#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cim s TRP 5 N 0.00 2.04 0.00 4.41 1.48 -1.26 -4.85 118.94 120.76 1cim s TRP 5 Ca 0.00 1.53 0.00 0.00 -1.06 0.00 0.00 56.10 56.57 1cim s TRP 5 Cb 0.00 -3.62 0.00 0.00 -1.16 0.00 0.00 33.47 28.69 1cim s TRP 5 CO 0.00 -2.83 0.00 0.41 -4.06 0.00 0.00 176.95 170.47 1cim n GLY 6 N 0.74 3.56 0.13 3.67 0.00 -0.12 -5.02 105.19 108.16 1cim n GLY 6 Ca 0.15 -0.33 0.02 0.00 0.00 0.00 0.00 46.02 45.86 1cim n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1cim n TYR 7 N 0.00 0.00 -1.97 1.61 4.01 -1.26 -3.92 117.16 115.63 1cim n TYR 7 Ca 0.00 -0.28 -0.16 0.00 -0.16 0.00 0.00 57.90 57.30 1cim n TYR 7 Cb 0.00 -0.05 0.10 0.00 -0.31 0.00 0.00 39.34 39.08 1cim n TYR 7 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1cim n GLY 8 N -0.35 -0.40 0.34 2.72 0.00 -1.26 -4.70 105.19 101.54 1cim n GLY 8 Ca 0.03 -1.84 0.01 0.00 0.00 0.00 0.00 46.02 44.22 1cim n GLY 8 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cim h LYS 9 N 0.00 0.95 0.00 1.61 6.56 -1.98 -0.17 116.57 123.54 1cim h LYS 9 Ca -0.23 -0.06 -0.02 0.00 -1.06 0.00 0.00 60.65 59.28 1cim h LYS 9 Cb 0.71 -0.21 -0.00 0.00 -0.57 0.00 0.00 32.23 32.16 1cim h LYS 9 CO 0.19 0.64 -1.20 0.72 -2.06 0.00 0.00 179.45 177.74 1cim n HIS 10 N -4.42 0.82 -1.02 -1.35 8.25 -1.26 -4.41 115.22 111.84 1cim n HIS 10 Ca 0.08 0.24 0.02 0.00 -0.26 0.00 0.00 57.72 57.80 1cim n HIS 10 Cb 0.04 -0.90 0.03 0.00 1.12 0.00 0.00 29.99 30.28 1cim n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1cim n ASN 11 N -2.63 0.96 -2.81 0.41 6.94 -1.18 -4.94 115.26 112.01 1cim n ASN 11 Ca -0.02 -1.92 -0.12 0.00 -0.02 0.00 0.00 54.58 52.51 1cim n ASN 11 Cb 0.58 -0.14 0.09 0.00 -2.36 0.00 0.00 39.78 37.95 1cim n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cim n GLY 12 N -0.41 -1.60 0.33 4.83 0.00 -0.08 -0.94 105.19 107.31 1cim n GLY 12 Ca 0.03 -1.63 0.09 0.00 0.00 0.00 0.00 46.02 44.51 1cim n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1cim h PRO 13 N 0.00 0.72 0.00 1.61 0.11 -1.84 0.95 132.00 133.55 1cim h PRO 13 Ca -0.17 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1cim h PRO 13 Cb 0.49 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.44 1cim h PRO 13 CO 0.12 0.48 0.00 -0.85 -0.21 0.00 0.00 178.00 177.54 1cim n GLU 14 N -4.79 0.08 -0.00 1.05 0.00 -1.26 -1.65 120.64 114.07 1cim n GLU 14 Ca 0.20 0.43 0.09 0.00 0.00 0.00 0.00 57.16 57.88 1cim n GLU 14 Cb 0.47 -1.69 -0.11 0.00 0.00 0.00 0.00 31.44 30.11 1cim n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1cim n HIS 15 N -1.85 0.00 0.23 -1.84 8.25 0.33 -4.62 115.22 115.71 1cim n HIS 15 Ca 0.01 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.57 1cim n HIS 15 Cb 0.12 -0.01 0.57 0.00 1.12 0.00 0.00 29.99 31.79 1cim n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1cim h TRP 16 N 0.00 0.00 -0.47 4.41 6.55 -1.31 -2.70 115.95 122.43 1cim h TRP 16 Ca 0.00 0.00 0.05 0.00 0.95 0.00 0.00 58.89 59.89 1cim h TRP 16 Cb 0.46 0.00 -0.03 0.00 -0.86 0.00 0.00 29.16 28.73 1cim h TRP 16 CO 0.00 0.21 0.31 1.12 -1.05 0.00 0.00 178.44 179.04 1cim h HIS 17 N 0.00 0.43 -0.49 0.49 2.07 -1.78 0.66 115.15 116.53 1cim h HIS 17 Ca -0.00 0.01 -0.01 0.00 -2.85 0.00 0.00 60.37 57.52 1cim h HIS 17 Cb 0.51 -0.14 -0.02 0.00 2.57 0.00 0.00 27.41 30.32 1cim h HIS 17 CO 0.00 0.24 0.28 0.87 -3.07 0.00 0.00 177.93 176.24 1cim h LYS 18 N 0.43 0.67 0.00 5.12 1.57 -1.83 -2.53 116.57 119.99 1cim h LYS 18 Ca 0.20 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.76 1cim h LYS 18 Cb 0.25 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1cim h LYS 18 CO -0.05 0.49 -2.07 -0.25 -0.57 0.00 0.00 179.45 176.99 1cim n ASP 19 N -4.42 0.47 -3.79 0.86 8.00 -0.84 -4.71 116.55 112.12 1cim n ASP 19 Ca 0.04 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.26 1cim n ASP 19 Cb 0.09 1.45 -0.12 0.00 -0.02 0.00 0.00 41.12 42.52 1cim n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1cim s PHE 20 N -2.93 2.88 0.63 1.24 0.08 0.17 -4.98 117.98 115.07 1cim s PHE 20 Ca -0.08 -3.03 0.33 0.00 0.12 0.00 0.00 56.93 54.27 1cim s PHE 20 Cb 0.09 -2.29 1.83 0.00 -0.57 0.00 0.00 43.02 42.08 1cim s PHE 20 CO 0.79 -0.65 2.10 -1.00 -0.10 0.00 0.00 175.22 176.37 1cim h PRO 21 N 5.71 0.00 0.00 0.24 0.13 -1.70 0.37 132.00 136.75 1cim h PRO 21 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1cim h PRO 21 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1cim h PRO 21 CO 0.62 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.90 1cim n ILE 22 N -3.36 1.30 0.32 -3.56 3.06 -1.26 -2.50 119.36 113.35 1cim n ILE 22 Ca -0.00 0.46 0.17 0.00 -2.50 0.00 0.00 62.75 60.87 1cim n ILE 22 Cb 0.30 -1.39 0.87 0.00 0.54 0.00 0.00 39.64 39.96 1cim n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1cim h ALA 23 N 2.16 1.34 -0.66 1.51 0.00 -1.24 0.22 119.26 122.59 1cim h ALA 23 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1cim h ALA 23 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1cim h ALA 23 CO 0.00 -0.30 0.00 1.63 0.00 0.00 0.00 179.25 180.58 1cim n LYS 24 N -2.98 3.29 0.00 0.00 4.76 -1.04 -4.96 118.16 117.22 1cim n LYS 24 Ca -0.02 -2.76 0.00 0.00 -2.87 0.00 0.00 58.31 52.66 1cim n LYS 24 Cb 0.35 -1.73 0.00 0.00 -1.84 0.00 0.00 35.03 31.81 1cim n LYS 24 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1cim n GLY 25 N 1.27 -1.50 0.14 0.72 0.00 0.77 -5.03 105.19 101.56 1cim n GLY 25 Ca 0.25 -1.54 -0.21 0.00 0.00 0.00 0.00 46.02 44.51 1cim n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1cim h GLU 26 N 0.00 0.35 -2.26 1.61 4.39 -1.96 -3.40 114.58 113.32 1cim h GLU 26 Ca 0.00 -0.60 -0.59 0.00 0.34 0.00 0.00 59.36 58.51 1cim h GLU 26 Cb 0.00 0.22 -0.42 0.00 -0.10 0.00 0.00 28.75 28.46 1cim h GLU 26 CO 0.00 1.26 -0.66 2.89 -1.16 0.00 0.00 179.01 181.34 1cim n ARG 27 N -3.55 3.03 -3.08 2.33 1.85 -1.26 -4.77 116.66 111.22 1cim n ARG 27 Ca -0.23 -4.77 -0.31 0.00 -1.00 0.00 0.00 57.85 51.54 1cim n ARG 27 Cb 1.07 -2.21 -0.04 0.00 -1.05 0.00 0.00 32.46 30.23 1cim n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1cim s GLN 28 N -3.28 3.79 0.20 2.89 -1.52 -1.26 -2.57 119.66 117.91 1cim s GLN 28 Ca 0.47 0.38 0.08 0.00 -1.95 0.00 0.00 55.36 54.35 1cim s GLN 28 Cb 0.26 -2.49 -0.05 0.00 -0.22 0.00 0.00 33.01 30.52 1cim s GLN 28 CO -0.12 0.10 -0.15 -1.12 -0.25 0.00 0.00 175.29 173.75 1cim s SER 29 N -2.89 2.62 1.14 5.90 0.01 -1.26 -4.71 113.70 114.51 1cim s SER 29 Ca 0.50 -0.99 -0.19 0.00 1.31 0.00 0.00 55.95 56.58 1cim s SER 29 Cb -0.10 -0.14 0.27 0.00 0.21 0.00 0.00 66.02 66.25 1cim s SER 29 CO 0.27 -0.14 1.21 -2.16 0.41 0.00 0.00 173.24 172.83 1cim s PRO 30 N -3.46 -0.74 0.08 12.44 0.04 -1.26 -4.62 135.00 137.48 1cim s PRO 30 Ca 0.21 -0.30 -0.03 0.00 0.04 0.00 0.00 61.00 60.92 1cim s PRO 30 Cb -0.02 -1.67 -0.03 0.00 0.04 0.00 0.00 34.50 32.82 1cim s PRO 30 CO 0.07 -3.35 0.06 0.14 0.04 0.00 0.00 177.00 173.96 1cim s VAL 31 N -3.38 0.17 0.09 -0.36 -7.23 -1.26 -0.61 120.40 107.81 1cim s VAL 31 Ca 0.73 -1.66 -0.28 0.00 -1.81 0.00 0.00 61.98 58.96 1cim s VAL 31 Cb -0.06 -1.62 -0.06 0.00 0.56 0.00 0.00 36.38 35.21 1cim s VAL 31 CO 0.55 -0.76 0.90 -0.62 -0.31 0.00 0.00 175.10 174.86 1cim s ASP 32 N -2.94 7.40 -0.48 4.85 2.15 -1.26 -3.22 116.67 123.17 1cim s ASP 32 Ca 0.11 1.68 -0.19 0.00 0.43 0.00 0.00 52.55 54.58 1cim s ASP 32 Cb 0.07 -2.55 0.05 0.00 -0.30 0.00 0.00 42.92 40.19 1cim s ASP 32 CO -0.07 -0.04 0.58 -0.63 -0.17 0.00 0.00 175.17 174.84 1cim s ILE 33 N 0.01 4.93 -0.51 4.11 1.01 0.27 -4.93 121.20 126.09 1cim s ILE 33 Ca 0.44 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 60.38 1cim s ILE 33 Cb -0.22 -4.24 0.03 0.00 0.01 0.00 0.00 42.46 38.04 1cim s ILE 33 CO 0.28 -0.71 0.99 -0.62 0.00 0.00 0.00 174.94 174.88 1cim s ASP 34 N 2.48 6.46 0.50 3.58 -1.08 -1.26 -0.95 116.67 126.39 1cim s ASP 34 Ca 0.15 0.01 0.27 0.00 -0.52 0.00 0.00 52.55 52.45 1cim s ASP 34 Cb -0.19 -2.47 1.33 0.00 -1.46 0.00 0.00 42.92 40.13 1cim s ASP 34 CO 0.12 -1.19 2.01 0.71 0.52 0.00 0.00 175.17 177.35 1cim h THR 35 N 6.09 0.55 -0.04 1.71 1.35 -1.95 -2.00 112.91 118.62 1cim h THR 35 Ca -0.25 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 1cim h THR 35 Cb 1.07 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 1cim h THR 35 CO 1.08 0.14 0.00 1.41 -0.25 0.00 0.00 175.52 177.90 1cim n HIS 36 N -3.56 0.05 -0.27 4.73 8.25 -1.26 -3.81 115.22 119.34 1cim n HIS 36 Ca -0.01 -0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1cim n HIS 36 Cb 0.29 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.40 1cim n HIS 36 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1cim n THR 37 N -0.22 0.00 -2.48 1.59 -1.04 -0.81 -5.02 114.28 106.30 