 167 CO 0.26 0.17 -0.29 -0.33 -3.07 0.00 0.00 178.15 174.89 2ciq h GLU 168 N 0.93 0.00 -0.67 2.19 5.08 -1.86 -2.16 114.58 118.09 2ciq h GLU 168 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 2ciq h GLU 168 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2ciq h GLU 168 CO -0.19 0.29 0.00 0.41 -1.00 0.00 0.00 179.01 178.52 2ciq n GLY 169 N -0.39 2.56 3.87 -3.84 0.00 -0.62 -4.68 105.19 102.09 2ciq n GLY 169 Ca -0.01 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 2ciq n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ciq s THR 170 N -1.64 5.16 0.14 2.61 2.01 -0.81 -4.46 115.64 118.65 2ciq s THR 170 Ca 0.50 -0.37 0.03 0.00 0.31 0.00 0.00 61.69 62.15 2ciq s THR 170 Cb 0.30 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.32 2ciq s THR 170 CO 0.26 0.24 -0.06 0.00 -0.69 0.00 0.00 174.62 174.37 2ciq s MET 171 N -2.16 1.02 -0.10 4.92 0.23 -0.68 -4.37 119.30 118.16 2ciq s MET 171 Ca 0.29 -1.45 0.03 0.00 -1.03 0.00 0.00 55.69 53.53 2ciq s MET 171 Cb -0.13 -0.40 0.01 0.00 -1.53 0.00 0.00 34.83 32.79 2ciq s MET 171 CO 0.21 -0.02 -0.19 0.08 -2.03 0.00 0.00 175.02 173.08 2ciq s VAL 172 N -3.51 1.72 0.25 5.16 1.01 -0.41 -0.76 120.40 123.86 2ciq s VAL 172 Ca 0.18 -0.80 0.10 0.00 0.00 0.00 0.00 61.98 61.46 2ciq s VAL 172 Cb 0.05 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 2ciq s VAL 172 CO 0.00 0.48 -0.08 -0.94 0.00 0.00 0.00 175.10 174.57 2ciq s SER 173 N 0.70 4.21 0.00 3.32 1.04 0.03 -0.66 113.70 122.33 2ciq s SER 173 Ca -0.12 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.57 2ciq s SER 173 Cb -0.16 -0.66 0.00 0.00 0.10 0.00 0.00 66.02 65.30 2ciq s SER 173 CO 0.03 0.03 0.00 -3.20 0.98 0.00 0.00 173.24 171.08 2ciq n ASN 174 N -0.63 -1.87 -0.64 7.02 4.05 -1.26 -2.19 115.26 119.73 2ciq n ASN 174 Ca -0.07 0.00 0.06 0.00 0.45 0.00 0.00 54.58 55.02 2ciq n ASN 174 Cb 0.59 -0.31 0.13 0.00 1.23 0.00 0.00 39.78 41.41 2ciq n ASN 174 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2ciq n LEU 175 N 0.00 2.67 -4.72 1.20 4.77 -1.26 -4.92 117.00 114.74 2ciq n LEU 175 Ca 0.00 -1.64 -0.42 0.00 -0.03 0.00 0.00 56.01 53.92 2ciq n LEU 175 Cb 0.00 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 40.90 2ciq n LEU 175 CO 0.00 0.62 1.27 0.00 -1.33 0.00 0.00 177.39 177.95 2ciq n ALA 176 N 0.66 2.44 -0.80 -1.18 0.00 -1.26 -2.19 120.51 118.17 2ciq n ALA 176 Ca 0.11 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.94 2ciq n ALA 176 Cb 0.40 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.39 2ciq n ALA 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ciq n GLY 177 N 2.95 0.92 3.84 0.00 0.00 0.15 -5.03 105.19 108.02 2ciq n GLY 177 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2ciq n GLY 177 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ciq s MET 178 N -0.19 4.05 0.30 1.61 1.00 -0.93 -4.74 119.30 120.41 2ciq s MET 178 Ca 0.00 0.78 -0.28 0.00 0.00 0.00 0.00 55.69 56.19 2ciq s MET 178 Cb 0.00 -2.36 -0.09 0.00 0.00 0.00 0.00 34.83 32.37 2ciq s MET 178 CO 0.00 0.10 1.03 0.21 0.00 0.00 0.00 175.02 176.36 2ciq s LYS 179 N -3.06 4.59 0.08 2.03 2.20 -1.26 -1.15 119.74 123.17 2ciq s LYS 179 Ca 0.56 1.60 0.02 0.00 -0.36 0.00 0.00 55.97 57.79 2ciq s LYS 179 Cb -0.10 -3.02 -0.04 0.00 -1.51 0.00 0.00 37.83 33.16 2ciq s LYS 179 CO 0.17 0.22 -0.07 -0.48 -0.36 0.00 0.00 175.35 174.83 2ciq s LEU 180 N -1.71 2.45 -0.23 5.43 0.05 -0.32 -0.91 118.68 123.43 2ciq s LEU 180 Ca 0.47 -0.89 -0.08 0.00 0.05 0.00 0.00 54.13 53.68 2ciq s LEU 180 Cb -0.27 -0.10 -0.03 0.00 -2.05 0.00 0.00 46.19 43.74 2ciq s LEU 180 CO 0.34 -0.40 0.08 -0.47 -0.55 0.00 0.00 176.35 175.35 2ciq s TYR 181 N -3.05 3.15 -0.46 3.48 5.04 0.14 -1.99 117.35 123.66 2ciq s TYR 181 Ca 0.06 -0.20 -0.19 0.00 -2.44 0.00 0.00 57.07 54.30 2ciq s TYR 181 Cb 0.01 -2.20 0.03 0.00 0.35 0.00 0.00 41.96 40.16 2ciq s TYR 181 CO -0.03 -0.17 0.58 0.34 -1.34 0.00 0.00 175.55 174.93 2ciq s ASP 182 N 1.21 6.26 0.39 4.32 -1.08 -0.11 -0.21 116.67 127.44 2ciq s ASP 182 Ca 0.05 -0.62 0.28 0.00 -0.52 0.00 0.00 52.55 51.74 2ciq s ASP 182 Cb -0.14 -2.28 1.15 0.00 -1.46 0.00 0.00 42.92 40.18 2ciq s ASP 182 CO 0.04 -0.77 1.83 