#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cgp h THR 10 N 0.00 0.22 -0.68 3.45 2.02 -2.01 -1.55 112.91 114.37 1cgp h THR 10 Ca 0.00 -0.05 0.10 0.00 0.77 0.00 0.00 66.41 67.23 1cgp h THR 10 Cb 0.00 0.06 -0.11 0.00 -1.74 0.00 0.00 68.15 66.36 1cgp h THR 10 CO 0.00 0.03 -0.27 -0.11 0.37 0.00 0.00 175.52 175.53 1cgp n LEU 11 N -5.28 -0.46 0.01 2.58 -0.00 -1.26 -1.17 117.00 111.42 1cgp n LEU 11 Ca 0.24 1.18 -0.11 0.00 -0.00 0.00 0.00 56.01 57.32 1cgp n LEU 11 Cb 0.77 -0.26 0.03 0.00 -0.00 0.00 0.00 43.42 43.95 1cgp n LEU 11 CO 0.03 -1.06 0.42 -0.33 -0.00 0.00 0.00 177.39 176.45 1cgp h GLU 12 N 0.00 0.56 -0.50 1.96 4.39 -1.71 0.02 114.58 119.31 1cgp h GLU 12 Ca 0.23 -0.39 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 1cgp h GLU 12 Cb 0.40 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1cgp h GLU 12 CO -0.67 1.01 0.31 2.35 -1.16 0.00 0.00 179.01 180.85 1cgp h TRP 13 N 0.42 0.66 0.30 4.33 7.01 -1.39 -1.23 115.95 126.04 1cgp h TRP 13 Ca -0.01 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 1cgp h TRP 13 Cb 1.19 -0.22 -0.00 0.00 -2.10 0.00 0.00 29.16 28.03 1cgp h TRP 13 CO 0.05 0.45 -0.18 0.35 -2.79 0.00 0.00 178.44 176.32 1cgp h PHE 14 N 0.68 -0.47 -0.99 2.65 3.57 -0.63 -3.31 116.94 118.44 1cgp h PHE 14 Ca 0.18 -0.01 0.28 0.00 3.53 0.00 0.00 57.97 61.95 1cgp h PHE 14 Cb -0.02 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.83 1cgp h PHE 14 CO -0.03 -0.27 0.70 -0.07 -2.23 0.00 0.00 178.31 176.41 1cgp h LEU 15 N -0.44 0.09 -1.79 0.59 3.38 -0.83 0.11 115.31 116.42 1cgp h LEU 15 Ca -0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1cgp h LEU 15 Cb 0.35 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1cgp h LEU 15 CO 0.05 0.02 0.21 0.77 0.09 0.00 0.00 178.44 179.58 1cgp h SER 16 N 0.08 0.00 -2.13 -0.43 4.64 -1.31 -2.80 113.55 111.60 1cgp h SER 16 Ca 0.48 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.23 1cgp h SER 16 Cb 1.78 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 63.47 1cgp h SER 16 CO -0.05 0.00 -0.84 0.00 -0.87 0.00 0.00 176.83 175.07 1cgp n HIS 17 N -2.60 2.06 -3.77 4.77 -0.00 0.03 -4.97 115.22 110.74 1cgp n HIS 17 Ca -0.02 -3.91 -0.13 0.00 -0.00 0.00 0.00 57.72 53.67 1cgp n HIS 17 Cb 0.25 -0.47 -0.10 0.00 -0.00 0.00 0.00 29.99 29.67 1cgp n HIS 17 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1cgp s HIS 19 N -0.22 3.21 -0.18 0.00 3.76 -0.45 -4.76 115.29 116.65 1cgp s HIS 19 Ca -0.04 -0.26 -0.28 0.00 -0.15 0.00 0.00 55.06 54.33 1cgp s HIS 19 Cb -0.03 -2.68 -0.00 0.00 1.11 0.00 0.00 32.58 30.98 1cgp s HIS 19 CO 0.01 -0.52 0.98 0.42 -0.85 0.00 0.00 174.74 174.78 1cgp s ILE 20 N 1.93 4.76 0.22 0.60 -1.09 -1.26 -1.25 121.20 125.11 1cgp s ILE 20 Ca 0.09 1.95 0.09 0.00 -2.23 0.00 0.00 60.65 60.56 1cgp s ILE 