1cim n THR 37 Ca 0.19 -0.30 -0.40 0.00 -2.04 0.00 0.00 64.05 61.50 1cim n THR 37 Cb 0.25 1.27 -0.04 0.00 -1.82 0.00 0.00 70.33 69.99 1cim n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1cim s ALA 38 N -0.19 3.40 -0.21 2.41 0.00 -0.84 -4.78 121.76 121.55 1cim s ALA 38 Ca 0.00 0.88 -0.12 0.00 0.00 0.00 0.00 51.96 52.72 1cim s ALA 38 Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1cim s ALA 38 CO 0.00 -0.17 0.23 0.21 0.00 0.00 0.00 175.76 176.03 1cim s LYS 39 N -1.15 4.14 0.09 0.00 2.20 -0.23 -4.80 119.74 119.98 1cim s LYS 39 Ca 0.46 -0.11 -0.31 0.00 -0.36 0.00 0.00 55.97 55.65 1cim s LYS 39 Cb -0.31 -3.50 -0.09 0.00 -1.51 0.00 0.00 37.83 32.41 1cim s LYS 39 CO 0.39 0.10 1.78 -0.47 -0.36 0.00 0.00 175.35 176.80 1cim s TYR 40 N 0.92 2.11 -0.31 4.03 5.04 -1.26 -0.49 117.35 127.38 1cim s TYR 40 Ca 0.11 0.04 0.03 0.00 -2.44 0.00 0.00 57.07 54.81 1cim s TYR 40 Cb -0.13 -4.11 0.09 0.00 0.35 0.00 0.00 41.96 38.16 1cim s TYR 40 CO 0.04 -4.60 0.01 0.34 -1.34 0.00 0.00 175.55 170.00 1cim s ASP 41 N 2.88 4.62 0.16 4.32 2.15 -0.54 -4.86 116.67 125.40 1cim s ASP 41 Ca 0.79 -1.90 0.17 0.00 0.43 0.00 0.00 52.55 52.05 1cim s ASP 41 Cb -0.43 -1.56 0.77 0.00 -0.30 0.00 0.00 42.92 41.41 1cim s ASP 41 CO 0.35 -0.33 1.53 -0.81 -0.17 0.00 0.00 175.17 175.74 1cim n PRO 42 N 4.34 0.10 0.00 4.34 -0.04 -1.26 -1.79 135.00 140.69 1cim n PRO 42 Ca -0.02 0.44 0.14 0.00 -0.04 0.00 0.00 63.50 64.02 1cim n PRO 42 Cb 0.42 -1.74 0.66 0.00 -0.04 0.00 0.00 33.50 32.80 1cim n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1cim n SER 43 N -1.94 0.71 -4.67 3.54 3.41 -1.26 -4.82 113.62 108.60 1cim n SER 43 Ca 0.01 -1.00 -0.43 0.00 -0.26 0.00 0.00 58.87 57.20 1cim n SER 43 Cb 0.14 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.05 1cim n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1cim s LEU 44 N -2.20 4.19 0.68 1.04 1.43 -0.74 -5.02 118.68 118.05 1cim s LEU 44 Ca 0.36 1.63 -0.15 0.00 -1.03 0.00 0.00 54.13 54.94 1cim s LEU 44 Cb 0.21 -3.54 0.01 0.00 0.03 0.00 0.00 46.19 42.90 1cim s LEU 44 CO 0.41 -0.68 1.13 -0.54 0.23 0.00 0.00 176.35 176.90 1cim s LYS 45 N 3.06 2.61 0.62 1.70 1.02 -1.25 -4.97 119.74 122.52 1cim s LYS 45 Ca 0.52 1.48 -0.18 0.00 0.02 0.00 0.00 55.97 57.81 1cim s LYS 45 Cb -0.20 -1.92 -0.02 0.00 -0.52 0.00 0.00 37.83 35.17 1cim s LYS 45 CO 0.14 -1.42 1.21 -1.25 -0.92 0.00 0.00 175.35 173.11 1cim s PRO 46 N -4.06 2.84 0.44 -1.68 0.04 -1.26 -2.78 135.00 128.53 1cim s PRO 46 Ca 0.69 1.81 -0.24 0.00 0.04 0.00 0.00 61.00 63.30 1cim s PRO 46 Cb -0.23 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.32 1cim s PRO 46 CO 0.43 -1.31 1.20 -0.51 0.04 0.00 0.00 177.00 176.84 1cim s LEU 47 N -4.26 4.08 -0.25 -3.56 1.43 -1.26 -1.96 118.68 112.90 1cim s LEU 47 Ca 0.77 2.39 0.01 0.00 -1.03 0.00 0.00 54.13 56.28 1cim s LEU 47 Cb -0.30 -4.13 0.06 0.00 0.03 0.00 0.00 46.19 41.85 1cim s LEU 47 CO 0.35 -0.88 -0.05 -0.55 0.23 0.00 0.00 176.35 175.46 1cim s SER 48 N -1.18 4.05 -0.41 2.29 0.15 0.03 -4.87 113.70 113.76 1cim s SER 48 Ca 0.61 -1.31 -0.09 0.00 0.70 0.00 0.00 55.95 55.86 1cim s SER 48 Cb -0.31 -1.28 0.07 0.00 -1.71 0.00 0.00 66.02 62.79 1cim s SER 48 CO 0.39 -0.24 0.24 -0.69 1.20 0.00 0.00 173.24 174.14 1cim s VAL 49 N 1.31 4.27 -0.66 4.45 1.01 -1.26 -1.24 120.40 128.27 1cim s VAL 49 Ca -0.05 -1.30 -0.08 0.00 0.00 0.00 0.00 61.98 60.55 1cim s VAL 49 Cb -0.19 -3.57 0.17 0.00 0.00 0.00 0.00 36.38 32.79 1cim s VAL 49 CO -0.07 -0.45 0.52 -0.44 0.00 0.00 0.00 175.10 174.67 1cim s SER 50 N 2.00 5.82 -0.01 3.32 0.01 -0.30 -4.89 113.70 119.65 1cim s SER 50 Ca 0.03 -2.61 0.12 0.00 1.31 0.00 0.00 55.95 54.79 1cim s SER 50 Cb -0.22 -2.00 0.33 0.00 0.21 0.00 0.00 66.02 64.34 1cim s SER 50 CO 0.03 -0.50 1.28 -1.22 0.41 0.00 0.00 173.24 173.24 1cim n TYR 51 N 3.93 0.52 0.27 2.43 4.01 -1.26 -1.67 117.16 125.39 1cim n TYR 51 Ca 0.06 -0.52 0.15 0.00 -0.16 0.00 0.00 57.90 57.44 1cim n TYR 51 Cb 0.41 -0.04 0.75 0.00 -0.31 0.00 0.00 39.34 40.15 1cim n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1cim h ASP 52 N 2.14 0.00 -0.40 7.72 2.03 -1.90 -2.66 116.42 123.35 1cim h ASP 52 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1cim h ASP 52 Cb 0.78 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.28 1cim h ASP 52 CO 0.01 0.09 0.00 0.00 -1.03 0.00 0.00 179.24 178.31 1cim n GLN 53 N -3.40 2.23 -1.72 4.15 3.00 -1.24 -5.01 117.38 115.40 1cim n GLN 53 Ca -0.01 -1.88 -0.43 0.00 -0.01 0.00 0.00 57.00 54.67 1cim n GLN 53 Cb 0.26 -1.45 -0.01 0.00 0.00 0.00 0.00 30.24 29.03 1cim n GLN 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1cim n ALA 54 N 1.06 1.69 -3.99 -1.58 0.00 -1.01 -4.61 120.51 112.08 1cim n ALA 54 Ca 0.18 0.37 -0.31 0.00 0.00 0.00 0.00 53.44 53.68 1cim n ALA 54 Cb 0.49 -2.33 -0.15 0.00 0.00 0.00 0.00 19.45 17.46 1cim n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1cim s THR 55 N -0.70 2.12 0.35 0.00 2.01 -1.26 -4.91 115.64 113.25 1cim s THR 55 Ca 0.59 -2.21 -0.22 0.00 0.31 0.00 0.00 61.69 60.15 1cim s THR 55 Cb -0.55 -2.56 -0.10 0.00 0.01 0.00 0.00 72.50 69.30 1cim s THR 55 CO 0.58 -0.59 0.91 -0.94 -0.69 0.00 0.00 174.62 173.89 1cim s SER 56 N 0.99 7.10 0.00 3.53 1.04 -1.26 -1.47 113.70 123.63 1cim s SER 56 Ca 0.10 1.69 0.00 0.00 0.48 0.00 0.00 55.95 58.22 1cim s SER 56 Cb -0.19 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.40 1cim s SER 56 CO -0.10 -0.18 0.00 0.18 0.98 0.00 0.00 173.24 174.12 1cim n LEU 57 N 0.02 1.64 -3.89 2.42 4.77 0.19 -3.83 117.00 118.33 1cim n LEU 57 Ca 0.04 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.92 1cim n LEU 57 Cb 0.52 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 1cim n LEU 57 CO 0.41 0.27 -0.15 -0.13 -1.33 0.00 0.00 177.39 176.46 1cim s ARG 58 N -1.99 0.67 0.05 3.23 0.52 -1.21 -1.03 118.95 119.19 1cim s ARG 58 Ca 0.00 -0.75 0.06 0.00 -0.52 0.00 0.00 55.73 54.53 1cim s ARG 58 Cb 0.00 0.27 -0.02 0.00 0.52 0.00 0.00 34.95 35.72 1cim s ARG 58 CO 0.00 -0.19 -0.18 -1.50 0.02 0.00 0.00 175.30 173.45 1cim s ILE 59 N -2.83 1.46 -0.09 1.52 2.07 -0.88 -1.03 121.20 121.42 1cim s ILE 59 Ca -0.03 -1.15 -0.10 0.00 -1.41 0.00 0.00 60.65 57.95 1cim s ILE 59 Cb 0.00 -1.29 0.03 0.00 0.13 0.00 0.00 42.46 41.33 1cim s ILE 59 CO -0.05 0.11 0.28 -0.22 -1.91 0.00 0.00 174.94 173.14 1cim s LEU 60 N -1.22 0.95 -0.24 8.50 2.96 -0.18 -1.91 118.68 127.53 1cim s LEU 60 Ca 0.05 0.45 -0.10 0.00 -0.22 0.00 0.00 54.13 54.31 1cim s LEU 60 Cb -0.09 1.00 -0.05 0.00 0.50 0.00 0.00 46.19 47.56 1cim s LEU 60 CO 0.02 -0.17 0.15 0.21 -1.32 0.00 0.00 176.35 175.24 1cim s ASN 61 N -0.16 6.05 -0.03 3.68 3.84 -0.62 -1.07 114.94 126.63 1cim s ASN 61 Ca -0.03 0.10 0.11 0.00 0.21 0.00 0.00 52.86 53.25 1cim s ASN 61 Cb -0.03 -2.09 0.33 0.00 -0.55 0.00 0.00 41.25 38.91 1cim s ASN 61 CO 0.01 0.07 1.27 -0.46 -2.79 0.00 0.00 177.10 175.20 1cim n ASN 62 N 4.26 3.05 0.00 -4.21 0.23 -0.79 -1.15 115.26 116.64 1cim n ASN 62 Ca -0.15 -2.18 0.00 0.00 -0.53 0.00 0.00 54.58 51.72 1cim n ASN 62 Cb 0.52 -0.28 0.00 0.00 -2.08 0.00 0.00 39.78 37.94 1cim n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1cim n GLY 63 N 0.29 3.39 0.00 4.83 0.00 -1.26 -4.76 105.19 107.68 1cim n GLY 63 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1cim n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1cim n HIS 64 N -1.89 0.00 -3.90 1.61 1.44 -1.26 -4.65 115.22 106.57 1cim n HIS 64 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1cim n HIS 64 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 1cim n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1cim n ALA 65 N -0.90 -2.50 -2.49 1.59 0.00 -1.26 -4.85 120.51 110.10 1cim n ALA 65 Ca 0.00 -0.68 -0.32 0.00 0.00 0.00 0.00 53.44 52.44 1cim n ALA 65 Cb 0.00 0.24 -0.14 0.00 0.00 0.00 0.00 19.45 19.55 1cim n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1cim s PHE 66 N -2.55 2.59 0.01 0.00 -0.71 -1.26 -1.89 117.98 114.16 1cim s PHE 66 Ca 0.21 -0.31 0.03 0.00 -1.04 0.00 0.00 56.93 55.83 1cim s PHE 66 Cb -0.01 -1.61 -0.03 0.00 -1.21 0.00 0.00 43.02 40.16 1cim s PHE 66 CO 0.01 0.07 -0.07 -0.80 -1.34 0.00 0.00 175.22 173.10 1cim s ASN 67 N -0.59 4.63 -0.24 1.98 0.02 -0.24 -4.31 114.94 116.20 1cim s ASN 67 Ca 0.08 -0.15 -0.07 0.00 -1.02 0.00 0.00 52.86 51.70 1cim s ASN 67 Cb -0.11 -1.07 -0.03 0.00 0.02 0.00 0.00 41.25 40.06 1cim s ASN 67 CO 0.01 0.28 0.06 -0.69 0.02 0.00 0.00 177.10 176.78 1cim s VAL 68 N -1.01 4.34 0.01 1.60 1.01 -0.44 -1.02 120.40 124.89 1cim s VAL 68 Ca 0.17 -0.17 -0.00 0.00 0.00 0.00 0.00 61.98 61.98 1cim s VAL 68 Cb -0.11 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1cim s VAL 68 CO 0.08 0.36 0.11 -1.61 0.00 0.00 0.00 175.10 174.04 