1.56 0.52 0.00 0.00 175.17 178.35 2ciq h GLN 183 N 8.88 0.00 0.08 4.34 4.20 -1.19 0.28 115.11 131.70 2ciq h GLN 183 Ca -0.26 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.09 2ciq h GLN 183 Cb 1.10 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.85 2ciq h GLN 183 CO 0.89 0.00 -2.03 1.28 -0.67 0.00 0.00 178.83 178.30 2ciq n LEU 184 N -2.61 2.59 0.13 1.46 4.77 -1.25 -4.16 117.00 117.93 2ciq n LEU 184 Ca 0.01 0.17 0.12 0.00 -0.03 0.00 0.00 56.01 56.28 2ciq n LEU 184 Cb 0.26 -1.05 0.06 0.00 -2.33 0.00 0.00 43.42 40.37 2ciq n LEU 184 CO 0.23 0.80 0.27 -0.07 -1.33 0.00 0.00 177.39 177.29 2ciq h LEU 185 N -0.11 0.00 -1.46 2.23 3.38 -1.91 -3.49 115.31 113.96 2ciq h LEU 185 Ca -0.46 -0.02 -0.27 0.00 0.09 0.00 0.00 57.88 57.22 2ciq h LEU 185 Cb 1.91 0.00 0.13 0.00 0.09 0.00 0.00 40.66 42.79 2ciq h LEU 185 CO -0.00 0.01 -0.58 0.29 0.09 0.00 0.00 178.44 178.25 2ciq n LYS 186 N -2.74 -5.52 -3.71 1.13 5.02 0.95 -5.04 118.16 108.26 2ciq n LYS 186 Ca 0.01 0.66 -0.13 0.00 -2.02 0.00 0.00 58.31 56.83 2ciq n LYS 186 Cb 0.53 -5.14 -0.07 0.00 -0.02 0.00 0.00 35.03 30.33 2ciq n LYS 186 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2ciq s GLU 187 N -5.37 0.80 -0.03 1.97 -1.05 -1.12 -4.99 118.70 108.91 2ciq s GLU 187 Ca 0.15 -0.27 -0.07 0.00 -0.15 0.00 0.00 54.97 54.63 2ciq s GLU 187 Cb -0.06 0.36 -0.05 0.00 -0.44 0.00 0.00 34.13 33.94 2ciq s GLU 187 CO 0.57 -0.25 0.24 -1.12 0.95 0.00 0.00 175.26 175.65 2ciq s SER 188 N -1.66 6.48 0.16 0.83 0.01 -1.26 -0.94 113.70 117.32 2ciq s SER 188 Ca -0.09 0.54 -0.24 0.00 1.31 0.00 0.00 55.95 57.47 2ciq s SER 188 Cb -0.03 -2.09 0.06 0.00 0.21 0.00 0.00 66.02 64.18 2ciq s SER 188 CO 0.01 0.30 0.74 -0.72 0.41 0.00 0.00 173.24 173.98 2ciq s TYR 189 N -1.21 -0.35 0.08 2.43 -0.85 -0.84 -5.00 117.35 111.60 2ciq s TYR 189 Ca 0.24 0.08 -0.27 0.00 -0.52 0.00 0.00 57.07 56.60 2ciq s TYR 189 Cb -0.13 0.61 -0.06 0.00 0.38 0.00 0.00 41.96 42.76 2ciq s TYR 189 CO 0.13 -0.89 0.84 0.08 -1.52 0.00 0.00 175.55 174.19 2ciq s VAL 190 N -3.60 4.62 -0.53 -3.49 1.01 -1.26 -1.18 120.40 115.97 2ciq s VAL 190 Ca 0.06 1.80 -0.29 0.00 0.00 0.00 0.00 61.98 63.56 2ciq s VAL 190 Cb -0.02 -4.20 0.03 0.00 0.00 0.00 0.00 36.38 32.19 2ciq s VAL 190 CO -0.05 0.35 1.19 -0.62 0.00 0.00 0.00 175.10 175.98 2ciq s ASP 191 N -0.09 6.51 0.00 3.32 2.15 -0.30 -4.89 116.67 123.37 2ciq s ASP 191 Ca 0.42 0.31 0.26 0.00 0.43 0.00 0.00 52.55 53.96 2ciq s ASP 191 Cb -0.22 -2.55 0.61 0.00 -0.30 0.00 0.00 42.92 40.46 2ciq s ASP 191 CO 0.26 -1.39 1.48 0.29 -0.17 0.00 0.00 175.17 175.64 2ciq n LYS 192 N 8.17 0.23 -2.80 4.34 5.02 -1.26 0.34 118.16 132.19 2ciq n LYS 192 Ca 0.11 -0.13 -0.35 0.00 -2.02 0.00 0.00 58.31 55.92 2ciq n LYS 192 Cb 0.49 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.93 2ciq n LYS 192 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2ciq s HIS 193 N -2.86 3.46 0.14 2.13 3.76 -1.26 -4.74 115.29 115.92 2ciq s HIS 193 Ca 0.15 1.68 0.22 0.00 -0.15 0.00 0.00 55.06 56.96 2ciq s HIS 193 Cb 0.18 -2.88 0.84 0.00 1.11 0.00 0.00 32.58 31.83 2ciq s HIS 193 CO 0.64 0.01 1.79 -1.00 -0.85 0.00 0.00 174.74 175.34 2ciq h PRO 194 N 2.40 0.00 -4.12 8.40 0.13 -1.98 -3.38 132.00 133.44 2ciq h PRO 194 Ca -0.48 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.52 2ciq h PRO 194 Cb 1.18 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 2ciq h PRO 194 CO 0.63 0.27 -0.51 0.14 -0.23 0.00 0.00 178.00 178.29 2ciq s VAL 195 N -3.64 0.13 -0.19 1.56 -7.23 -1.26 -4.52 120.40 105.24 2ciq s VAL 195 Ca 0.00 -1.61 -0.15 0.00 -1.81 0.00 0.00 61.98 58.42 2ciq s VAL 195 Cb 0.10 -1.