20 Cb -0.17 -4.27 -0.05 0.00 -1.58 0.00 0.00 42.46 36.39 1cgp s ILE 20 CO 0.12 -0.07 -0.17 -1.00 -1.23 0.00 0.00 174.94 172.58 1cgp s HIS 21 N 2.58 1.94 -0.16 3.97 3.76 0.02 -4.96 115.29 122.44 1cgp s HIS 21 Ca 0.44 -0.47 0.01 0.00 -0.15 0.00 0.00 55.06 54.90 1cgp s HIS 21 Cb -0.16 -0.89 0.01 0.00 1.11 0.00 0.00 32.58 32.64 1cgp s HIS 21 CO 0.11 0.48 -0.19 0.15 -0.85 0.00 0.00 174.74 174.45 1cgp s LYS 22 N -3.42 3.10 -0.18 1.40 1.02 -1.26 -0.82 119.74 119.59 1cgp s LYS 22 Ca 0.24 -0.80 -0.07 0.00 0.02 0.00 0.00 55.97 55.35 1cgp s LYS 22 Cb -0.03 -2.55 -0.04 0.00 -0.52 0.00 0.00 37.83 34.69 1cgp s LYS 22 CO 0.10 -0.05 0.07 0.71 -0.92 0.00 0.00 175.35 175.26 1cgp s TYR 23 N 0.93 3.29 0.72 3.18 2.02 0.73 -4.95 117.35 123.27 1cgp s TYR 23 Ca -0.04 0.14 -0.11 0.00 -0.37 0.00 0.00 57.07 56.70 1cgp s TYR 23 Cb -0.15 -2.06 0.02 0.00 -0.40 0.00 0.00 41.96 39.37 1cgp s TYR 23 CO -0.03 0.23 1.07 -1.25 -1.57 0.00 0.00 175.55 173.99 1cgp s PRO 24 N 0.21 2.76 0.24 -1.71 0.04 -1.26 -0.98 135.00 134.29 1cgp s PRO 24 Ca 0.05 0.98 -0.31 0.00 0.04 0.00 0.00 61.00 61.76 1cgp s PRO 24 Cb -0.12 -1.97 -0.13 0.00 0.04 0.00 0.00 34.50 32.32 1cgp s PRO 24 CO 0.00 -1.23 1.45 0.43 0.04 0.00 0.00 177.00 177.68 1cgp n SER 25 N -3.22 2.90 0.00 6.66 7.64 -1.24 -1.25 113.62 125.11 1cgp n SER 25 Ca 0.08 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.09 1cgp n SER 25 Cb 0.54 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 1cgp n SER 25 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1cgp n LYS 26 N 2.20 0.00 -2.17 1.43 5.02 0.21 -4.98 118.16 119.87 1cgp n LYS 26 Ca 0.12 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 56.00 1cgp n LYS 26 Cb 0.32 -2.08 -0.02 0.00 -0.02 0.00 0.00 35.03 33.22 1cgp n LYS 26 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1cgp s SER 27 N -3.27 6.84 -0.20 4.39 1.04 -0.38 -4.65 113.70 117.48 1cgp s SER 27 Ca 0.00 2.63 -0.17 0.00 0.48 0.00 0.00 55.95 58.89 1cgp s SER 27 Cb 0.00 -2.65 -0.04 0.00 0.10 0.00 0.00 66.02 63.44 1cgp s SER 27 CO 0.00 -0.48 0.43 -0.89 0.98 0.00 0.00 173.24 173.28 1cgp s THR 28 N -1.14 5.18 0.00 2.02 2.01 -1.26 -0.54 115.64 121.91 1cgp s THR 28 Ca 0.48 0.78 0.00 0.00 0.31 0.00 0.00 61.69 63.26 1cgp s THR 28 Cb -0.39 -3.76 0.00 0.00 0.01 0.00 0.00 72.50 68.36 1cgp s THR 28 CO 0.51 0.24 0.00 0.18 -0.69 0.00 0.00 174.62 174.86 1cgp n LEU 29 N 4.51 0.12 -4.75 4.42 4.77 -1.04 -4.95 117.00 120.07 1cgp n LEU 29 Ca -0.07 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.51 1cgp n LEU 29 Cb 0.51 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.55 1cgp n LEU 29 CO 0.41 0.00 0.73 -0.63 -1.33 0.00 0.00 177.39 176.56 1cgp s ILE 30 N 0.00 3.76 -0.10 -0.08 1.01 -1.20 -4.94 121.20 119.65 1cgp s ILE 30 Ca 0.00 1.77 -0.00 0.00 0.00 