1cim s GLU 69 N 1.44 3.14 0.16 2.72 2.02 -0.20 -1.70 118.70 126.29 1cim s GLU 69 Ca 0.05 -0.47 0.10 0.00 0.02 0.00 0.00 54.97 54.67 1cim s GLU 69 Cb -0.15 -2.90 -0.04 0.00 0.10 0.00 0.00 34.13 31.14 1cim s GLU 69 CO 0.03 0.64 -0.21 -0.06 0.02 0.00 0.00 175.26 175.68 1cim s PHE 70 N -1.26 2.02 -0.23 1.61 0.40 0.41 -0.63 117.98 120.30 1cim s PHE 70 Ca 0.25 -0.41 -0.29 0.00 -0.60 0.00 0.00 56.93 55.88 1cim s PHE 70 Cb -0.12 -1.03 -0.01 0.00 0.51 0.00 0.00 43.02 42.37 1cim s PHE 70 CO 0.17 0.37 1.36 0.34 0.70 0.00 0.00 175.22 178.16 1cim s ASP 71 N -2.49 6.71 -0.28 1.36 -1.08 -0.54 -4.82 116.67 115.53 1cim s ASP 71 Ca 0.16 1.48 0.08 0.00 -0.52 0.00 0.00 52.55 53.75 1cim s ASP 71 Cb -0.08 -2.54 0.45 0.00 -1.46 0.00 0.00 42.92 39.30 1cim s ASP 71 CO 0.07 -1.00 1.25 -0.90 0.52 0.00 0.00 175.17 175.12 1cim n ASP 72 N 7.41 3.95 -0.03 -0.34 5.75 -1.26 -4.71 116.55 127.32 1cim n ASP 72 Ca 0.15 -3.80 0.13 0.00 -0.01 0.00 0.00 54.79 51.26 1cim n ASP 72 Cb 0.46 -0.44 0.35 0.00 -1.03 0.00 0.00 41.12 40.45 1cim n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1cim n SER 73 N -0.87 0.48 -3.68 -1.12 3.41 -1.26 -4.89 113.62 105.70 1cim n SER 73 Ca 0.37 -0.22 -0.11 0.00 -0.26 0.00 0.00 58.87 58.65 1cim n SER 73 Cb 0.88 0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 64.87 1cim n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1cim s GLN 74 N -2.91 1.00 -1.09 4.33 -0.21 -1.26 -5.07 119.66 114.45 1cim s GLN 74 Ca 0.14 -0.68 -0.23 0.00 0.02 0.00 0.00 55.36 54.61 1cim s GLN 74 Cb 0.18 0.44 -0.12 0.00 1.00 0.00 0.00 33.01 34.51 1cim s GLN 74 CO 0.64 -0.37 1.94 -0.25 -2.12 0.00 0.00 175.29 175.13 1cim n ASP 75 N -0.04 2.79 -0.12 5.90 8.00 -1.26 -4.64 116.55 127.17 1cim n ASP 75 Ca -0.16 -2.67 -0.25 0.00 0.71 0.00 0.00 54.79 52.41 1cim n ASP 75 Cb 0.63 -1.62 -0.10 0.00 -0.02 0.00 0.00 41.12 40.01 1cim n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1cim n LYS 76 N 8.07 0.57 -4.02 -1.24 5.02 -1.26 -4.84 118.16 120.46 1cim n LYS 76 Ca 0.45 0.36 -0.31 0.00 -2.02 0.00 0.00 58.31 56.79 1cim n LYS 76 Cb 0.46 -1.57 -0.15 0.00 -0.02 0.00 0.00 35.03 33.74 1cim n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cim s ALA 77 N -2.51 2.24 0.25 7.82 0.00 -1.26 -3.65 121.76 124.66 1cim s ALA 77 Ca -0.34 -1.47 0.05 0.00 0.00 0.00 0.00 51.96 50.19 1cim s ALA 77 Cb 0.11 -1.44 -0.05 0.00 0.00 0.00 0.00 23.12 21.74 1cim s ALA 77 CO 0.50 -1.03 -0.03 0.14 0.00 0.00 0.00 175.76 175.34 1cim s VAL 78 N 1.27 1.33 -0.05 0.00 -7.23 -0.67 -1.08 120.40 113.97 1cim s VAL 78 Ca -0.05 -2.08 0.02 0.00 -1.81 0.00 0.00 61.98 58.06 1cim s VAL 78 Cb -0.18 -2.39 0.01 0.00 0.56 0.00 0.00 36.38 34.38 1cim s VAL 78 CO -0.07 -0.31 -0.09 -0.22 -0.31 0.00 0.00 175.10 174.10 1cim s LEU 79 N -3.37 1.59 0.35 1.32 2.96 0.32 -1.15 118.68 120.70 1cim s LEU 79 Ca 0.29 -0.22 -0.07 0.00 -0.22 0.00 0.00 54.13 53.91 1cim s LEU 79 Cb 0.05 -0.64 0.02 0.00 0.50 0.00 0.00 46.19 46.12 1cim s LEU 79 CO 0.10 0.02 0.57 -1.59 -1.32 0.00 0.00 176.35 174.13 1cim s LYS 80 N 0.59 1.99 1.86 1.98 -2.85 -0.38 -1.15 119.74 121.79 1cim s LYS 80 Ca -0.10 -1.64 0.00 0.00 -1.00 0.00 0.00 55.97 53.23 1cim s LYS 80 Cb -0.13 0.50 0.00 0.00 -2.06 0.00 0.00 37.83 36.14 1cim s LYS 80 CO 0.02 -0.86 0.00 0.41 0.10 0.00 0.00 175.35 175.02 1cim n GLY 81 N -0.55 -1.22 7.00 0.59 0.00 -1.26 -0.79 105.19 108.96 1cim n GLY 81 Ca -0.02 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1cim n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cim n GLY 82 N 0.00 2.47 0.05 -0.02 0.00 -0.83 -0.93 105.19 105.94 1cim n GLY 82 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1cim n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cim n PRO 83 N 14.00 1.05 -3.77 1.61 -0.04 -1.26 -3.86 135.00 142.73 1cim n PRO 83 Ca 0.00 -0.08 -0.35 0.00 -0.04 0.00 0.00 63.50 63.03 1cim n PRO 83 Cb 0.00 -1.03 -0.05 0.00 -0.04 0.00 0.00 33.50 32.38 1cim n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1cim s LEU 84 N -0.98 4.37 -0.25 1.53 1.43 -0.11 -5.07 118.68 119.62 1cim s LEU 84 Ca 0.02 0.55 -0.07 0.00 -1.03 0.00 0.00 54.13 53.59 1cim s LEU 84 Cb 0.01 -2.64 -0.03 0.00 0.03 0.00 0.00 46.19 43.56 1cim s LEU 84 CO 0.01 0.26 0.07 -1.81 0.23 0.00 0.00 176.35 175.12 1cim s ASP 85 N -1.67 5.17 0.00 2.29 1.01 -1.26 -4.34 116.67 117.87 1cim s ASP 85 Ca 0.27 -0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.34 1cim s ASP 85 Cb -0.13 -1.93 0.00 0.00 1.01 0.00 0.00 42.92 41.87 1cim s ASP 85 CO 0.16 -0.03 0.00 0.61 0.21 0.00 0.00 175.17 176.12 1cim n GLY 86 N 4.86 -0.72 3.68 0.21 0.00 -1.26 -4.91 105.19 107.05 1cim n GLY 86 Ca -0.16 -1.73 -0.39 0.00 0.00 0.00 0.00 46.02 43.75 1cim n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cim s THR 87 N -1.17 5.12 -0.17 2.61 2.01 -1.26 -4.63 115.64 118.15 1cim s THR 87 Ca 0.00 0.98 -0.04 0.00 0.31 0.00 0.00 61.69 62.94 1cim s THR 87 Cb 0.00 -3.85 -0.02 0.00 0.01 0.00 0.00 72.50 68.64 1cim s THR 87 CO 0.00 0.22 -0.03 -0.31 -0.69 0.00 0.00 174.62 173.81 1cim s TYR 88 N 1.33 3.01 -0.07 4.92 1.51 -0.30 -1.39 117.35 126.36 1cim s TYR 88 Ca 0.25 -0.40 -0.17 0.00 -1.01 0.00 0.00 57.07 55.74 1cim s TYR 88 Cb -0.15 -1.99 -0.05 0.00 -0.11 0.00 0.00 41.96 39.66 1cim s TYR 88 CO 0.10 -0.13 0.45 0.50 -1.11 0.00 0.00 175.55 175.37 1cim s ARG 89 N 0.59 4.20 0.01 -0.62 3.52 0.05 -0.52 118.95 126.18 1cim s ARG 89 Ca -0.03 0.44 -0.30 0.00 -0.13 0.00 0.00 55.73 55.72 1cim s ARG 89 Cb -0.14 -3.35 -0.05 0.00 -1.56 0.00 0.00 34.95 29.84 1cim s ARG 89 CO 0.02 0.36 1.26 -1.17 -0.81 0.00 0.00 175.30 174.97 1cim s LEU 90 N -0.04 4.32 -0.12 -0.88 2.96 -0.24 -1.39 118.68 123.29 1cim s LEU 90 Ca 0.25 1.99 0.05 0.00 -0.22 0.00 0.00 54.13 56.20 1cim s LEU 90 Cb -0.16 -3.57 -0.11 0.00 0.50 0.00 0.00 46.19 42.85 1cim s LEU 90 CO 0.12 -0.59 -0.05 0.00 -1.32 0.00 0.00 176.35 174.51 1cim n ILE 91 N 4.36 0.77 -3.58 6.68 3.06 -0.73 -4.55 119.36 125.38 1cim n ILE 91 Ca 0.11 -0.38 -0.07 0.00 -2.50 0.00 0.00 62.75 59.91 1cim n ILE 91 Cb 0.45 -0.86 -0.02 0.00 0.54 0.00 0.00 39.64 39.76 1cim n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1cim s GLN 92 N -2.27 1.03 0.04 9.51 1.03 -1.23 -0.44 119.66 127.33 1cim s GLN 92 Ca -0.12 -0.46 0.00 0.00 0.04 0.00 0.00 55.36 54.82 1cim s GLN 92 Cb 0.04 0.43 -0.03 0.00 0.03 0.00 0.00 33.01 33.48 1cim s GLN 92 CO 0.38 -0.46 -0.04 -0.59 -2.54 0.00 0.00 175.29 172.04 1cim s PHE 93 N -3.29 0.44 0.25 9.60 -0.12 -0.69 -0.87 117.98 123.30 1cim s PHE 93 Ca 0.07 -0.68 -0.11 0.00 -0.05 0.00 0.00 56.93 56.15 1cim s PHE 93 Cb -0.01 -0.30 -0.01 0.00 -0.63 0.00 0.00 43.02 42.07 1cim s PHE 93 CO -0.06 -0.21 0.45 -3.38 -0.05 0.00 0.00 175.22 171.97 1cim s HIS 94 N -2.19 0.47 0.30 3.49 -3.43 -0.92 -1.33 115.29 111.68 1cim s HIS 94 Ca -0.07 -0.82 0.06 0.00 -0.80 0.00 0.00 55.06 53.43 1cim s HIS 94 Cb -0.05 0.11 -0.06 0.00 -1.43 0.00 0.00 32.58 31.16 1cim s HIS 94 CO -0.03 -0.97 -0.04 -0.06 -2.00 0.00 0.00 174.74 171.64 1cim s PHE 95 N -3.96 2.02 -0.02 0.38 0.40 -1.26 -0.92 117.98 114.61 1cim s PHE 95 Ca 0.24 -0.73 0.03 0.00 -0.60 0.00 0.00 56.93 55.88 1cim s PHE 95 Cb 0.00 -1.20 -0.00 0.00 0.51 0.00 0.00 43.02 42.33 1cim s PHE 95 CO 0.10 0.26 -0.12 -1.01 0.70 0.00 0.00 175.22 175.16 1cim s HIS 96 N -3.02 1.16 0.22 0.36 3.76 -0.37 -4.80 115.29 112.60 1cim s HIS 96 Ca 0.31 -0.28 -0.11 0.00 -0.15 0.00 0.00 55.06 54.83 1cim s HIS 96 Cb 0.05 -0.79 -0.01 0.00 1.11 0.00 0.00 32.58 32.94 1cim s HIS 96 CO 0.13 -0.09 0.40 1.67 -0.85 0.00 0.00 174.74 176.00 1cim s TRP 97 N 0.02 0.41 0.48 1.40 -2.14 -1.24 -1.15 118.94 116.72 1cim s TRP 97 Ca -0.01 -0.76 0.05 0.00 2.66 0.00 0.00 56.10 58.04 1cim s TRP 97 Cb -0.08 0.07 -0.02 0.00 -3.10 0.00 0.00 33.47 30.34 1cim s TRP 97 CO 0.01 -0.89 0.14 0.20 -2.66 0.00 0.00 176.95 173.75 1cim s GLY 98 N -3.01 2.63 0.00 3.67 0.00 -1.19 -1.09 107.32 108.33 1cim s GLY 98 Ca 0.22 -1.29 0.29 0.00 0.00 0.00 0.00 44.72 43.93 1cim s GLY 98 CO 0.06 -2.05 1.89 -1.14 0.00 0.00 0.00 173.10 171.86 1cim n SER 99 N -1.33 0.08 -3.85 1.64 3.41 -1.26 -4.47 113.62 107.83 1cim n SER 99 Ca -0.09 0.26 -0.11 0.00 -0.26 0.00 0.00 58.87 58.68 1cim n SER 99 Cb 0.66 -0.37 -0.09 0.00 -0.26 0.00 0.00 64.21 64.15 1cim n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1cim s LEU 100 N -2.90 1.41 0.00 1.04 1.43 -1.26 -5.06 118.68 113.33 1cim s LEU 100 Ca 0.17 -0.20 0.05 0.00 -1.03 0.00 0.00 54.13 53.12 1cim s LEU 100 Cb 0.19 0.82 0.22 0.00 0.03 0.00 0.00 46.19 47.45 1cim s LEU 100 CO 0.53 -0.42 1.15 0.47 0.23 0.00 0.00 176.35 178.32 1cim n ASP 101 N 1.27 0.00 -1.46 2.29 8.00 -1.26 -2.83 116.55 122.55 1cim n ASP 101 Ca -0.22 0.48 0.01 0.00 0.71 0.00 0.00 54.79 55.77 1cim n ASP 101 Cb 0.56 -0.49 0.28 0.00 -0.02 0.00 0.00 41.12 41.46 1cim n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cim n GLY 102 N -0.97 3.96 3.37 0.44 0.00 -1.26 -3.39 105.19 107.34 1cim n GLY 102 Ca 0.01 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.86 1cim n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1cim s GLN 103 N -2.97 1.11 0.00 1.61 -2.07 -1.13 -4.71 119.66 111.51 1cim s GLN 103 Ca 0.49 -0.49 0.00 0.00 -1.82 0.00 0.00 55.36 53.54 1cim s GLN 103 Cb 0.40 0.50 0.00 0.00 -1.09 0.00 0.00 33.01 32.82 1cim s GLN 103 CO 0.10 -0.44 0.00 0.41 -1.32 0.00 0.00 175.29 174.04 1cim n GLY 104 N -0.06 4.18 3.74 2.60 0.00 -1.05 -3.29 105.19 111.31 1cim n GLY 104 Ca -0.17 -0.