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.27 2ciq s VAL 195 CO 0.65 -0.57 0.35 -0.69 -0.31 0.00 0.00 175.10 174.52 2ciq s VAL 196 N -3.96 5.24 0.37 1.32 1.01 0.16 -4.92 120.40 119.63 2ciq s VAL 196 Ca 0.15 0.61 0.07 0.00 0.00 0.00 0.00 61.98 62.81 2ciq s VAL 196 Cb 0.06 -3.68 -0.07 0.00 0.00 0.00 0.00 36.38 32.69 2ciq s VAL 196 CO -0.04 0.30 -0.01 0.42 0.00 0.00 0.00 175.10 175.77 2ciq s THR 197 N 1.05 1.90 -0.06 3.92 -4.23 -1.26 -1.29 115.64 115.68 2ciq s THR 197 Ca 0.17 -2.05 0.02 0.00 -1.18 0.00 0.00 61.69 58.65 2ciq s THR 197 Cb -0.14 -2.86 0.02 0.00 1.34 0.00 0.00 72.50 70.86 2ciq s THR 197 CO 0.07 -0.06 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.64 2ciq s PHE 198 N -2.80 1.11 0.00 3.99 0.08 -1.26 -4.97 117.98 114.13 2ciq s PHE 198 Ca 0.34 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 57.01 2ciq s PHE 198 Cb 0.08 -0.88 0.00 0.00 -0.57 0.00 0.00 43.02 41.65 2ciq s PHE 198 CO 0.17 -0.24 0.31 0.27 -0.10 0.00 0.00 175.22 175.62 2ciq n ASN 199 N 3.98 0.00 -3.56 1.36 2.04 -1.26 -4.57 115.26 113.25 2ciq n ASN 199 Ca -0.23 -1.00 -0.03 0.00 -0.44 0.00 0.00 54.58 52.88 2ciq n ASN 199 Cb 0.51 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.76 2ciq n ASN 199 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2ciq s GLN 200 N 0.00 1.17 0.24 -3.83 -2.07 -1.26 -5.12 119.66 108.79 2ciq s GLN 200 Ca 0.00 -0.70 -0.31 0.00 -1.82 0.00 0.00 55.36 52.53 2ciq s GLN 200 Cb 0.00 0.36 -0.14 0.00 -1.09 0.00 0.00 33.01 32.14 2ciq s GLN 200 CO 0.00 -0.54 1.36 -1.91 -1.32 0.00 0.00 175.29 172.88 2ciq n GLU 201 N -0.58 1.93 -3.88 9.60 2.13 -1.26 -4.81 120.64 123.76 2ciq n GLU 201 Ca -0.05 0.69 -0.12 0.00 0.66 0.00 0.00 57.16 58.34 2ciq n GLU 201 Cb 0.60 -2.31 -0.13 0.00 0.27 0.00 0.00 31.44 29.87 2ciq n GLU 201 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2ciq s THR 202 N -0.19 0.02 -0.42 6.31 -1.32 -0.80 -4.99 115.64 114.25 2ciq s THR 202 Ca 0.67 -0.16 0.05 0.00 -1.21 0.00 0.00 61.69 61.05 2ciq s THR 202 Cb -0.66 -0.10 0.17 0.00 -1.51 0.00 0.00 72.50 70.40 2ciq s THR 202 CO 0.51 -0.09 0.51 -0.62 -2.21 0.00 0.00 174.62 172.73 2ciq s ASP 203 N -0.26 -0.07 0.11 8.08 -1.08 -1.24 -1.42 116.67 120.80 2ciq s ASP 203 Ca -0.03 -1.61 0.08 0.00 -0.52 0.00 0.00 52.55 50.48 2ciq s ASP 203 Cb -0.02 1.09 -0.04 0.00 -1.46 0.00 0.00 42.92 42.49 2ciq s ASP 203 CO -0.00 -0.18 -0.21 0.68 0.52 0.00 0.00 175.17 175.98 2ciq s VAL 204 N 1.23 1.75 -0.35 1.11 -7.23 -0.55 -0.66 120.40 115.70 2ciq s VAL 204 Ca 0.22 -1.57 0.03 0.00 -1.81 0.00 0.00 61.98 58.84 2ciq s VAL 204 Cb -0.07 -1.60 0.10 0.00 0.56 0.00 0.00 36.38 35.38 2ciq s VAL 204 CO -0.06 -0.06 0.07 -0.63 -0.31 0.00 0.00 175.10 174.11 2ciq s ILE 205 N -1.20 2.40 0.52 -0.62 1.01 0.71 -0.34 121.20 123.67 2ciq s ILE 205 Ca 0.07 -2.35 -0.20 0.00 0.00 0.00 0.00 60.65 58.17 2ciq s ILE 205 Cb -0.10 -2.75 -0.07 0.00 0.01 0.00 0.00 42.46 39.55 2ciq s ILE 205 CO 0.04 -0.62 1.08 -0.31 0.00 0.00 0.00 174.94 175.14 2ciq s TYR 206 N 0.88 2.83 0.22 3.97 2.02 0.69 -0.68 117.35 127.28 2ciq s TYR 206 Ca 0.11 1.56 0.08 0.00 -0.37 0.00 0.00 57.07 58.44 2ciq s TYR 206 Cb -0.20 -3.18 -0.05 0.00 -0.40 0.00 0.00 41.96 38.14 2ciq s TYR 206 CO -0.07 -1.20 -0.13 -0.65 -1.57 0.00 0.00 175.55 171.93 2ciq s GLN 207 N -3.26 1.38 -1.12 -0.62 -0.21 -0.09 -1.22 119.66 114.52 2ciq s GLN 207 Ca 0.70 -1.63 -0.07 0.00 0.02 0.00 0.00 55.36 54.38 2ciq s GLN 207 Cb -0.20 -1.13 0.01 0.00 1.00 0.00 0.00 33.01 32.69 2ciq s GLN 207 CO 0.23 0.16 0.94 0.09 -2.12 0.00 0.00 175.29 174.60 2ciq n ASN 208 N -0.42 -5.59 -4.57 5.90 5.03 -0.61 -4.50 115.26 110.49 2ciq n ASN 208 Ca -0.07 -0.43 -0.40 0.00 0.87 0.00 0.00 54.58 54.54 2ciq n ASN 208 Cb 0.61 -4.21 -0.09 0.00 -1.02 0.00 0.00 39.78 35.07 2ciq n ASN 208 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2ciq s VAL 209 N -3.25 5.12 0.56 2.41 1.01 0.46 -5.05 120.40 121.66 2ciq s VAL 209 Ca 0.47 0.34 0.04 0.00 0.00 0.00 0.00 61.98 62.84 2ciq s VAL 209 Cb -0.21 -3.83 0.06 0.00 0.00 0.00 0.00 36.38 32.41 2ciq s VAL 209 CO 0.58 -0.04 0.78 -0.94 0.00 0.00 0.00 175.10 175.48 2ciq s SER 210 N 1.70 5.11 0.42 3.32 1.04 -1.26 -4.13 113.70 119.91 2ciq s SER 210 Ca 0.15 -0.40 0.27 0.00 0.48 0.00 0.00 55.95 56.45 2ciq s SER 210 Cb -0.16 -0.34 1.45 0.00 0.10 0.00 0.00 66.02 67.07 2ciq s SER 210 CO 0.11 -1.26 1.80 0.00 0.98 0.00 0.00 173.24 174.88 2ciq h ALA 211 N 0.10 1.04 0.00 5.32 0.00 -1.94 -2.29 119.26 121.49 2ciq h ALA 211 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2ciq h ALA 211 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2ciq h ALA 211 CO 0.45 -0.04 -0.49 0.39 0.00 0.00 0.00 179.25 179.56 2ciq n GLU 212 N -2.47 