0.00 0.00 60.65 62.42 1cgp s ILE 30 Cb 0.00 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.32 1cgp s ILE 30 CO 0.00 0.42 -0.08 -1.00 0.00 0.00 0.00 174.94 174.28 1cgp s HIS 31 N -1.18 2.92 0.57 3.97 3.76 -1.26 -2.89 115.29 121.19 1cgp s HIS 31 Ca 0.43 -0.18 -0.19 0.00 -0.15 0.00 0.00 55.06 54.97 1cgp s HIS 31 Cb -0.29 -1.79 -0.05 0.00 1.11 0.00 0.00 32.58 31.56 1cgp s HIS 31 CO 0.37 0.14 1.18 -1.14 -0.85 0.00 0.00 174.74 174.44 1cgp s GLN 32 N -0.32 3.14 0.00 1.40 0.74 -1.18 -2.18 119.66 121.26 1cgp s GLN 32 Ca 0.04 1.77 0.00 0.00 0.05 0.00 0.00 55.36 57.22 1cgp s GLN 32 Cb -0.13 -1.98 0.00 0.00 1.10 0.00 0.00 33.01 32.00 1cgp s GLN 32 CO 0.02 -1.06 0.00 0.41 -0.55 0.00 0.00 175.29 174.11 1cgp n GLY 33 N 0.40 3.11 3.67 2.59 0.00 -0.06 -4.93 105.19 109.98 1cgp n GLY 33 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1cgp n GLY 33 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1cgp n GLU 34 N -1.05 -0.07 -2.66 1.61 1.02 -0.93 -4.50 120.64 114.07 1cgp n GLU 34 Ca 0.00 0.06 -0.41 0.00 -0.02 0.00 0.00 57.16 56.79 1cgp n GLU 34 Cb 0.00 -2.40 -0.04 0.00 -0.02 0.00 0.00 31.44 28.98 1cgp n GLU 34 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1cgp s LYS 35 N -4.28 4.66 -0.04 3.49 0.00 -1.26 -0.24 119.74 122.07 1cgp s LYS 35 Ca 0.71 1.54 -0.30 0.00 0.00 0.00 0.00 55.97 57.91 1cgp s LYS 35 Cb -0.27 -3.35 -0.03 0.00 0.00 0.00 0.00 37.83 34.18 1cgp s LYS 35 CO 0.54 0.15 1.17 0.00 0.00 0.00 0.00 175.35 177.20 1cgp s ALA 36 N 0.01 3.45 0.00 0.59 0.00 0.07 -4.80 121.76 121.08 1cgp s ALA 36 Ca 0.48 0.62 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1cgp s ALA 36 Cb -0.25 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.38 1cgp s ALA 36 CO 0.31 -0.68 0.00 -1.91 0.00 0.00 0.00 175.76 173.48 1cgp n GLU 37 N 4.96 0.00 -3.84 0.00 4.07 -1.26 -4.70 120.64 119.86 1cgp n GLU 37 Ca 0.10 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 57.05 1cgp n GLU 37 Cb 0.47 -0.11 -0.16 0.00 -0.06 0.00 0.00 31.44 31.58 1cgp n GLU 37 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 1cgp s THR 38 N 0.00 0.03 0.21 6.31 2.01 -1.26 -1.06 115.64 121.87 1cgp s THR 38 Ca 0.00 0.13 -0.07 0.00 0.31 0.00 0.00 61.69 62.06 1cgp s THR 38 Cb 0.00 -0.13 -0.06 0.00 0.01 0.00 0.00 72.50 72.32 1cgp s THR 38 CO 0.00 0.09 0.49 -0.22 -0.69 0.00 0.00 174.62 174.29 1cgp s LEU 39 N 0.84 4.19 0.22 4.42 2.96 -0.63 -4.84 118.68 125.84 1cgp s LEU 39 Ca -0.07 0.76 0.08 0.00 -0.22 0.00 0.00 54.13 54.68 1cgp s LEU 39 Cb -0.11 -3.52 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 1cgp s LEU 39 CO -0.02 -0.05 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.50 1cgp s TYR 40 N -1.81 1.84 -0.04 5.38 1.51 0.07 -1.90 117.35 122.40 1cgp s TYR 40 Ca 0.44 -0.54 -0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1cgp s TYR 40 Cb -0.11 -0.85 0.03 0.00 -0.11 0.00 0.00 41.96 40.91 1cgp s TYR 40 CO 0.24 0.42 0.01 -0.47 -1.11 0.00 0.00 175.55 174.64 1cgp s TYR 41 N -2.89 0.35 -0.46 2.71 6.14 -0.18 -1.87 117.35 121.14 1cgp s TYR 41 Ca 0.24 0.01 -0.29 0.00 0.64 0.00 0.00 57.07 57.68 1cgp s TYR 41 Cb -0.01 -0.50 0.02 0.00 0.42 0.00 0.00 41.96 41.88 1cgp s TYR 41 CO 0.09 -0.18 1.31 0.42 0.64 0.00 0.00 175.55 177.82 1cgp s ILE 42 N 1.40 4.00 -0.05 3.14 1.01 -0.16 -0.46 121.20 130.08 1cgp s ILE 42 Ca -0.04 0.99 -0.13 0.00 0.00 0.00 0.00 60.65 61.47 1cgp s ILE 42 Cb -0.13 -4.40 -0.30 0.00 0.01 0.00 0.00 42.46 37.63 1cgp s ILE 42 CO -0.03 -0.93 0.68 0.58 0.00 0.00 0.00 174.94 175.24 1cgp h VAL 43 N 6.37 1.00 -3.84 2.92 2.07 -0.90 0.79 116.25 124.65 1cgp h VAL 43 Ca -0.26 -2.50 -0.13 0.00 0.82 0.00 0.00 66.70 64.63 1cgp h VAL 43 Cb 1.09 2.79 -0.18 0.00 -1.52 0.00 0.00 31.29 33.47 1cgp h VAL 43 CO 1.12 0.82 -0.55 -0.75 0.02 0.00 0.00 177.57 178.23 1cgp s LYS 44 N -2.55 0.57 0.00 1.57 2.36 -0.42 -4.68 119.74 116.58 1cgp s LYS 44 Ca -0.16 -0.77 0.00 0.00 -2.55 0.00 0.00 55.97 52.49 1cgp s LYS 44 Cb 0.05 0.22 0.00 0.00 -1.05 0.00 0.00 37.83 37.05 1cgp s LYS 44 CO 0.84 -0.14 0.00 0.41 1.55 0.00 0.00 175.35 178.02 1cgp n GLY 45 N 0.79 0.74 3.16 5.54 0.00 -1.26 -1.25 105.19 112.91 1cgp n GLY 45 Ca -0.19 -1.95 -0.24 0.00 0.00 0.00 0.00 46.02 43.64 1cgp n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cgp s SER 46 N -0.66 1.97 0.10 1.61 0.01 -1.26 -1.45 113.70 114.02 1cgp s SER 46 Ca 0.00 -0.33 0.06 0.00 1.31 0.00 0.00 55.95 57.00 1cgp s SER 46 Cb 0.00 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.99 1cgp s SER 46 CO 0.00 0.19 -0.16 -0.69 0.41 0.00 0.00 173.24 172.99 1cgp s VAL 47 N -0.45 1.34 -0.12 3.43 1.01 -0.63 0.23 120.40 125.22 1cgp s VAL 47 Ca 0.06 -1.51 0.03 0.00 0.00 0.00 0.00 61.98 60.56 1cgp s VAL 47 Cb -0.07 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 34.97 1cgp s VAL 47 CO -0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 175.10 174.62 1cgp s ALA 48 N -1.55 2.22 -0.28 5.51 0.00 -0.42 -0.99 121.76 126.25 1cgp s ALA 48 Ca 0.04 -1.03 -0.19 0.00 0.00 0.00 0.00 51.96 50.79 1cgp s ALA 48 Cb -0.08 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.11 1cgp s ALA 48 CO 0.03 0.14 0.55 0.08 0.00 0.00 0.00 175.76 176.56 1cgp s VAL 49 N 0.56 5.02 0.05 0.00 1.01 0.42 -1.26 120.40 126.20 1cgp s VAL 49 Ca -0.13 0.83 -0.02 0.00 0.00 0.00 0.00 61.98 62.65 1cgp s VAL 49 Cb -0.17 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 1cgp s VAL 49 CO 0.04 -0.01 0.01 -1.48 0.00 0.00 0.00 175.10 173.66 1cgp s LEU 50 N 2.41 2.27 0.04 3.92 0.05 0.31 -0.26 118.68 127.41 1cgp s LEU 50 Ca 0.22 -0.84 0.05 0.00 0.05 0.00 0.00 54.13 53.62 1cgp s LEU 50 