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 1cim n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cim s SER 105 N 0.00 4.51 -0.17 1.61 1.04 -0.46 -3.59 113.70 116.64 1cim s SER 105 Ca 0.00 2.11 -0.13 0.00 0.48 0.00 0.00 55.95 58.41 1cim s SER 105 Cb 0.00 -2.56 -0.06 0.00 0.10 0.00 0.00 66.02 63.50 1cim s SER 105 CO 0.00 -2.04 -0.19 -0.62 0.98 0.00 0.00 173.24 171.37 1cim n GLU 106 N -2.86 0.49 -2.20 4.02 1.02 -1.26 -4.84 120.64 115.01 1cim n GLU 106 Ca 0.11 0.43 -0.38 0.00 -0.02 0.00 0.00 57.16 57.31 1cim n GLU 106 Cb 0.52 -1.62 -0.01 0.00 -0.02 0.00 0.00 31.44 30.31 1cim n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1cim s HIS 107 N -2.45 2.85 0.24 -0.32 3.76 -1.26 -4.43 115.29 113.68 1cim s HIS 107 Ca -0.21 1.51 0.10 0.00 -0.15 0.00 0.00 55.06 56.31 1cim s HIS 107 Cb 0.04 -3.44 -0.05 0.00 1.11 0.00 0.00 32.58 30.24 1cim s HIS 107 CO 0.33 -1.64 -0.19 0.95 -0.85 0.00 0.00 174.74 173.34 1cim s THR 108 N -1.48 2.20 -0.22 1.30 -4.23 -1.20 -4.77 115.64 107.25 1cim s THR 108 Ca 0.63 -2.28 0.01 0.00 -1.18 0.00 0.00 61.69 58.87 1cim s THR 108 Cb -0.31 -2.18 0.05 0.00 1.34 0.00 0.00 72.50 71.41 1cim s THR 108 CO 0.37 -0.43 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.24 1cim s VAL 109 N -2.53 1.79 -1.37 2.29 1.01 -0.73 -0.57 120.40 120.29 1cim s VAL 109 Ca 0.26 -1.22 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 1cim s VAL 109 Cb -0.04 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.46 1cim s VAL 109 CO 0.12 0.08 0.68 0.47 0.00 0.00 0.00 175.10 176.44 1cim n ASP 110 N 4.61 -1.50 0.00 3.32 8.00 -0.13 -0.92 116.55 129.93 1cim n ASP 110 Ca -0.14 -0.86 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1cim n ASP 110 Cb 0.45 -3.78 0.00 0.00 -0.02 0.00 0.00 41.12 37.77 1cim n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1cim n LYS 111 N -4.36 -1.37 -2.81 -1.24 5.02 -1.26 -4.97 118.16 107.17 1cim n LYS 111 Ca -0.25 0.31 -0.41 0.00 -2.02 0.00 0.00 58.31 55.94 1cim n LYS 111 Cb 0.66 -4.58 -0.04 0.00 -0.02 0.00 0.00 35.03 31.05 1cim n LYS 111 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1cim s LYS 112 N -1.53 4.56 -0.04 1.97 2.20 -0.09 -5.00 119.74 121.80 1cim s LYS 112 Ca 0.00 1.28 -0.03 0.00 -0.36 0.00 0.00 55.97 56.85 1cim s LYS 112 Cb 0.00 -3.43 -0.04 0.00 -1.51 0.00 0.00 37.83 32.85 1cim s LYS 112 CO 0.00 0.07 0.15 0.15 -0.36 0.00 0.00 175.35 175.36 1cim s LYS 113 N 0.63 3.38 0.46 4.03 1.02 -1.26 -1.77 119.74 126.23 1cim s LYS 113 Ca 0.46 -0.30 0.07 0.00 0.02 0.00 0.00 55.97 56.23 1cim s LYS 113 Cb -0.21 -3.08 -0.00 0.00 -0.52 0.00 0.00 37.83 34.02 1cim s LYS 113 CO 0.26 0.70 0.41 0.71 -0.92 0.00 0.00 175.35 176.51 1cim s TYR 114 N -1.22 2.36 0.27 3.18 1.51 -1.26 -4.63 117.35 117.55 1cim s TYR 114 Ca 0.23 -0.59 0.13 0.00 -1.01 0.00 0.00 57.07 55.83 1cim s TYR 114 Cb -0.12 -2.11 0.54 0.00 -0.11 0.00 0.00 41.96 40.15 1cim s TYR 114 CO 0.14 -0.27 1.70 0.00 -1.11 0.00 0.00 175.55 176.00 1cim h ALA 115 N 0.91 1.07 -2.74 3.71 0.00 -1.44 -1.15 119.26 119.62 1cim h ALA 115 Ca -0.39 -0.45 0.11 0.00 0.00 0.00 0.00 54.91 54.18 1cim h ALA 115 Cb 1.28 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.93 1cim h ALA 115 CO 0.56 0.62 0.33 0.00 0.00 0.00 0.00 179.25 180.76 1cim s ALA 116 N -3.74 -1.38 -0.05 0.00 0.00 -1.15 -3.18 121.76 112.26 1cim s ALA 116 Ca -0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 1cim s ALA 116 Cb 0.13 0.77 0.03 0.00 0.00 0.00 0.00 23.12 24.04 1cim s ALA 116 CO 0.73 -1.04 0.12 -2.00 0.00 0.00 0.00 175.76 173.57 1cim s GLU 117 N -3.64 0.07 -0.16 0.00 2.12 -0.30 -0.99 118.70 115.79 1cim s GLU 117 Ca 0.12 0.31 -0.12 0.00 0.36 0.00 0.00 54.97 55.63 1cim s GLU 117 Cb -0.04 -0.16 -0.05 0.00 0.26 0.00 0.00 34.13 34.14 1cim s GLU 117 CO 0.05 -0.15 0.23 -1.17 -0.54 0.00 0.00 175.26 173.68 1cim s LEU 118 N 1.00 4.26 -0.20 2.70 2.96 0.29 -1.24 118.68 128.45 1cim s LEU 118 Ca -0.08 0.43 0.00 0.00 -0.22 0.00 0.00 54.13 54.26 1cim s LEU 118 Cb -0.10 -2.26 0.02 0.00 0.50 0.00 0.00 46.19 44.35 1cim s LEU 118 CO -0.05 0.17 -0.16 -1.00 -1.32 0.00 0.00 176.35 173.99 1cim s HIS 119 N 0.20 2.87 -0.38 5.38 3.76 -0.10 -1.21 115.29 125.81 1cim s HIS 119 Ca 0.14 -1.60 -0.12 0.00 -0.15 0.00 0.00 55.06 53.33 1cim s HIS 119 Cb -0.12 -1.96 0.02 0.00 1.11 0.00 0.00 32.58 31.63 1cim s HIS 119 CO 0.02 -0.77 0.23 -0.51 -0.85 0.00 0.00 174.74 172.86 1cim s LEU 120 N 1.30 4.79 -0.19 0.89 1.43 -0.39 -2.17 118.68 124.34 1cim s LEU 120 Ca 0.04 -0.92 -0.17 0.00 -1.03 0.00 0.00 54.13 52.04 1cim s LEU 120 Cb -0.14 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.98 1cim s LEU 120 CO -0.10 -0.39 0.46 -0.69 0.23 0.00 0.00 176.35 175.86 1cim s VAL 121 N 1.60 5.16 0.08 -1.59 1.01 -0.05 -1.22 120.40 125.39 1cim s VAL 121 Ca 0.03 0.83 0.07 0.00 0.00 0.00 0.00 61.98 62.92 1cim s VAL 121 Cb -0.19 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 1cim s VAL 121 CO 0.08 0.23 -0.19 -1.00 0.00 0.00 0.00 175.10 174.22 1cim s HIS 122 N 1.38 1.61 0.13 5.22 3.76 -0.41 -1.78 115.29 125.21 1cim s HIS 122 Ca 0.22 -0.42 0.10 0.00 -0.15 0.00 0.00 55.06 54.81 1cim s HIS 122 Cb -0.15 -0.90 -0.04 0.00 1.11 0.00 0.00 32.58 32.60 1cim s HIS 122 CO 0.09 0.14 -0.23 1.67 -0.85 0.00 0.00 174.74 175.56 1cim s TRP 123 N -1.11 2.03 -0.30 1.40 1.48 -0.48 -1.61 118.94 120.34 1cim s TRP 123 Ca 0.04 -0.40 -0.29 0.00 -1.06 0.00 0.00 56.10 54.39 1cim s TRP 123 Cb -0.10 -1.08 -0.01 0.00 -1.16 0.00 0.00 33.47 31.12 1cim s TRP 123 CO 0.03 0.30 1.55 1.21 -4.06 0.00 0.00 176.95 175.98 1cim s ASN 124 N -2.15 6.32 0.50 -2.66 3.84 0.88 -0.77 114.94 120.90 1cim s ASN 124 Ca 0.12 1.29 0.34 0.00 0.21 0.00 0.00 52.86 54.82 1cim s ASN 124 Cb -0.09 -2.53 1.75 0.00 -0.55 0.00 0.00 41.25 39.82 1cim s ASN 124 CO 0.06 -1.36 2.02 0.71 -2.79 0.00 0.00 177.10 175.74 1cim h THR 125 N 6.33 0.00 0.00 -5.21 1.35 -1.57 -2.62 112.91 111.19 1cim h THR 125 Ca -0.31 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1cim h THR 125 Cb 1.13 0.87 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1cim h THR 125 CO 1.03 0.00 0.00 0.07 -0.25 0.00 0.00 175.52 176.37 1cim h LYS 127 N 0.00 0.00 -0.08 4.72 2.10 -1.91 -1.01 116.57 120.38 1cim h LYS 127 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1cim h LYS 127 Cb 0.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 1cim h LYS 127 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 1cim n TYR 128 N -2.59 0.09 0.00 0.07 4.01 -0.99 -4.98 117.16 112.77 1cim n TYR 128 Ca -0.00 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1cim n TYR 128 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 1cim n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1cim n GLY 129 N 1.22 1.57 3.25 2.72 0.00 -0.39 -4.57 105.19 108.99 1cim n GLY 129 Ca 0.17 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1cim n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1cim s ASP 130 N 0.00 0.15 0.27 1.61 1.47 -1.26 -5.04 116.67 113.87 1cim s ASP 130 Ca 0.00 -0.94 -0.04 0.00 1.18 0.00 0.00 52.55 52.76 1cim s ASP 130 Cb 0.00 0.37 0.36 0.00 -0.34 0.00 0.00 42.92 43.31 1cim s ASP 130 CO 0.00 -0.81 1.92 0.15 0.68 0.00 0.00 175.17 177.11 1cim h PHE 131 N 2.70 1.20 -0.95 2.11 3.57 -1.95 -2.03 116.94 121.58 1cim h PHE 131 Ca -0.33 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.26 1cim h PHE 131 Cb 1.21 -0.40 -0.06 0.00 2.79 0.00 0.00 35.95 39.49 1cim h PHE 131 CO 0.42 0.70 0.62 0.78 -2.23 0.00 0.00 178.31 178.60 1cim h GLY 132 N 1.24 1.41 1.39 2.40 0.00 -1.97 -1.90 103.07 105.64 1cim h GLY 132 Ca 0.38 -0.45 -0.28 0.00 0.00 0.00 0.00 47.33 46.98 1cim h GLY 132 CO -0.11 0.34 -1.20 0.50 0.00 0.00 0.00 176.54 176.08 1cim h LYS 133 N 1.13 0.51 -0.79 4.80 1.79 -1.67 -3.28 116.57 119.06 1cim h LYS 133 Ca 0.40 -0.68 0.04 0.00 -2.18 0.00 0.00 60.65 58.23 1cim h LYS 133 Cb 0.13 0.23 -0.05 0.00 -1.58 0.00 0.00 32.23 30.96 1cim h LYS 133 CO -0.15 1.29 0.52 0.00 -1.08 0.00 0.00 179.45 180.03 1cim h ALA 134 N 0.44 1.56 0.00 3.86 0.00 -0.69 -0.09 119.26 124.34 