0.13 -3.48 0.00 -0.58 -1.26 -4.71 120.64 108.27 2ciq n GLU 212 Ca -0.02 0.04 -0.43 0.00 -0.42 0.00 0.00 57.16 56.34 2ciq n GLU 212 Cb 0.10 -1.59 -0.06 0.00 -0.57 0.00 0.00 31.44 29.31 2ciq n GLU 212 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 2ciq s ARG 213 N -3.08 2.86 0.29 3.49 3.52 -0.86 -5.05 118.95 120.12 2ciq s ARG 213 Ca 0.09 -2.05 -0.28 0.00 -0.13 0.00 0.00 55.73 53.36 2ciq s ARG 213 Cb 0.16 -4.09 -0.09 0.00 -1.56 0.00 0.00 34.95 29.36 2ciq s ARG 213 CO 0.69 -1.24 0.95 0.00 -0.81 0.00 0.00 175.30 174.89 2ciq s ALA 214 N 0.88 3.27 -0.13 6.12 0.00 -1.26 -4.75 121.76 125.89 2ciq s ALA 214 Ca 0.10 0.58 -0.03 0.00 0.00 0.00 0.00 51.96 52.61 2ciq s ALA 214 Cb -0.22 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 2ciq s ALA 214 CO -0.03 0.17 -0.02 0.42 0.00 0.00 0.00 175.76 176.30 2ciq s ILE 215 N -1.42 4.07 -0.06 0.00 1.01 -0.57 -4.72 121.20 119.52 2ciq s ILE 215 Ca 0.46 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.83 2ciq s ILE 215 Cb -0.22 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 2ciq s ILE 215 CO 0.28 0.53 -0.12 -1.10 0.00 0.00 0.00 174.94 174.53 2ciq s GLN 216 N -0.08 2.59 -0.21 2.79 -1.52 -0.93 -1.21 119.66 121.09 2ciq s GLN 216 Ca 0.03 -0.64 -0.07 0.00 -1.95 0.00 0.00 55.36 52.72 2ciq s GLN 216 Cb -0.13 -2.45 -0.04 0.00 -0.22 0.00 0.00 33.01 30.17 2ciq s GLN 216 CO 0.02 0.64 0.06 0.42 -0.25 0.00 0.00 175.29 176.18 2ciq s ILE 217 N -0.75 4.53 -0.03 1.08 1.01 -0.18 -0.79 121.20 126.07 2ciq s ILE 217 Ca 0.12 -0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.72 2ciq s ILE 217 Cb -0.11 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.28 2ciq s ILE 217 CO 0.01 0.40 -0.25 -0.69 0.00 0.00 0.00 174.94 174.41 2ciq s VAL 218 N 0.93 2.02 -0.06 2.92 1.01 0.06 -0.77 120.40 126.52 2ciq s VAL 218 Ca 0.04 -1.08 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 2ciq s VAL 218 Cb -0.14 -1.68 0.04 0.00 0.00 0.00 0.00 36.38 34.59 2ciq s VAL 218 CO 0.03 0.57 0.13 -0.62 0.00 0.00 0.00 175.10 175.20 2ciq s ASP 219 N -0.45 -0.08 -1.52 3.32 2.15 -0.15 -1.68 116.67 118.25 2ciq s ASP 219 Ca 0.05 0.26 -0.04 0.00 0.43 0.00 0.00 52.55 53.25 2ciq s ASP 219 Cb -0.11 0.15 0.03 0.00 -0.30 0.00 0.00 42.92 42.69 2ciq s ASP 219 CO 0.01 -0.14 0.31 0.29 -0.17 0.00 0.00 175.17 175.47 2ciq n LYS 220 N 4.14 -2.24 -0.39 4.34 5.02 -1.26 -0.96 118.16 126.82 2ciq n LYS 220 Ca -0.26 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2ciq n LYS 220 Cb 0.52 -4.25 0.00 0.00 -0.02 0.00 0.00 35.03 31.28 2ciq n LYS 220 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ciq n GLY 221 N -2.09 1.30 3.76 0.72 0.00 -1.26 -4.99 105.19 102.63 2ciq n GLY 221 Ca -0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 2ciq n GLY 221 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ciq s VAL 222 N -2.56 5.42 -0.56 1.61 1.01 -0.13 -5.05 120.40 120.14 2ciq s VAL 222 Ca 0.00 0.22 -0.27 0.00 0.00 0.00 0.00 61.98 61.93 2ciq s VAL 222 Cb 0.00 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 2ciq s VAL 222 CO 0.00 0.47 1.78 -1.10 0.00 0.00 0.00 175.10 176.25 2ciq s GLN 223 N 0.09 2.85 0.10 2.72 -0.21 -1.26 -0.98 119.66 122.97 2ciq s GLN 223 Ca 0.10 0.72 0.23 0.00 0.02 0.00 0.00 55.36 56.43 2ciq s GLN 223 Cb -0.11 -4.32 0.05 0.00 1.00 0.00 0.00 33.01 29.63 2ciq s GLN 223 CO -0.00 -2.46 1.03 0.44 -2.12 0.00 0.00 175.29 172.17 2ciq n ILE 224 N 7.19 0.33 -3.77 1.08 -5.35 0.05 -4.90 119.36 113.99 2ciq n ILE 224 Ca 0.19 -0.37 -0.13 0.00 -0.27 0.00 0.00 62.75 62.17 2ciq n ILE 224 Cb 0.51 -0.05 -0.10 0.00 -1.74 0.00 0.00 39.64 38.25 2ciq n ILE 224 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 2ciq s HIS 225 N -3.28 -0.27 -0.05 4.28 3.76 -1.10 -4.74 115.29 113.89 2ciq s HIS 225 Ca 0.02 0.60 0.04 0.00 -0.15 0.00 0.00 55.06 55.57 2ciq s HIS 225 Cb 0.13 0.10 -0.00 0.00 1.11 0.00 0.00 32.58 33.91 2ciq s HIS 225 CO 0.79 -0.23 -0.17 0.99 -0.85 0.00 0.00 174.74 175.28 2ciq s THR 226 N -0.35 1.40 -0.14 1.30 2.01 -0.09 -1.01 115.64 118.76 2ciq s THR 226 Ca -0.05 -0.69 0.01 0.00 0.31 0.00 0.00 61.69 61.28 2ciq s THR 226 Cb -0.03 -1.21 0.02 0.00 0.01 0.00 0.00 72.50 71.29 2ciq s