1cim h ALA 134 Ca -0.16 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1cim h ALA 134 Cb 1.87 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1cim h ALA 134 CO 0.22 0.35 0.00 1.33 0.00 0.00 0.00 179.25 181.15 1cim n VAL 135 N -4.46 0.00 0.43 0.00 0.24 -0.85 -1.39 118.33 112.30 1cim n VAL 135 Ca 0.11 0.00 0.12 0.00 -2.04 0.00 0.00 64.34 62.52 1cim n VAL 135 Cb 0.14 -0.46 0.24 0.00 -1.47 0.00 0.00 33.84 32.29 1cim n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cim n GLN 136 N -0.78 2.42 -4.39 7.34 6.02 -0.05 -4.93 117.38 123.01 1cim n GLN 136 Ca 0.09 -2.14 -0.29 0.00 -0.01 0.00 0.00 57.00 54.65 1cim n GLN 136 Cb 0.04 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 29.67 1cim n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1cim s GLN 137 N -1.53 1.41 0.54 -1.09 -1.52 -0.49 -5.04 119.66 111.94 1cim s GLN 137 Ca 0.38 -1.36 0.33 0.00 -1.95 0.00 0.00 55.36 52.76 1cim s GLN 137 Cb 0.22 -1.90 1.35 0.00 -0.22 0.00 0.00 33.01 32.47 1cim s GLN 137 CO 0.31 0.45 1.97 -1.00 -0.25 0.00 0.00 175.29 176.77 1cim h PRO 138 N 3.83 0.00 -0.01 2.91 0.13 -1.85 -3.04 132.00 133.98 1cim h PRO 138 Ca -0.51 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 1cim h PRO 138 Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 1cim h PRO 138 CO 0.40 0.00 -0.57 -0.40 -0.23 0.00 0.00 178.00 177.19 1cim n ASP 139 N -3.06 1.66 0.09 1.44 5.75 -1.26 -4.17 116.55 117.01 1cim n ASP 139 Ca 0.01 -3.66 -0.04 0.00 -0.01 0.00 0.00 54.79 51.08 1cim n ASP 139 Cb 0.30 -0.50 -0.00 0.00 -1.03 0.00 0.00 41.12 39.89 1cim n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1cim h GLY 140 N 1.02 0.00 -4.10 6.12 0.00 -1.38 -3.44 103.07 101.29 1cim h GLY 140 Ca -0.03 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.86 1cim h GLY 140 CO 0.02 0.00 -0.78 1.08 0.00 0.00 0.00 176.54 176.86 1cim s LEU 141 N -7.03 2.33 -0.07 3.11 1.43 -0.75 -0.08 118.68 117.62 1cim s LEU 141 Ca 0.00 -0.70 0.02 0.00 -1.03 0.00 0.00 54.13 52.42 1cim s LEU 141 Cb 0.11 -0.61 0.01 0.00 0.03 0.00 0.00 46.19 45.73 1cim s LEU 141 CO 0.79 -0.07 -0.11 0.00 0.23 0.00 0.00 176.35 177.19 1cim s ALA 142 N -1.56 1.22 -0.12 4.21 0.00 -0.64 -0.95 121.76 123.92 1cim s ALA 142 Ca 0.04 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.61 1cim s ALA 142 Cb -0.08 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.45 1cim s ALA 142 CO 0.03 0.08 -0.13 0.08 0.00 0.00 0.00 175.76 175.82 1cim s VAL 143 N 0.74 3.05 -0.32 0.00 1.01 -0.90 -1.28 120.40 122.69 1cim s VAL 143 Ca -0.13 -0.67 -0.17 0.00 0.00 0.00 0.00 61.98 61.01 1cim s VAL 143 Cb -0.16 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1cim s VAL 143 CO 0.03 0.53 0.48 -0.22 0.00 0.00 0.00 175.10 175.91 1cim s LEU 144 N 0.27 4.27 -0.19 3.92 2.96 -0.36 -1.65 118.68 127.91 1cim s LEU 144 Ca -0.09 0.07 -0.06 0.00 -0.22 0.00 0.00 54.13 53.83 1cim s LEU 144 Cb -0.16 -2.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.95 1cim s LEU 144 CO 0.05 -0.40 0.03 -0.83 -1.32 0.00 0.00 176.35 173.89 1cim s GLY 145 N 1.71 1.82 -0.04 7.98 0.00 0.24 -1.26 107.32 117.77 1cim s GLY 145 Ca 0.18 -0.85 0.05 0.00 0.00 0.00 0.00 44.72 44.10 1cim s GLY 145 CO 0.12 0.11 -0.20 -0.42 0.00 0.00 0.00 173.10 172.72 1cim s ILE 146 N 0.62 1.61 0.28 0.90 1.01 -0.35 -1.25 121.20 124.02 1cim s ILE 146 Ca 0.01 -0.83 -0.12 0.00 0.00 0.00 0.00 60.65 59.72 1cim s ILE 146 Cb -0.13 -1.37 -0.08 0.00 0.01 0.00 0.00 42.46 40.89 1cim s ILE 146 CO 0.02 0.46 0.64 -0.36 0.00 0.00 0.00 174.94 175.69 1cim s PHE 147 N -0.10 3.41 -0.07 3.97 0.08 -1.26 -0.55 117.98 123.45 1cim s PHE 147 Ca -0.02 1.01 0.04 0.00 0.12 0.00 0.00 56.93 58.09 1cim s PHE 147 Cb -0.11 -2.37 -0.00 0.00 -0.57 0.00 0.00 43.02 39.96 1cim s PHE 147 CO 0.02 0.18 -0.21 -0.51 -0.10 0.00 0.00 175.22 174.60 1cim s LEU 148 N -2.96 1.98 0.13 -0.37 1.02 -0.16 -1.47 118.68 116.83 1cim s LEU 148 Ca 0.50 -0.46 0.09 0.00 0.02 0.00 0.00 54.13 54.28 1cim s LEU 148 Cb -0.11 -1.21 -0.04 0.00 0.02 0.00 0.00 46.19 44.86 1cim s LEU 148 CO 0.20 0.16 -0.20 -1.59 0.02 0.00 0.00 176.35 174.94 1cim s LYS 149 N 0.17 1.20 -0.10 1.70 -2.85 -0.71 -2.16 119.74 117.00 1cim s LYS 149 Ca -0.10 -1.27 -0.30 0.00 -1.00 0.00 0.00 55.97 53.31 1cim s LYS 149 Cb -0.15 -1.41 -0.01 0.00 -2.06 0.00 0.00 37.83 34.20 1cim s LYS 149 CO 0.05 0.31 1.02 0.08 0.10 0.00 0.00 175.35 176.91 1cim s VAL 150 N -1.47 4.75 0.00 1.79 1.01 -1.26 -1.30 120.40 123.92 1cim s VAL 150 Ca 0.10 2.01 0.00 0.00 0.00 0.00 0.00 61.98 64.10 1cim s VAL 150 Cb -0.08 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 32.00 1cim s VAL 150 CO 0.05 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.78 1cim n GLY 151 N 3.10 0.90 3.80 4.51 0.00 0.31 -4.88 105.19 112.92 1cim n GLY 151 Ca 0.09 0.43 -0.34 0.00 0.00 0.00 0.00 46.02 46.20 1cim n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cim s SER 152 N 2.00 6.26 0.38 1.61 0.01 -1.26 -3.80 113.70 118.91 1cim s SER 152 Ca 0.00 1.93 -0.27 0.00 1.31 0.00 0.00 55.95 58.92 1cim s SER 152 Cb 0.00 -2.56 -0.10 0.00 0.21 0.00 0.00 66.02 63.57 1cim s SER 152 CO 0.00 -0.84 1.41 0.00 0.41 0.00 0.00 173.24 174.23 1cim s ALA 153 N -2.01 3.46 -0.42 1.44 0.00 -1.26 -2.72 121.76 120.24 1cim s ALA 153 Ca 0.67 1.44 -0.16 0.00 0.00 0.00 0.00 51.96 53.91 1cim s ALA 153 Cb -0.17 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.42 1cim s ALA 153 CO 0.22 -0.96 0.37 0.21 0.00 0.00 0.00 175.76 175.61 1cim s LYS 154 N -2.11 3.02 0.18 0.00 2.47 -1.24 -4.80 119.74 117.26 1cim s LYS 154 Ca 0.54 -0.95 -0.16 0.00 -1.56 0.00 0.00 55.97 53.84 1cim s LYS 154 Cb -0.43 -4.00 0.13 0.00 -1.46 0.00 0.00 37.83 32.07 1cim s LYS 154 CO 0.58 -0.84 1.66 -1.35 0.16 0.00 0.00 175.35 175.56 1cim h PRO 155 N 8.69 0.02 0.00 4.03 0.11 -1.92 -2.04 132.00 140.89 1cim h PRO 155 Ca -0.27 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1cim h PRO 155 Cb 1.11 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1cim h PRO 155 CO 0.78 0.01 0.00 0.41 -0.21 0.00 0.00 178.00 178.99 1cim n GLY 156 N -1.33 -0.71 0.02 -0.55 0.00 -1.26 -0.96 105.19 100.40 1cim n GLY 156 Ca 0.04 0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.28 1cim n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1cim n LEU 157 N -1.91 0.63 0.06 0.99 7.94 -0.77 -4.54 117.00 119.41 1cim n LEU 157 Ca -0.01 -0.03 -0.02 0.00 -1.11 0.00 0.00 56.01 54.85 1cim n LEU 157 Cb 0.02 -0.14 0.25 0.00 0.53 0.00 0.00 43.42 44.09 1cim n LEU 157 CO 0.06 0.07 0.75 -0.61 -1.11 0.00 0.00 177.39 176.55 1cim h GLN 158 N 0.00 0.36 -0.21 1.96 5.75 -1.12 -2.16 115.11 119.69 1cim h GLN 158 Ca 0.00 -0.13 -0.02 0.00 -0.15 0.00 0.00 58.65 58.36 1cim h GLN 158 Cb 0.65 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.16 1cim h GLN 158 CO 0.00 0.60 0.06 -0.22 -2.65 0.00 0.00 178.83 176.61 1cim h LYS 159 N 0.32 0.29 -0.01 1.69 3.64 -1.80 0.44 116.57 121.15 1cim h LYS 159 Ca 0.05 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1cim h LYS 159 Cb 0.63 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1cim h LYS 159 CO 0.05 0.27 -0.08 0.28 -2.27 0.00 0.00 179.45 177.69 1cim h VAL 160 N 0.29 1.56 -0.83 2.00 2.07 -1.71 -3.07 116.25 116.56 1cim h VAL 160 Ca 0.07 -1.75 0.07 0.00 0.82 0.00 0.00 66.70 65.91 1cim h VAL 160 Cb 0.11 2.71 -0.07 0.00 -1.52 0.00 0.00 31.29 32.52 1cim h VAL 160 CO -0.00 0.47 0.49 0.58 0.02 0.00 0.00 177.57 179.12 1cim h VAL 161 N -0.63 0.98 -0.60 2.57 2.07 -0.88 -2.21 116.25 117.55 1cim h VAL 161 Ca -0.01 -0.30 -0.08 0.00 0.82 0.00 0.00 66.70 67.13 1cim h VAL 161 Cb 0.80 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1cim h VAL 161 CO 0.02 0.16 0.07 0.44 0.02 0.00 0.00 177.57 178.27 1cim h ASP 162 N 0.87 0.96 0.58 0.57 3.32 -0.97 -2.90 116.42 118.85 1cim h ASP 162 Ca 0.38 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1cim h ASP 162 Cb 0.25 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1cim h ASP 162 CO -0.20 0.98 0.00 0.55 -1.72 0.00 0.00 179.24 178.85 1cim n VAL 163 N -4.21 0.69 0.29 -1.35 3.14 -0.84 -4.06 118.33 111.99 1cim n VAL 163 Ca 0.04 0.17 0.16 0.00 -2.96 0.00 0.00 64.34 61.75 1cim n VAL 163 Cb 0.30 -0.86 0.85 0.00 -1.06 0.00 0.00 33.84 33.07 1cim n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1cim h LEU 164 N 0.00 0.00 -1.64 6.55 3.38 -1.47 -1.03 115.31 121.10 1cim h LEU 164 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1cim h LEU 164 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1cim h LEU 164 CO 0.00 0.06 -0.20 0.44 0.09 0.00 0.00 178.44 178.83 1cim h ASP 165 N 0.00 0.00 1.06 -0.43 3.32 -1.82 -2.27 116.42 116.29 1cim h ASP 165 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1cim h ASP 165 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1cim