THR 226 CO 0.02 0.40 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.95 2ciq s LEU 227 N 0.10 1.89 0.29 4.42 2.96 -0.35 -0.89 118.68 127.10 2ciq s LEU 227 Ca -0.05 -0.53 0.11 0.00 -0.22 0.00 0.00 54.13 53.44 2ciq s LEU 227 Cb -0.12 -1.29 -0.05 0.00 0.50 0.00 0.00 46.19 45.23 2ciq s LEU 227 CO 0.02 0.01 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.35 2ciq s LYS 228 N 1.15 1.68 0.15 1.98 1.02 -0.15 -1.51 119.74 124.07 2ciq s LYS 228 Ca -0.01 -1.79 -0.11 0.00 0.02 0.00 0.00 55.97 54.08 2ciq s LYS 228 Cb -0.14 -1.70 0.00 0.00 -0.52 0.00 0.00 37.83 35.48 2ciq s LYS 228 CO -0.07 0.28 0.33 -0.98 -0.92 0.00 0.00 175.35 173.99 2ciq s ARG 229 N -3.54 1.14 -0.07 1.68 3.03 -1.26 -0.53 118.95 119.40 2ciq s ARG 229 Ca 0.30 -1.03 0.02 0.00 2.03 0.00 0.00 55.73 57.04 2ciq s ARG 229 Cb -0.03 0.41 0.02 0.00 -1.03 0.00 0.00 34.95 34.31 2ciq s ARG 229 CO 0.15 -0.43 -0.10 -0.47 -1.13 0.00 0.00 175.30 173.32 2ciq s TYR 230 N -3.92 1.29 -1.18 5.89 5.04 -0.25 -4.07 117.35 120.16 2ciq s TYR 230 Ca 0.12 -0.48 0.00 0.00 -2.44 0.00 0.00 57.07 54.27 2ciq s TYR 230 Cb 0.03 -0.99 0.00 0.00 0.35 0.00 0.00 41.96 41.34 2ciq s TYR 230 CO -0.03 -0.29 0.00 -1.71 -1.34 0.00 0.00 175.55 172.18 2ciq n ASN 231 N 4.03 -4.24 -3.64 4.32 5.15 -1.26 -1.95 115.26 117.67 2ciq n ASN 231 Ca -0.22 -0.01 -0.29 0.00 -0.60 0.00 0.00 54.58 53.46 2ciq n ASN 231 Cb 0.51 -3.40 -0.13 0.00 -0.53 0.00 0.00 39.78 36.23 2ciq n ASN 231 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2ciq s LEU 232 N -3.92 1.97 0.04 1.20 1.43 -1.26 -4.83 118.68 113.30 2ciq s LEU 232 Ca 0.00 -2.15 0.26 0.00 -1.03 0.00 0.00 54.13 51.21 2ciq s LEU 232 Cb 0.00 -0.77 1.06 0.00 0.03 0.00 0.00 46.19 46.51 2ciq s LEU 232 CO 0.00 -0.33 1.82 -0.81 0.23 0.00 0.00 176.35 177.26 2ciq n PRO 233 N 4.14 0.04 -4.15 1.29 -0.04 -1.07 -4.41 135.00 130.80 2ciq n PRO 233 Ca 0.06 0.09 -0.27 0.00 -0.04 0.00 0.00 63.50 63.33 2ciq n PRO 233 Cb 0.38 -1.55 -0.07 0.00 -0.04 0.00 0.00 33.50 32.21 2ciq n PRO 233 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ciq s ASP 234 N -3.25 5.09 -0.11 3.54 1.01 -0.12 -0.41 116.67 122.43 2ciq s ASP 234 Ca 0.12 -0.26 -0.02 0.00 0.71 0.00 0.00 52.55 53.11 2ciq s ASP 234 Cb 0.16 -1.20 0.04 0.00 1.01 0.00 0.00 42.92 42.93 2ciq s ASP 234 CO 0.49 0.10 0.01 -0.89 0.21 0.00 0.00 175.17 175.09 2ciq s THR 235 N -1.65 0.44 -0.03 -1.27 2.01 -0.36 -1.03 115.64 113.75 2ciq s THR 235 Ca 0.28 -0.11 -0.26 0.00 0.31 0.00 0.00 61.69 61.92 2ciq s THR 235 Cb -0.10 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 2ciq s THR 235 CO 0.20 0.11 0.80 -0.69 -0.69 0.00 0.00 174.62 174.35 2ciq s VAL 236 N 1.93 4.95 -0.20 3.82 1.01 0.01 -0.22 120.40 131.70 2ciq s VAL 236 Ca 0.03 1.68 -0.02 0.00 0.00 0.00 0.00 61.98 63.67 2ciq s VAL 236 Cb -0.14 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.10 2ciq s VAL 236 CO -0.06 0.23 -0.10 -0.69 0.00 0.00 0.00 175.10 174.48 2ciq s VAL 237 N 0.79 2.95 -0.02 2.92 1.01 0.54 -0.74 120.40 127.85 2ciq s VAL 237 Ca 0.43 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.77 2ciq s VAL 237 Cb -0.19 -2.31 0.02 0.00 0.00 0.00 0.00 36.38 33.90 2ciq s VAL 237 CO 0.22 0.47 -0.02 0.86 0.00 0.00 0.00 175.10 176.63 2ciq s TRP 238 N 1.29 0.35 -0.03 5.22 -0.00 -0.52 -1.48 118.94 123.78 2ciq s TRP 238 Ca 0.04 -0.04 -0.01 0.00 -0.00 0.00 0.00 56.10 56.09 2ciq s TRP 238 Cb -0.14 -0.36 0.03 0.00 -0.00 0.00 0.00 33.47 32.99 2ciq s TRP 238 CO -0.05 -0.09 0.05 1.21 -0.00 0.00 0.00 176.95 178.07 2ciq s ASN 239 N 0.65 0.03 0.43 5.86 3.84 -0.51 -1.71 114.94 123.53 2ciq s ASN 239 Ca -0.07 0.09 0.23 0.00 0.21 0.00 0.00 52.86 53.32 2ciq s ASN 239 Cb -0.10 -0.01 0.92 0.00 -0.55 0.00 0.00 41.25 41.51 2ciq s ASN 239 CO -0.01 -0.13 1.83 1.55 -2.79 0.00 0.00 177.10 177.56 2ciq h PRO 240 N 7.22 0.00 0.00 0.43 0.13 -1.93 -2.13 132.00 135.72 2ciq h PRO 240 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2ciq h PRO 240 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2ciq h PRO 240 CO 0.47 0.26 0.00 1.87 -0.23 0.00 0.00 178.00 180.37 2ciq n TRP 241 N -3.49 -1.02 0.22 1.56 -0.00 -1.26 -3.77 117.44 109.68 2ciq n TRP 241 Ca -0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.50 57.36 2ciq n TRP 241 Cb 0.42 0.19 -0.07 0.00 -0.00 0.00 0.00 31.31 31.85 2ciq n TRP 241 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 2ciq h ILE 242 N 0.00 0.45 -0.14 5.87 2.04 -1.95 -2.78 117.51 121.00 2ciq h ILE 242 Ca 0.00 -0.51 -0.05 0.00 1.00 0.00 0.00 64.86 65.30 2ciq h ILE 242 Cb 0.00 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2ciq h ILE 242 CO 0.00 0.07 -0.12 -0.33 0.00 0.00 0.00 178.15 177.78 2ciq h GLU 243 N -0.93 0.32 -0.82 2.37 4.39 -1.96 -2.32 114.58 115.63 2ciq h GLU 243 Ca -0.06 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.44 2ciq h GLU 243 Cb 0.57 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.18 2ciq h GLU 243 CO 0.10 0.70 0.34 0.87 -1.16 0.00 0.00 179.01 179.86 2ciq h LYS 244 N -0.05 1.21 -0.56 2.33 1.79 -1.70 -2.56 116.57 117.03 2ciq h LYS 244 Ca 0.02 -0.21 0.03 0.00 -2.18 0.00 0.00 60.65 58.32 2ciq h LYS 244 Cb 0.63 -0.20 -0.04 0.00 -1.58 0.00 0.00 32.23 31.04 2ciq h LYS 244 CO 0.03 0.97 0.33 0.77 -1.08 0.00 0.00 179.45 180.46 2ciq h SER 245 N 1.18 0.52 -0.84 0.86 0.02 -1.42 -2.31 113.55 111.57 2ciq h SER 245 Ca 0.27 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.33 2ciq h SER 245 Cb 0.19 -0.10 -0.07 0.00 0.14 0.00 0.00 62.40 62.56 2ciq h SER 245 CO -0.03 0.36 0.49 -0.61 -1.14 0.00 0.00 176.83 175.90 2ciq h GLN 246 N 0.65 0.79 0.00 3.45 5.75 -1.09 -2.72 115.11 121.93 2ciq h GLN 246 Ca 0.23 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.68 2ciq h GLN 246 Cb 0.05 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 28.42 2ciq h GLN 246 CO -0.11 0.52 -0.04 0.78 -2.65 0.00 0.00 178.83 177.33 2ciq h GLY 247 N 0.81 0.00 -6.69 2.39 0.00 -1.03 -3.43 103.07 95.12 2ciq h GLY 247 Ca 0.40 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 47.15 2ciq h GLY 247 CO -0.25 0.00 0.76 1.06 0.00 0.00 0.00 176.54 178.11 2ciq s MET 248 N -3.48 3.68 0.39 4.80 -1.94 -0.98 -4.92 119.30 116.85 2ciq s MET 248 Ca 0.03 0.44 0.06 0.00 -1.71 0.00 0.00 55.69 54.52 2ciq s MET 248 Cb 0.08 -3.90 0.81 0.00 2.01 0.00 0.00 34.83 33.83 2ciq s MET 248 CO 0.60 -1.25 2.04 0.00 -0.01 0.00 0.00 175.02 176.40 2ciq h ALA 249 N 9.03 1.69 -0.70 3.03 0.00 -1.86 -1.76 119.26 128.70 2ciq h ALA 249 Ca -0.23 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2ciq h ALA 249 Cb 1.07 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2ciq h ALA 249 CO 1.07 0.28 0.00 -0.40 0.00 0.00 0.00 179.25 180.20 2ciq n ASP 250 N -4.47 4.50 -4.53 0.00 5.75 -1.26 -4.84 116.55 111.70 2ciq n ASP 250 Ca 0.05 -2.27 -0.41 0.00 -0.01 0.00 0.00 54.79 52.14 2ciq n ASP 250 Cb 0.08 -0.55 -0.09 0.00 -1.03 0.00 0.00 41.12 39.53 2ciq n ASP 250 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2ciq s PHE 251 N -1.52 3.19 0.01 2.11 5.36 -0.66 -3.61 117.98 122.85 2ciq s PHE 251 Ca 0.51 -0.06 -0.10 0.00 -0.96 0.00 0.00 56.93 56.32 2ciq s PHE 251 Cb 0.31 -2.80 0.01 0.00 -0.34 0.00 0.00 43.02 40.20 2ciq s PHE 251 CO 0.29 -0.53 0.20 -1.21 -1.46 0.00 0.00 175.22 172.51 2ciq s GLU 252 N 2.15 0.59 0.96 10.12 0.41 -1.26 -4.48 118.70 127.19 2ciq s GLU 252 Ca 0.14 -0.41 -0.12 0.00 -0.41 0.00 0.00 54.97 54.17 2ciq s GLU 252 Cb -0.16 0.25 0.17 0.00 -1.78 0.00 0.00 34.13 32.60 2ciq s GLU 252 CO 0.13 -0.16 1.09 -1.25 -0.49 0.00 0.00 175.26 174.58 2ciq s PRO 253 N -1.70 0.74 0.45 0.39 0.04 -1.26 -1.73 135.00 131.92 2ciq s PRO 253 Ca -0.12 0.71 0.31 0.00 0.04 0.00 0.00 61.00 61.93 2ciq s PRO 253 Cb -0.05 -1.76 1.35 0.00 0.04 0.00 0.00 34.50 34.08 2ciq s PRO 253 CO 0.01 -2.57 1.91 0.87 0.04 0.00 0.00 177.00 177.26 2ciq h LYS 254 N -1.78 0.00 -0.16 4.56 1.79 -1.92 0.13 116.57 119.18 2ciq h LYS 254 Ca -0.52 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.95 2ciq h LYS 254 Cb 1.31 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.96 2ciq h LYS 254 CO 0.55 0.00 0.00 0.25 -1.08 0.00 0.00 179.45 179.17 2ciq n THR 255 N -2.72 0.20 0.31 -0.16 -2.24 -1.26 -4.36 114.28 104.05 2ciq n THR 255 Ca 0.01 -0.30 0.17 0.00 -2.27 0.00 0.00 64.05 61.66 2ciq n THR 255 Cb 0.23 0.25 0.77 0.00 -2.10 0.00 0.00 70.33 69.48 2ciq n THR 255 