h ASP 165 CO 0.01 0.20 0.00 0.28 -1.72 0.00 0.00 179.24 178.01 1cim h SER 166 N 0.00 0.00 -1.01 6.45 0.02 -1.48 -3.29 113.55 114.25 1cim h SER 166 Ca -0.00 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.50 1cim h SER 166 Cb 0.44 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.56 1cim h SER 166 CO 0.03 0.00 -0.96 2.30 -1.14 0.00 0.00 176.83 177.05 1cim n ILE 167 N -2.71 1.77 0.00 3.27 -5.35 -0.86 -4.64 119.36 110.85 1cim n ILE 167 Ca 0.02 -3.85 -0.03 0.00 -0.27 0.00 0.00 62.75 58.63 1cim n ILE 167 Cb 0.31 -0.17 0.22 0.00 -1.74 0.00 0.00 39.64 38.26 1cim n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1cim h LYS 168 N 2.64 0.52 -6.18 6.28 3.64 -1.62 -3.42 116.57 118.41 1cim h LYS 168 Ca 0.11 -0.17 -0.58 0.00 -1.27 0.00 0.00 60.65 58.74 1cim h LYS 168 Cb 1.18 -0.04 -0.11 0.00 -0.41 0.00 0.00 32.23 32.85 1cim h LYS 168 CO 0.60 0.68 -0.68 0.95 -2.27 0.00 0.00 179.45 178.73 1cim s THR 169 N -4.63 3.04 -0.00 1.00 -4.23 -1.26 -0.64 115.64 108.92 1cim s THR 169 Ca -0.07 -2.07 -0.34 0.00 -1.18 0.00 0.00 61.69 58.02 1cim s THR 169 Cb 0.14 -2.67 -0.13 0.00 1.34 0.00 0.00 72.50 71.18 1cim s THR 169 CO 0.79 -0.36 1.75 1.17 -0.54 0.00 0.00 174.62 177.43 1cim n LYS 170 N -0.82 2.10 0.00 3.99 4.81 -0.39 -2.61 118.16 125.25 1cim n LYS 170 Ca -0.06 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 1cim n LYS 170 Cb 0.60 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.07 1cim n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1cim n GLY 171 N 3.99 2.60 3.79 3.14 0.00 -0.30 -4.53 105.19 113.89 1cim n GLY 171 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1cim n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cim s LYS 172 N -0.68 3.65 0.20 1.61 -0.14 -1.07 -4.85 119.74 118.45 1cim s LYS 172 Ca 0.00 1.39 -0.07 0.00 -1.36 0.00 0.00 55.97 55.93 1cim s LYS 172 Cb 0.00 -2.07 -0.02 0.00 -1.68 0.00 0.00 37.83 34.06 1cim s LYS 172 CO 0.00 -0.57 0.29 -1.54 -0.76 0.00 0.00 175.35 172.77 1cim s SER 173 N -2.04 0.04 0.01 2.83 1.04 -1.26 -1.58 113.70 112.75 1cim s SER 173 Ca 0.68 -1.08 -0.11 0.00 0.48 0.00 0.00 55.95 55.92 1cim s SER 173 Cb -0.18 0.46 0.01 0.00 0.10 0.00 0.00 66.02 66.42 1cim s SER 173 CO 0.23 -0.96 0.23 0.00 0.98 0.00 0.00 173.24 173.73 1cim s ALA 174 N -4.05 -0.52 0.40 5.32 0.00 -0.80 -4.88 121.76 117.22 1cim s ALA 174 Ca 0.27 -0.03 -0.25 0.00 0.00 0.00 0.00 51.96 51.95 1cim s ALA 174 Cb 0.03 0.18 -0.08 0.00 0.00 0.00 0.00 23.12 23.25 1cim s ALA 174 CO 0.07 -0.30 1.19 -0.51 0.00 0.00 0.00 175.76 176.21 1cim s ASP 175 N -1.68 6.48 -0.47 0.00 1.01 -1.26 -2.08 116.67 118.67 1cim s ASP 175 Ca -0.10 2.39 0.06 0.00 0.71 0.00 0.00 52.55 55.61 1cim s ASP 175 Cb -0.04 -2.62 0.18 0.00 1.01 0.00 0.00 42.92 41.45 1cim s ASP 175 CO 0.00 -0.71 0.55 0.12 0.21 0.00 0.00 175.17 175.35 1cim s PHE 176 N -1.39 -0.42 0.28 4.23 5.36 -0.19 -4.76 117.98 121.09 1cim s PHE 176 Ca 0.57 -1.34 0.06 0.00 -0.96 0.00 0.00 56.93 55.26 1cim s PHE 176 Cb -0.32 -0.23 -0.03 0.00 -0.34 0.00 0.00 43.02 42.11 1cim s PHE 176 CO 0.40 -1.08 0.34 0.95 -1.46 0.00 0.00 175.22 174.37 1cim s THR 177 N 0.52 4.47 -1.45 0.12 -4.23 -1.25 -2.39 115.64 111.43 1cim s THR 177 Ca 0.31 -1.15 -0.08 0.00 -1.18 0.00 0.00 61.69 59.59 1cim s THR 177 Cb 0.02 -3.52 0.05 0.00 1.34 0.00 0.00 72.50 70.39 1cim s THR 177 CO -0.12 -0.26 0.86 0.59 -0.54 0.00 0.00 174.62 175.15 1cim n ASN 178 N -1.41 -3.32 -4.75 3.99 4.13 -1.25 -4.94 115.26 107.71 1cim n ASN 178 Ca -0.05 -0.81 -0.36 0.00 1.68 0.00 0.00 54.58 55.05 1cim n ASN 178 Cb 0.58 -3.89 -0.08 0.00 -1.54 0.00 0.00 39.78 34.86 1cim n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1cim s PHE 179 N -3.46 3.45 -0.35 3.10 5.36 -1.26 -5.01 117.98 119.81 1cim s PHE 179 Ca 0.41 0.41 -0.12 0.00 -0.96 0.00 0.00 56.93 56.67 1cim s PHE 179 Cb -0.20 -2.16 -0.00 0.00 -0.34 0.00 0.00 43.02 40.31 1cim s PHE 179 CO 0.83 0.35 0.22 0.34 -1.46 0.00 0.00 175.22 175.50 1cim s ASP 180 N 0.16 5.87 0.52 6.13 -1.08 -1.26 -4.30 116.67 122.71 1cim s ASP 180 Ca 0.11 -0.60 0.28 0.00 -0.52 0.00 0.00 52.55 51.81 1cim s ASP 180 Cb -0.12 -2.09 1.45 0.00 -1.46 0.00 0.00 42.92 40.71 1cim s ASP 180 CO -0.00 -0.28 2.07 -0.65 0.52 0.00 0.00 175.17 176.83 1cim h PRO 181 N 8.46 0.00 -0.11 4.34 0.11 -1.96 -2.99 132.00 139.84 1cim h PRO 181 Ca -0.30 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.84 1cim h PRO 181 Cb 1.14 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1cim h PRO 181 CO 0.65 0.12 0.35 0.00 -0.21 0.00 0.00 178.00 178.91 1cim h ARG 182 N 0.00 0.00 0.00 1.05 3.08 -1.94 -0.13 114.38 116.44 1cim h ARG 182 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1cim h ARG 182 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 1cim h ARG 182 CO 0.02 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 1cim n GLY 183 N -1.30 -0.89 0.28 0.04 0.00 -1.13 -2.86 105.19 99.34 1cim n GLY 183 Ca 0.01 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1cim n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1cim n LEU 184 N -0.82 1.77 -4.80 0.99 4.77 -0.06 -4.33 117.00 114.52 1cim n LEU 184 Ca 0.14 -1.24 -0.39 0.00 -0.03 0.00 0.00 56.01 54.49 1cim n LEU 184 Cb 0.06 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 1cim n LEU 184 CO 0.10 0.39 0.32 -0.76 -1.33 0.00 0.00 177.39 176.11 1cim s LEU 185 N -0.64 4.53 1.14 2.23 1.43 -1.14 -4.92 118.68 121.31 1cim s LEU 185 Ca 0.09 1.34 -0.18 0.00 -1.03 0.00 0.00 54.13 54.35 1cim s LEU 185 Cb 0.06 -2.99 0.26 0.00 0.03 0.00 0.00 46.19 43.55 1cim s LEU 185 CO 0.08 0.24 1.13 -2.16 0.23 0.00 0.00 176.35 175.88 1cim s PRO 186 N -1.01 -0.73 0.08 1.29 0.04 -1.26 -4.99 135.00 128.42 1cim s PRO 186 Ca 0.31 -0.03 -0.18 0.00 0.04 0.00 0.00 61.00 61.14 1cim s PRO 186 Cb -0.20 -1.65 -0.09 0.00 0.04 0.00 0.00 34.50 32.60 1cim s PRO 186 CO 0.20 -3.39 1.45 1.49 0.04 0.00 0.00 177.00 176.79 1cim h GLU 187 N -2.35 0.52 -5.99 4.56 4.81 -1.92 -3.44 114.58 110.77 1cim h GLU 187 Ca -0.46 -0.23 -0.61 0.00 -0.13 0.00 0.00 59.36 57.94 1cim h GLU 187 Cb 1.29 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.60 1cim h GLU 187 CO 0.38 0.78 -0.20 0.45 -0.73 0.00 0.00 179.01 179.70 1cim s SER 188 N -6.19 6.80 -0.30 1.04 0.15 -1.26 -4.99 113.70 108.95 1cim s SER 188 Ca -0.13 0.96 0.11 0.00 0.70 0.00 0.00 55.95 57.58 1cim s SER 188 Cb 0.07 -2.26 0.76 0.00 -1.71 0.00 0.00 66.02 62.89 1cim s SER 188 CO 0.78 0.30 1.79 0.18 1.20 0.00 0.00 173.24 177.48 1cim n LEU 189 N 1.97 5.96 -4.76 3.45 4.77 -1.26 -4.71 117.00 122.42 1cim n LEU 189 Ca -0.13 -3.17 -0.41 0.00 -0.03 0.00 0.00 56.01 52.27 1cim n LEU 189 Cb 0.52 -0.73 -0.03 0.00 -2.33 0.00 0.00 43.42 40.85 1cim n LEU 189 CO 0.38 0.78 0.92 -1.81 -1.33 0.00 0.00 177.39 176.32 1cim s ASP 190 N -1.04 6.96 0.06 -1.43 1.01 -1.26 -4.69 116.67 116.28 1cim s ASP 190 Ca 0.55 2.49 -0.04 0.00 0.71 0.00 0.00 52.55 56.26 1cim s ASP 190 Cb 0.43 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.71 1cim s ASP 190 CO 0.14 -0.40 0.07 -0.72 0.21 0.00 0.00 175.17 174.46 1cim s TYR 191 N -0.91 0.33 0.24 4.23 -0.85 -1.26 -0.66 117.35 118.46 1cim s TYR 191 Ca 0.49 -0.78 0.07 0.00 -0.52 0.00 0.00 57.07 56.33 1cim s TYR 191 Cb -0.36 -0.23 -0.04 0.00 0.38 0.00 0.00 41.96 41.71 1cim s TYR 191 CO 0.46 -0.42 0.16 -1.58 -1.52 0.00 0.00 175.55 172.65 1cim s TRP 192 N -3.53 3.06 -0.13 -3.49 0.51 0.06 -0.89 118.94 114.53 1cim s TRP 192 Ca 0.03 -0.11 -0.20 0.00 -2.12 0.00 0.00 56.10 53.70 1cim s TRP 192 Cb 0.04 -1.39 0.05 0.00 -0.81 0.00 0.00 33.47 31.36 1cim s TRP 192 CO -0.09 0.53 0.51 -0.08 -0.51 0.00 0.00 176.95 177.32 1cim s THR 193 N -2.09 0.01 0.08 2.01 -1.32 -0.74 -1.05 115.64 112.55 1cim s THR 193 Ca 0.32 -0.09 -0.24 0.00 -1.21 0.00 0.00 61.69 60.47 1cim s THR 193 Cb -0.08 -0.76 0.06 0.00 -1.51 0.00 0.00 72.50 70.21 1cim s THR 193 CO 0.24 -0.05 0.57 -0.72 -2.21 0.00 0.00 174.62 172.45 1cim s TYR 194 N -0.31 -0.49 -0.17 9.09 1.13 -0.99 -1.57 117.35 124.04 1cim s TYR 194 Ca -0.05 0.48 -0.29 0.00 -1.41 0.00 0.00 57.07 55.80 1cim s TYR 194 Cb -0.03 0.43 -0.00 0.00 -1.10 0.00 0.00 41.96 41.26 1cim s TYR 194 CO 0.03 -0.72 1.02 -1.25 -2.51 0.00 0.00 175.55 172.12 1cim s PRO 195 N -2.84 4.34 0.00 -3.49 0.04 -1.26 -1.44 135.00 130.36 1cim s PRO 195 Ca -0.03 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1cim s PRO 195 Cb -0.00 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.95 1cim s PRO 195 CO -0.05 -0.47 0.00 0.41 0.04 0.00 0.00 177.00 176.93 1cim n GLY 196 N 3.21 5.44 3.39 0.56 0.00 0.99 -4.82 105.19 113.95 1cim n GLY 196 Ca 0.10 -1.21 -0.14 0.00 0.00 0.00 0.00 46.02 44.77 1cim n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cim s SER 197 N 1.00 0.78 0.55 1.61 1.04 -1.06 -2.48 113.70 115.15 1cim s SER 197 Ca 0.00 -1.45 -0.20 0.00 0.48 0.00 0.00 55.95 54.78 1cim s SER 197 Cb 0.00 0.56 -0.05 0.00 0.10 0.00 0.00 66.02 66.63 1cim s SER 197 CO 0.00 -1.11 1.20 -0.76 0.98 0.00 0.00 173.24 173.55 1cim s LEU 198 N -3.22 3.77 0.00 2.42 1.43 -0.56 -4.47 118.68 118.05 1cim s LEU 198 Ca 0.34 2.37 0.23 0.00 -1.03 0.00 0.00 54.13 56.04 1cim s LEU 198 Cb 0.02 -4.49 0.43 0.00 0.03 0.00 0.00 46.19 42.17 1cim s LEU 198 CO 0.19 -1.39 1.40 0.35 0.23 0.00 0.00 176.35 177.12 1cim n THR 199 N -1.26 0.51 -4.35 5.49 -2.24 -1.26 -4.38 114.28 106.78 1cim n THR 199 Ca 0.12 -0.76 -0.20 0.00 -2.27 0.00 0.00 64.05 60.94 1cim n THR 199 Cb 0.49 0.98 -0.10 0.00 -2.10 0.00 0.00 70.33 69.60 1cim n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1cim s THR 200 N -1.47 1.82 0.15 4.28 -4.23 -1.26 -4.69 115.64 110.24 1cim s THR 200 Ca 0.39 -2.10 -0.31 0.00 -1.18 0.00 0.00 61.69 58.48 1cim s THR 200 Cb 0.23 -1.97 -0.18 0.00 1.34 0.00 0.00 72.50 71.92 1cim s THR 200 CO 0.32 -0.47 0.69 -2.65 -0.54 0.00 0.00 174.62 171.97 1cim n PRO 201 N -0.12 0.06 -0.07 3.99 -0.02 -1.26 -0.84 135.00 136.75 1cim n PRO 201 Ca -0.10 0.02 0.02 0.00 -2.02 0.00 0.00 63.50 61.42 1cim n PRO 201 Cb 0.59 -1.17 0.06 0.00 -0.02 0.00 0.00 33.50 32.96 1cim n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1cim n PRO 202 N 1.14 1.32 -2.96 0.52 -0.04 -1.26 -5.00 135.00 128.72 1cim n PRO 202 Ca 0.18 -0.48 -0.21 0.00 -0.04 0.00 0.00 63.50 62.95 1cim n PRO 202 Cb 0.21 -1.12 0.02 0.00 -0.04 0.00 0.00 33.50 32.56 1cim n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1cim n LEU 203 N -0.10 -2.20 -4.77 1.53 4.77 -0.02 -4.92 117.00 111.30 1cim n LEU 203 Ca 0.04 -0.23 -0.40 0.00 -0.03 0.00 0.00 56.01 55.40 1cim n LEU 203 Cb 0.12 -2.71 -0.02 0.00 -2.33 0.00 0.00 43.42 38.48 1cim n LEU 203 CO 0.03 0.12 0.92 -0.76 -1.33 0.00 0.00 177.39 176.37 1cim s LEU 204 N -6.46 4.30 -1.16 2.23 1.43 -1.26 -4.53 118.68 113.23 1cim s LEU 204 Ca 0.26 2.56 -0.10 0.00 -1.03 0.00 0.00 54.13 55.81 1cim s LEU 204 Cb -0.12 -3.84 0.23 0.00 0.03 0.00 0.00 46.19 42.50 1cim s LEU 204 CO 0.32 -0.66 1.34 -0.62 0.23 0.00 0.00 176.35 176.96 1cim n GLU 205 N 0.40 3.59 0.00 1.70 1.02 -1.26 -1.50 120.64 124.59 1cim n GLU 205 Ca 0.02 -4.17 0.00 0.00 -0.02 0.00 0.00 57.16 52.99 1cim n GLU 205 Cb 0.44 -2.76 0.00 0.00 -0.02 0.00 0.00 31.44 29.10 1cim n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1cim s VAL 207 N -0.30 4.30 -0.37 0.00 1.01 -1.03 -1.82 120.40 122.19 1cim s VAL 207 Ca 0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 61.98 61.61 1cim s VAL 207 Cb 0.00 -2.81 0.02 0.00 0.00 0.00 0.00 36.38 33.59 1cim s VAL 207 CO 0.00 0.60 0.22 -0.89 0.00 0.00 0.00 175.10 175.04 1cim s THR 208 N -0.86 4.81 -0.03 3.92 2.01 -0.12 -0.01 115.64 125.35 1cim s THR 208 Ca 0.13 -0.68 -0.24 0.00 0.31 0.00 0.00 61.69 61.21 1cim s THR 208 Cb -0.11 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 1cim s THR 208 CO 0.02 -0.18 0.75 0.26 -0.69 0.00 0.00 174.62 174.77 1cim s TRP 209 N 1.61 3.62 -0.26 4.92 0.52 -0.52 -2.11 118.94 126.72 1cim s TRP 209 Ca 0.04 1.35 0.02 0.00 0.02 0.00 0.00 56.10 57.52 1cim s TRP 209 Cb -0.19 -2.84 0.07 0.00 -1.15 0.00 0.00 33.47 29.36 1cim s TRP 209 CO 0.08 0.12 -0.05 0.42 0.02 0.00 0.00 176.95 177.54 1cim s ILE 210 N 0.62 1.83 -0.21 2.03 1.01 -0.66 -2.34 121.20 123.49 1cim s ILE 210 Ca 0.39 -1.55 -0.06 0.00 0.00 0.00 0.00 60.65 59.43 1cim s ILE 210 Cb -0.19 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 1cim s ILE 210 CO 0.20 -0.19 0.02 -0.69 0.00 0.00 0.00 174.94 174.29 1cim s VAL 211 N 1.23 4.10 0.20 2.92 1.01 -0.21 -0.59 120.40 129.06 1cim s VAL 211 Ca -0.03 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.39 1cim s VAL 211 Cb -0.19 -2.87 -0.08 0.00 0.00 0.00 0.00 36.38 33.24 1cim s VAL 211 CO -0.07 0.41 0.98 -0.76 0.00 0.00 0.00 175.10 175.65 1cim s LEU 212 N 1.13 4.58 0.15 3.92 1.43 -0.38 -0.76 118.68 128.74 1cim s LEU 212 Ca 0.03 1.95 -0.16 0.00 -1.03 0.00 0.00 54.13 54.92 1cim s LEU 212 Cb -0.14 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.48 1cim s LEU 212 CO 0.02 0.03 1.78 0.50 0.23 0.00 0.00 176.35 178.91 1cim h LYS 213 N 4.61 0.55 -5.57 1.70 3.64 -1.22 -3.43 116.57 116.85 1cim h LYS 213 Ca -0.44 -0.05 -0.60 0.00 -1.27 0.00 0.00 60.65 58.29 1cim h LYS 213 Cb 1.21 -0.12 -0.10 0.00 -0.41 0.00 0.00 32.23 32.81 1cim h LYS 213 CO 0.69 0.40 0.03 -2.00 -2.27 0.00 0.00 179.45 176.30 1cim s GLU 214 N -6.02 4.19 0.57 1.90 2.12 -1.26 -5.02 118.70 115.18 1cim s GLU 214 Ca -0.13 0.48 -0.17 0.00 0.36 0.00 0.00 54.97 55.51 1cim s GLU 214 Cb 0.11 -3.58 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 1cim s GLU 214 CO 0.73 -0.20 1.07 -2.14 -0.54 0.00 0.00 175.26 174.18 1cim s PRO 215 N 1.81 3.35 0.28 4.30 0.02 -1.26 -4.64 135.00 138.86 1cim s PRO 215 Ca 0.26 1.33 -0.01 0.00 0.02 0.00 0.00 61.00 62.59 1cim s PRO 215 Cb -0.16 -2.03 -0.04 0.00 0.02 0.00 0.00 34.50 32.29 1cim s PRO 215 CO 0.10 -0.80 0.50 0.96 -0.33 0.00 0.00 177.00 177.42 1cim s ILE 216 N -2.23 5.11 0.09 2.83 -4.36 -0.54 -4.87 121.20 117.23 1cim s ILE 216 Ca 0.66 -0.29 0.05 0.00 -0.26 0.00 0.00 60.65 60.82 1cim s ILE 216 Cb -0.18 -3.78 -0.04 0.00 1.25 0.00 0.00 42.46 39.71 1cim s ILE 216 CO 0.32 -0.36 -0.02 -0.94 0.24 0.00 0.00 174.94 174.18 1cim s SER 217 N -3.50 4.94 0.12 4.36 1.04 -1.26 -1.74 113.70 117.65 1cim s SER 217 Ca 0.41 -0.20 0.05 0.00 0.48 0.00 0.00 55.95 56.69 1cim s SER 217 Cb -0.10 -1.15 -0.04 0.00 0.10 0.00 0.00 66.02 64.83 1cim s SER 217 CO 0.32 0.18 -0.12 0.68 0.98 0.00 0.00 173.24 175.28 1cim s VAL 218 N -1.28 1.18 0.67 5.02 -7.23 -0.42 -3.62 120.40 114.72 1cim s VAL 218 Ca 0.25 -1.75 -0.11 0.00 -1.81 0.00 0.00 61.98 58.56 1cim s VAL 218 Cb -0.12 -1.52 -0.01 0.00 0.56 0.00 0.00 36.38 35.30 1cim s VAL 218 CO 0.17 -0.52 1.07 -0.94 -0.31 0.00 0.00 175.10 174.57 1cim s SER 219 N -2.57 5.73 0.26 4.85 1.04 -1.16 -0.53 113.70 121.32 1cim s SER 219 Ca 0.09 1.30 -0.02 0.00 0.48 0.00 0.00 55.95 57.80 1cim s SER 219 Cb -0.03 -2.21 0.42 0.00 0.10 0.00 0.00 66.02 64.30 1cim s SER 219 CO 0.02 -1.18 1.86 -1.28 0.98 0.00 0.00 173.24 173.64 1cim h SER 220 N -0.54 0.96 1.02 7.02 0.87 -1.93 -0.97 113.55 119.99 1cim h SER 220 Ca -0.45 0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.04 1cim h SER 220 Cb 1.22 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.99 1cim h SER 220 CO 0.62 0.59 -0.46 1.05 -0.53 0.00 0.00 176.83 178.11 1cim h GLU 221 N 1.09 0.00 -0.28 2.24 9.09 -1.95 0.61 114.58 125.37 1cim h GLU 221 Ca 0.43 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.81 1cim h GLU 221 Cb 0.24 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.33 1cim h GLU 221 CO -0.19 0.46 0.04 1.96 0.05 0.00 0.00 179.01 181.33 1cim h GLN 222 N 0.00 0.47 -0.21 1.06 4.20 -1.73 -3.10 115.11 115.80 1cim h GLN 222 Ca -0.00 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 1cim h GLN 222 Cb 1.10 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 1cim h GLN 222 CO 0.06 0.58 -0.34 0.28 -0.67 0.00 0.00 178.83 178.74 1cim h VAL 223 N 0.29 1.29 -0.42 -0.54 2.07 -0.79 -3.02 116.25 115.12 1cim h VAL 223 Ca 0.09 -1.42 0.05 0.00 0.82 0.00 0.00 66.70 66.24 1cim h VAL 223 Cb 0.34 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1cim h VAL 223 CO 0.01 0.44 0.29 -0.07 0.02 0.00 0.00 177.57 178.25 1cim h LEU 224 N 0.37 0.31 -0.94 2.57 3.38 -0.88 -1.70 115.31 118.42 1cim h LEU 224 Ca 0.04 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1cim h LEU 224 Cb 0.77 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1cim h LEU 224 CO 0.06 0.21 -0.36 0.11 0.09 0.00 0.00 178.44 178.55 1cim h LYS 225 N 0.36 0.00 -0.50 1.13 1.57 -1.45 -2.74 116.57 114.95 1cim h LYS 225 Ca 0.18 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1cim h LYS 225 Cb 0.27 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 1cim h LYS 225 CO -0.04 0.36 0.10 0.74 -0.57 0.00 0.00 179.45 180.04 1cim h PHE 226 N 0.00 0.79 0.00 -1.35 -1.00 -1.40 -2.64 116.94 111.34 1cim h PHE 226 Ca -0.00 -0.08 0.00 0.00 2.81 0.00 0.00 57.97 60.70 1cim h PHE 226 Cb 0.89 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 40.22 1cim h PHE 226 CO 0.00 0.68 0.00 0.54 -1.61 0.00 0.00 178.31 177.92 1cim n ARG 227 N -4.27 0.49 0.00 1.51 1.74 -1.03 -2.83 116.66 112.26 1cim n ARG 227 Ca 0.03 0.04 0.13 0.00 -0.77 0.00 0.00 57.85 57.28 1cim n ARG 227 Cb 0.23 -1.50 0.26 0.00 -1.02 0.00 0.00 32.46 30.44 1cim n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1cim n LYS 228 N -1.18 1.61 -1.75 5.56 5.02 -0.99 -4.46 118.16 121.97 1cim n LYS 228 Ca 0.14 -1.17 -0.29 0.00 -2.02 0.00 0.00 58.31 54.96 1cim n LYS 228 Cb 0.14 -1.48 