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2ciq h GLY 256 N 5.12 0.00 2.00 3.38 0.00 -1.06 -0.26 103.07 112.25 2ciq h GLY 256 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ciq h GLY 256 CO 0.00 0.00 -0.00 0.10 0.00 0.00 0.00 176.54 176.64 2ciq h TYR 257 N 0.00 0.00 0.00 5.60 -0.00 -1.79 -1.31 116.97 119.47 2ciq h TYR 257 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2ciq h TYR 257 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.05 2ciq h TYR 257 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 178.16 180.12 2ciq h GLN 258 N 0.00 0.00 -0.26 0.10 4.20 -1.39 -3.18 115.11 114.58 2ciq h GLN 258 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2ciq h GLN 258 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2ciq h GLN 258 CO 0.00 0.00 0.00 1.04 -0.67 0.00 0.00 178.83 179.20 2ciq n GLN 259 N -2.47 2.82 -4.02 1.46 3.00 -0.49 -0.62 117.38 117.06 2ciq n GLN 259 Ca 0.03 -2.47 -0.10 0.00 -0.01 0.00 0.00 57.00 54.45 2ciq n GLN 259 Cb 0.34 -1.57 -0.11 0.00 0.00 0.00 0.00 30.24 28.90 2ciq n GLN 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2ciq s MET 260 N -2.07 0.41 -0.04 -1.09 0.23 -1.20 -1.13 119.30 114.40 2ciq s MET 260 Ca 0.33 -0.72 -0.02 0.00 -1.03 0.00 0.00 55.69 54.25 2ciq s MET 260 Cb 0.24 0.01 0.03 0.00 -1.53 0.00 0.00 34.83 33.59 2ciq s MET 260 CO 0.11 -0.03 0.09 -1.50 -2.03 0.00 0.00 175.02 171.66 2ciq s ILE 261 N -1.73 -0.05 -0.21 3.16 1.10 -0.72 -4.86 121.20 117.90 2ciq s ILE 261 Ca -0.12 0.19 -0.18 0.00 -0.51 0.00 0.00 60.65 60.04 2ciq s ILE 261 Cb -0.08 -0.16 -0.03 0.00 0.15 0.00 0.00 42.46 42.33 2ciq s ILE 261 CO -0.02 0.08 0.49 0.00 -2.11 0.00 0.00 174.94 173.38 2ciq s ILE 263 N 1.67 1.14 -0.33 0.00 1.01 -1.07 -1.44 121.20 122.18 2ciq s ILE 263 Ca 0.22 -1.11 0.03 0.00 0.00 0.00 0.00 60.65 59.79 2ciq s ILE 263 Cb -0.15 -1.59 0.10 0.00 0.01 0.00 0.00 42.46 40.83 2ciq s ILE 263 CO 0.09 -0.27 0.06 -1.61 0.00 0.00 0.00 174.94 173.21 2ciq s GLU 264 N 1.55 1.30 0.29 2.79 2.02 0.08 -4.34 118.70 122.40 2ciq s GLU 264 Ca -0.01 -1.66 -0.29 0.00 0.02 0.00 0.00 54.97 53.04 2ciq s GLU 264 Cb -0.18 -2.89 -0.10 0.00 0.10 0.00 0.00 34.13 31.06 2ciq s GLU 264 CO -0.10 -0.94 1.14 -1.25 0.02 0.00 0.00 175.26 174.13 2ciq s PRO 265 N 1.09 4.57 0.21 0.39 0.04 -1.24 -0.81 135.00 139.26 2ciq s PRO 265 Ca 0.10 1.88 -0.21 0.00 0.04 0.00 0.00 61.00 62.81 2ciq s PRO 265 Cb -0.19 -3.15 0.07 0.00 0.04 0.00 0.00 34.50 31.27 2ciq s PRO 265 CO -0.12 0.13 1.00 0.20 0.04 0.00 0.00 177.00 178.25 2ciq s GLY 266 N -0.81 0.15 -0.43 0.56 0.00 -0.20 -1.62 107.32 104.97 2ciq s GLY 266 Ca 0.46 -0.40 0.03 0.00 0.00 0.00 0.00 44.72 44.81 2ciq s GLY 266 CO 0.43 2.04 0.17 -1.58 0.00 0.00 0.00 173.10 174.17 2ciq s HIS 267 N -2.20 3.13 0.00 1.90 2.46 0.13 -0.94 115.29 119.78 2ciq s HIS 267 Ca 0.21 -2.92 0.00 0.00 0.47 0.00 0.00 55.06 52.82 2ciq s HIS 267 Cb -0.03 -2.66 0.00 0.00 -0.13 0.00 0.00 32.58 29.76 2ciq s HIS 267 CO 0.06 -0.83 0.00 1.33 -2.47 0.00 0.00 174.74 172.83 2ciq n VAL 268 N 3.69 0.00 0.22 0.89 0.24 -1.26 -2.81 118.33 119.29 2ciq n VAL 268 Ca 0.05 -0.15 0.06 0.00 -2.04 0.00 0.00 64.34 62.26 2ciq n VAL 268 Cb 0.37 0.90 0.50 0.00 -1.47 0.00 0.00 33.84 34.14 2ciq n VAL 268 CO 0.00 0.00 0.00 1.12 -2.14 0.00 0.00 176.83 175.81 2ciq h HIS 269 N 0.00 0.00 -3.86 6.34 2.07 -1.97 -3.45 115.15 114.29 2ciq h HIS 269 Ca 0.00 0.00 -0.20 0.00 -2.85 0.00 0.00 60.37 57.32 2ciq h HIS 269 Cb 0.00 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 29.91 2ciq h HIS 269 CO 0.00 0.25 -0.10 0.16 -3.07 0.00 0.00 177.93 175.17 2ciq s ASP 270 N -6.69 0.61 0.13 3.10 1.47 -1.26 -5.16 116.67 108.86 2ciq s ASP 270 Ca -0.03 -1.35 -0.17 0.00 1.18 0.00 0.00 52.55 52.19 2ciq s ASP 270 Cb 0.14 0.69 -0.07 0.00 -0.34 0.00 0.00 42.92 43.34 2ciq s ASP 270 CO 0.67 -1.35 0.58 -0.36 0.68 0.00 0.00 175.17 175.39 2ciq s PHE 271 N -3.06 3.69 0.14 2.11 0.08 -1.26 -4.79 117.98 114.89 2ciq s PHE 271 Ca 0.27 1.18 -0.30 0.00 0.12 0.00 0.00 56.93 58.20 2ciq s PHE 271 Cb -0.01 -2.45 -0.07 0.00 -0.57 0.00 0.00 43.02 39.92 2ciq s PHE 271 CO 0.17 0.48 1.04 0.42 -0.10 0.00 0.00 175.22 177.24 2ciq s ILE 272 N -1.33 4.16 -0.27 0.64 