0.09 0.00 -0.02 0.00 0.00 35.03 33.77 1cim n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cim s LEU 229 N -2.19 2.53 -0.01 -0.35 1.43 -1.13 -4.91 118.68 114.05 1cim s LEU 229 Ca 0.28 1.02 0.06 0.00 -1.03 0.00 0.00 54.13 54.46 1cim s LEU 229 Cb 0.20 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.82 1cim s LEU 229 CO 0.41 -1.90 -0.19 0.20 0.23 0.00 0.00 176.35 175.11 1cim s ASN 230 N -4.27 2.18 0.11 2.29 0.02 0.19 -0.65 114.94 114.81 1cim s ASN 230 Ca 0.61 -0.34 -0.11 0.00 -1.02 0.00 0.00 52.86 52.00 1cim s ASN 230 Cb -0.12 -0.24 -0.14 0.00 0.02 0.00 0.00 41.25 40.76 1cim s ASN 230 CO 0.52 0.23 1.30 -0.26 0.02 0.00 0.00 177.10 178.91 1cim h PHE 231 N 5.67 1.01 -4.08 2.20 0.04 -1.50 -3.34 116.94 116.94 1cim h PHE 231 Ca -0.38 -0.46 -0.49 0.00 2.80 0.00 0.00 57.97 59.44 1cim h PHE 231 Cb 1.15 -0.15 0.06 0.00 2.20 0.00 0.00 35.95 39.21 1cim h PHE 231 CO 0.40 1.29 0.42 0.54 -0.60 0.00 0.00 178.31 180.36 1cim s ASN 232 N -7.13 5.89 0.82 2.17 4.22 -1.26 -4.40 114.94 115.26 1cim s ASN 232 Ca -0.10 2.13 -0.12 0.00 -2.14 0.00 0.00 52.86 52.63 1cim s ASN 232 Cb 0.09 -2.58 0.08 0.00 1.28 0.00 0.00 41.25 40.12 1cim s ASN 232 CO 0.90 -1.10 1.12 -0.83 -2.04 0.00 0.00 177.10 175.15 1cim s GLY 233 N -1.80 1.60 0.24 0.45 0.00 -1.26 -1.26 107.32 105.29 1cim s GLY 233 Ca 0.71 -0.40 -0.31 0.00 0.00 0.00 0.00 44.72 44.72 1cim s GLY 233 CO 0.26 0.07 1.44 -2.21 0.00 0.00 0.00 173.10 172.66 1cim n GLU 234 N -3.46 2.10 -2.12 2.90 2.13 -1.26 -2.78 120.64 118.15 1cim n GLU 234 Ca 0.07 0.75 -0.09 0.00 0.66 0.00 0.00 57.16 58.54 1cim n GLU 234 Cb 0.58 -2.42 -0.01 0.00 0.27 0.00 0.00 31.44 29.86 1cim n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1cim n GLY 235 N 2.26 0.05 3.60 8.31 0.00 -1.26 -5.05 105.19 113.11 1cim n GLY 235 Ca 0.12 -0.50 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 1cim n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cim s GLU 236 N -4.36 1.93 -0.04 1.61 2.02 -1.12 -5.09 118.70 113.65 1cim s GLU 236 Ca 0.00 -2.08 -0.39 0.00 0.02 0.00 0.00 54.97 52.52 1cim s GLU 236 Cb 0.00 -1.62 -0.18 0.00 0.10 0.00 0.00 34.13 32.42 1cim s GLU 236 CO 0.00 -0.03 1.29 -2.30 0.02 0.00 0.00 175.26 174.24 1cim n PRO 237 N -0.94 0.56 -2.28 0.39 -0.02 -1.26 -4.88 135.00 126.57 1cim n PRO 237 Ca -0.05 0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.21 1cim n PRO 237 Cb 0.66 -1.77 -0.03 0.00 -0.02 0.00 0.00 33.50 32.34 1cim n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1cim s GLU 238 N 0.80 4.38 -0.30 -0.52 2.12 -1.26 -4.78 118.70 119.14 1cim s GLU 238 Ca 0.90 1.95 -0.02 0.00 0.36 0.00 0.00 54.97 58.16 1cim s GLU 238 Cb -1.15 -3.28 0.10 0.00 0.26 0.00 0.00 34.13 30.05 1cim s GLU 238 CO 0.56 -0.34 0.10 -2.00 -0.54 0.00 0.00 175.26 173.05 1cim s GLU 239 N 0.94 0.56 0.29 4.30 2.56 -1.26 -5.05 118.70 121.04 1cim s GLU 239 Ca 0.61 -0.87 -0.30 0.00 0.00 0.00 0.00 54.97 54.41 1cim s GLU 239 Cb -0.34 -1.77 -0.11 0.00 2.00 0.00 0.00 34.13 33.92 1cim s GLU 239 CO 0.31 -0.97 1.51 -0.51 -0.56 0.00 0.00 175.26 175.04 1cim s LEU 240 N 1.77 4.36 -0.96 2.70 1.43 -1.26 -1.41 118.68 125.31 1cim s LEU 240 Ca 0.09 2.85 -0.22 0.00 -1.03 0.00 0.00 54.13 55.82 1cim s LEU 240 Cb -0.17 -3.64 0.08 0.00 0.03 0.00 0.00 46.19 42.50 1cim s LEU 240 CO -0.27 -0.81 1.31 -0.32 0.23 0.00 0.00 176.35 176.49 1cim s MET 241 N -0.70 3.56 0.06 1.70 -2.45 0.18 -4.72 119.30 116.92 1cim s MET 241 Ca 0.60 -1.31 0.02 0.00 -1.25 0.00 0.00 55.69 53.75 1cim s MET 241 Cb -0.45 -5.11 -0.03 0.00 1.25 0.00 0.00 34.83 30.49 1cim s MET 241 CO 0.48 -2.03 -0.07 0.14 1.05 0.00 0.00 175.02 174.59 1cim s VAL 242 N 4.14 0.55 -1.25 10.11 -7.23 -1.26 -4.38 120.40 121.08 1cim s VAL 242 Ca 0.40 -1.31 -0.03 0.00 -1.81 0.00 0.00 61.98 59.22 1cim s VAL 242 Cb -0.03 -0.90 0.00 0.00 0.56 0.00 0.00 36.38 36.02 1cim s VAL 242 CO -0.08 -0.53 1.06 0.47 -0.31 0.00 0.00 175.10 175.71 1cim n ASP 243 N 1.04 -3.63 -3.43 4.85 8.00 -0.25 -4.87 116.55 118.26 1cim n ASP 243 Ca -0.20 -0.59 -0.39 0.00 0.71 0.00 0.00 54.79 54.32 1cim n ASP 243 Cb 0.56 -5.07 0.00 0.00 -0.02 0.00 0.00 41.12 36.59 1cim n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1cim n ASN 244 N -3.07 7.72 -4.13 -2.24 6.94 -1.14 -4.90 115.26 114.44 1cim n ASN 244 Ca -0.18 -3.33 -0.14 0.00 -0.02 0.00 0.00 54.58 50.92 1cim n ASN 244 Cb 0.63 -1.29 -0.11 0.00 -2.36 0.00 0.00 39.78 36.65 1cim n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1cim s TRP 245 N -2.22 0.89 -0.11 -2.53 1.48 -1.26 -4.60 118.94 110.58 1cim s TRP 245 Ca 0.50 -0.61 -0.11 0.00 -1.06 0.00 0.00 56.10 54.82 1cim s TRP 245 Cb 0.21 -0.51 -0.05 0.00 -1.16 0.00 0.00 33.47 31.96 1cim s TRP 245 CO -0.13 -0.05 0.25 0.50 -4.06 0.00 0.00 176.95 173.46 1cim s ARG 246 N -2.33 3.88 0.78 3.25 3.52 -1.26 -4.96 118.95 121.83 1cim s ARG 246 Ca -0.01 0.05 -0.13 0.00 -0.13 0.00 0.00 55.73 55.51 1cim s ARG 246 Cb -0.05 -3.29 0.07 0.00 -1.56 0.00 0.00 34.95 30.11 1cim s ARG 246 CO -0.00 0.54 1.16 -2.14 -0.81 0.00 0.00 175.30 174.05 1cim s PRO 247 N -0.43 1.90 0.35 5.12 0.02 -1.26 -4.70 135.00 135.99 1cim s PRO 247 Ca 0.17 1.57 -0.29 0.00 0.02 0.00 0.00 61.00 62.47 1cim s PRO 247 Cb -0.13 -1.82 -0.11 0.00 0.02 0.00 0.00 34.50 32.45 1cim s PRO 247 CO 0.05 -1.98 1.51 0.00 -0.33 0.00 0.00 177.00 176.26 1cim s ALA 248 N -2.36 3.63 0.31 -1.55 0.00 -1.26 -4.47 121.76 116.06 1cim s ALA 248 Ca 0.69 1.55 0.06 0.00 0.00 0.00 0.00 51.96 54.27 1cim s ALA 248 Cb -0.25 -3.61 -0.02 0.00 0.00 0.00 0.00 23.12 19.24 1cim s ALA 248 CO 0.50 -1.01 0.40 -0.65 0.00 0.00 0.00 175.76 175.00 1cim s GLN 249 N -1.54 3.11 0.21 0.00 -1.52 0.22 -4.95 119.66 115.20 1cim s GLN 249 Ca 0.56 -1.00 -0.31 0.00 -1.95 0.00 0.00 55.36 52.66 1cim s GLN 249 Cb -0.46 -2.76 -0.10 0.00 -0.22 0.00 0.00 33.01 29.46 1cim s GLN 249 CO 0.57 0.18 1.53 -2.14 -0.25 0.00 0.00 175.29 175.18 1cim s PRO 250 N -4.08 4.22 0.35 2.91 0.02 -1.26 -4.55 135.00 132.61 1cim s PRO 250 Ca 0.41 2.37 0.04 0.00 0.02 0.00 0.00 61.00 63.84 1cim s PRO 250 Cb -0.09 -3.12 0.63 0.00 0.02 0.00 0.00 34.50 31.95 1cim s PRO 250 CO 0.29 -0.54 1.92 1.25 -0.33 0.00 0.00 177.00 179.59 1cim h LEU 251 N 5.88 0.56 -2.55 -5.54 5.85 -1.93 -3.44 115.31 114.14 1cim h LEU 251 Ca -0.44 -0.07 -0.47 0.00 0.84 0.00 0.00 57.88 57.74 1cim h LEU 251 Cb 1.21 -0.14 0.02 0.00 0.37 0.00 0.00 40.66 42.12 1cim h LEU 251 CO 0.85 0.54 -0.91 0.29 -0.34 0.00 0.00 178.44 178.87 1cim n LYS 252 N -4.34 -2.39 -0.96 1.25 5.02 -1.26 -2.74 118.16 112.73 1cim n LYS 252 Ca 0.03 0.43 0.00 0.00 -2.02 0.00 0.00 58.31 56.75 1cim n LYS 252 Cb 0.18 -4.33 0.00 0.00 -0.02 0.00 0.00 35.03 30.86 1cim n LYS 252 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1cim n ASN 253 N -2.82 -2.86 -4.86 4.39 5.03 -1.26 -4.99 115.26 107.88 1cim n ASN 253 Ca -0.21 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 54.93 1cim n ASN 253 Cb 0.64 -1.17 -0.00 0.00 -1.02 0.00 0.00 39.78 38.23 1cim n ASN 253 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1cim s ARG 254 N -0.48 3.71 0.01 3.52 0.52 -1.11 -5.09 118.95 120.03 1cim s ARG 254 Ca 0.00 0.81 0.08 0.00 -0.52 0.00 0.00 55.73 56.10 1cim s ARG 254 Cb 0.00 -2.10 -0.03 0.00 0.52 0.00 0.00 34.95 33.34 1cim s ARG 254 CO 0.00 -0.47 -0.23 -1.14 0.02 0.00 0.00 175.30 173.48 1cim s GLN 255 N -4.83 2.06 -0.21 3.54 0.74 -1.26 -5.03 119.66 114.68 1cim s GLN 255 Ca 0.56 -0.96 -0.15 0.00 0.05 0.00 0.00 55.36 54.86 1cim s GLN 255 Cb -0.11 -2.10 -0.04 0.00 1.10 0.00 0.00 33.01 31.86 1cim s GLN 255 CO 0.47 0.55 0.36 0.42 -0.55 0.00 0.00 175.29 176.54 1cim s ILE 256 N -0.75 5.22 0.08 -2.34 1.01 -1.26 -4.70 121.20 118.46 1cim s ILE 256 Ca 0.12 0.62 -0.05 0.00 0.00 0.00 0.00 60.65 61.34 1cim s ILE 256 Cb -0.10 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.63 1cim s ILE 256 CO 0.01 0.26 0.31 -0.54 0.00 0.00 0.00 174.94 174.98 1cim s LYS 257 N 1.31 3.58 0.08 2.79 1.02 -0.61 -1.07 119.74 126.84 1cim s LYS 257 Ca 0.17 -0.14 0.09 0.00 0.02 0.00 0.00 55.97 56.11 1cim s LYS 257 Cb -0.15 -2.97 -0.04 0.00 -0.52 0.00 0.00 37.83 34.16 1cim s LYS 257 CO 0.07 0.56 -0.22 0.00 -0.92 0.00 0.00 175.35 174.84 1cim s ALA 258 N -1.50 2.50 -2.29 5.17 0.00 0.35 -1.79 121.76 124.20 1cim s ALA 258 Ca 0.35 -1.32 0.20 0.00 0.00 0.00 0.00 51.96 51.20 1cim s ALA 258 Cb -0.13 -0.58 0.63 0.00 0.00 0.00 0.00 23.12 23.04 1cim s ALA 258 CO 0.22 0.56 1.48 -1.13 0.00 0.00 0.00 175.76 176.90 1cim n SER 259 N 1.24 2.12 0.00 0.00 3.41 -0.07 -1.47 113.62 118.85 1cim n SER 259 Ca -0.17 -1.81 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 1cim n SER 259 Cb 0.52 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1cim n SER 259 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10