1.01 -0.07 -4.87 121.20 120.47 2ciq s ILE 272 Ca 0.35 1.81 -0.00 0.00 0.00 0.00 0.00 60.65 62.81 2ciq s ILE 272 Cb -0.17 -4.16 0.05 0.00 0.01 0.00 0.00 42.46 38.19 2ciq s ILE 272 CO 0.19 0.29 -0.06 -0.55 0.00 0.00 0.00 174.94 174.81 2ciq s SER 273 N 0.01 4.54 -0.24 3.58 0.15 -1.26 -1.72 113.70 118.76 2ciq s SER 273 Ca 0.49 -1.19 -0.08 0.00 0.70 0.00 0.00 55.95 55.87 2ciq s SER 273 Cb -0.27 -1.64 -0.03 0.00 -1.71 0.00 0.00 66.02 62.37 2ciq s SER 273 CO 0.32 -0.20 0.08 -0.22 1.20 0.00 0.00 173.24 174.43 2ciq s LEU 274 N 1.22 3.59 0.78 3.45 2.96 0.62 -4.90 118.68 126.40 2ciq s LEU 274 Ca -0.05 -0.12 -0.13 0.00 -0.22 0.00 0.00 54.13 53.62 2ciq s LEU 274 Cb -0.19 -1.95 0.07 0.00 0.50 0.00 0.00 46.19 44.62 2ciq s LEU 274 CO -0.04 0.01 1.16 0.00 -1.32 0.00 0.00 176.35 176.16 2ciq s ALA 275 N 1.34 2.01 0.30 5.97 0.00 -1.26 -0.80 121.76 129.31 2ciq s ALA 275 Ca 0.05 0.65 -0.29 0.00 0.00 0.00 0.00 51.96 52.38 2ciq s ALA 275 Cb -0.15 -3.41 -0.13 0.00 0.00 0.00 0.00 23.12 19.43 2ciq s ALA 275 CO 0.04 -2.03 1.23 -2.30 0.00 0.00 0.00 175.76 172.70 2ciq n PRO 276 N -3.24 1.84 -0.05 0.00 -0.02 -1.26 -1.77 135.00 130.50 2ciq n PRO 276 Ca 0.12 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2ciq n PRO 276 Cb 0.51 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2ciq n PRO 276 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ciq n GLY 277 N 1.25 2.58 3.91 -1.23 0.00 0.81 -4.98 105.19 107.53 2ciq n GLY 277 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 2ciq n GLY 277 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ciq s LYS 278 N -0.01 3.55 0.12 1.61 -0.14 -0.73 -4.75 119.74 119.40 2ciq s LYS 278 Ca 0.00 0.12 0.09 0.00 -1.36 0.00 0.00 55.97 54.83 2ciq s LYS 278 Cb 0.00 -2.43 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 2ciq s LYS 278 CO 0.00 -0.13 -0.23 0.15 -0.76 0.00 0.00 175.35 174.38 2ciq s LYS 279 N -4.59 1.25 0.01 1.68 1.02 -1.26 -1.16 119.74 116.68 2ciq s LYS 279 Ca 0.46 -1.26 0.04 0.00 0.02 0.00 0.00 55.97 55.23 2ciq s LYS 279 Cb -0.10 -1.59 -0.01 0.00 -0.52 0.00 0.00 37.83 35.60 2ciq s LYS 279 CO 0.42 0.37 -0.12 -0.46 -0.92 0.00 0.00 175.35 174.64 2ciq s TRP 280 N -1.20 1.08 0.05 3.18 -0.00 0.10 -4.99 118.94 117.16 2ciq s TRP 280 Ca 0.10 -0.25 -0.05 0.00 -0.00 0.00 0.00 56.10 55.90 2ciq s TRP 280 Cb -0.10 -0.68 -0.01 0.00 -0.00 0.00 0.00 33.47 32.68 2ciq s TRP 280 CO 0.05 -0.00 0.09 0.54 -0.00 0.00 0.00 176.95 177.63 2ciq s ASN 281 N -0.56 0.21 0.27 5.86 4.22 -1.26 -0.43 114.94 123.24 2ciq s ASN 281 Ca 0.03 -0.60 -0.21 0.00 -2.14 0.00 0.00 52.86 49.94 2ciq s ASN 281 Cb -0.06 0.24 0.03 0.00 1.28 0.00 0.00 41.25 42.74 2ciq s ASN 281 CO 0.00 -0.55 0.75 0.00 -2.04 0.00 0.00 177.10 175.26 2ciq s ALA 282 N -2.93 -1.25 0.17 3.54 0.00 -0.59 -4.80 121.76 115.90 2ciq s ALA 282 Ca -0.02 -0.28 -0.17 0.00 0.00 0.00 0.00 51.96 51.48 2ciq s ALA 282 Cb 0.01 0.82 0.03 0.00 0.00 0.00 0.00 23.12 23.98 2ciq s ALA 282 CO -0.06 -1.04 0.48 1.52 0.00 0.00 0.00 175.76 176.66 2ciq s TYR 283 N -3.77 -0.16 0.18 0.00 -0.85 -0.82 -1.18 117.35 110.75 2ciq s TYR 283 Ca 0.11 -0.16 0.11 0.00 -0.52 0.00 0.00 57.07 56.61 2ciq s TYR 283 Cb -0.05 0.35 -0.04 0.00 0.38 0.00 0.00 41.96 42.59 2ciq s TYR 283 CO 0.07 -0.84 -0.22 1.14 -1.52 0.00 0.00 175.55 174.18 2ciq s GLN 284 N -3.84 1.58 -0.09 -3.49 -2.07 -0.40 -1.09 119.66 110.26 2ciq s GLN 284 Ca 0.07 -1.46 -0.01 0.00 -1.82 0.00 0.00 55.36 52.13 2ciq s GLN 284 Cb 0.00 -1.90 0.03 0.00 -1.09 0.00 0.00 33.01 30.05 2ciq s GLN 284 CO -0.07 0.41 -0.02 -1.17 -1.32 0.00 0.00 175.29 173.13 2ciq s LEU 285 N -2.61 0.79 -0.15 2.60 2.96 0.31 -1.46 118.68 121.12 2ciq s LEU 285 Ca 0.20 -0.18 -0.05 0.00 -0.22 0.00 0.00 54.13 53.89 2ciq s LEU 285 Cb -0.08 -0.56 -0.03 0.00 0.50 0.00 0.00 46.19 46.01 2ciq s LEU 285 CO 0.10 -0.18 0.02 -0.76 -1.32 0.00 0.00 176.35 174.21 2ciq s LEU 286 N 1.89 3.62 0.00 -0.68 1.43 0.36 -0.97 118.68 124.32 2ciq s LEU 286 Ca 0.05 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 2ciq s LEU 286 Cb -0.13 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.22 2ciq s LEU 286 CO -0.06 0.24 0.00 0.00 0.23 0.00 0.00 176.35 176.75