Cb -0.15 0.32 -0.02 0.00 -2.05 0.00 0.00 46.19 44.28 1cgp s LEU 50 CO 0.10 -0.56 -0.16 0.27 -0.55 0.00 0.00 176.35 175.45 1cgp s ILE 51 N -3.42 1.26 0.11 1.48 -4.36 -0.63 -0.49 121.20 115.15 1cgp s ILE 51 Ca 0.02 -1.04 0.07 0.00 -0.26 0.00 0.00 60.65 59.44 1cgp s ILE 51 Cb 0.04 -1.12 -0.03 0.00 1.25 0.00 0.00 42.46 42.59 1cgp s ILE 51 CO -0.08 0.06 -0.18 -0.54 0.24 0.00 0.00 174.94 174.44 1cgp s LYS 52 N -1.13 1.07 0.35 0.37 1.02 -1.26 -0.85 119.74 119.30 1cgp s LYS 52 Ca 0.03 -1.16 -0.11 0.00 0.02 0.00 0.00 55.97 54.75 1cgp s LYS 52 Cb -0.08 -1.21 -0.07 0.00 -0.52 0.00 0.00 37.83 35.95 1cgp s LYS 52 CO 0.01 0.27 0.71 0.34 -0.92 0.00 0.00 175.35 175.76 1cgp s ASP 53 N -2.04 6.59 0.57 2.83 2.15 0.10 -4.97 116.67 121.90 1cgp s ASP 53 Ca 0.06 1.09 0.27 0.00 0.43 0.00 0.00 52.55 54.41 1cgp s ASP 53 Cb -0.09 -2.30 1.56 0.00 -0.30 0.00 0.00 42.92 41.79 1cgp s ASP 53 CO 0.04 -0.29 2.04 -0.33 -0.17 0.00 0.00 175.17 176.46 1cgp h GLU 54 N 1.69 0.00 -0.84 4.34 3.07 -2.01 0.44 114.58 121.27 1cgp h GLU 54 Ca -0.47 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.22 1cgp h GLU 54 Cb 1.18 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 28.99 1cgp h GLU 54 CO 0.65 0.00 0.21 0.39 -1.40 0.00 0.00 179.01 178.87 1cgp n GLU 55 N -3.93 2.87 0.00 2.33 -0.58 -1.26 -4.96 120.64 115.11 1cgp n GLU 55 Ca 0.04 -2.15 0.00 0.00 -0.42 0.00 0.00 57.16 54.63 1cgp n GLU 55 Cb 0.43 -1.94 0.00 0.00 -0.57 0.00 0.00 31.44 29.36 1cgp n GLU 55 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1cgp n GLY 56 N -0.07 2.94 3.76 0.62 0.00 0.16 -5.06 105.19 107.53 1cgp n GLY 56 Ca 0.30 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.91 1cgp n GLY 56 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1cgp s LYS 57 N -0.03 4.36 0.04 1.61 2.47 -1.25 -4.58 119.74 122.36 1cgp s LYS 57 Ca 0.00 2.18 0.05 0.00 -1.56 0.00 0.00 55.97 56.65 1cgp s LYS 57 Cb 0.00 -3.10 -0.02 0.00 -1.46 0.00 0.00 37.83 33.24 1cgp s LYS 57 CO 0.00 -0.22 -0.15 -1.83 0.16 0.00 0.00 175.35 173.31 1cgp s GLU 58 N -1.23 0.99 -0.04 4.03 -1.05 -1.26 0.01 118.70 120.15 1cgp s GLU 58 Ca 0.52 -0.80 0.05 0.00 -0.15 0.00 0.00 54.97 54.59 1cgp s GLU 58 Cb -0.39 -1.01 -0.01 0.00 -0.44 0.00 0.00 34.13 32.27 1cgp s GLU 58 CO 0.48 0.25 -0.20 1.41 0.95 0.00 0.00 175.26 178.15 1cgp s MET 59 N -1.20 1.88 -0.11 -4.83 -2.45 -0.03 -4.72 119.30 107.83 1cgp s MET 59 Ca 0.02 -0.70 -0.25 0.00 -1.25 0.00 0.00 55.69 53.51 1cgp s MET 59 Cb -0.08 -1.67 -0.02 0.00 1.25 0.00 0.00 34.83 34.30 1cgp s MET 59 CO 0.01 0.33 0.80 0.42 1.05 0.00 0.00 175.02 177.64 1cgp s ILE 60 N -0.17 4.94 -0.04 10.11 1.01 -0.53 -1.61 121.20 134.91 1cgp s ILE 60 Ca 0.00 1.62 0.01 0.00 0.00 0.00 0.00 60.65 62.28 1cgp s ILE 60 Cb -0.11 -4.13 -0.26 0.00 0.01 0.00 0.00 42.46 37.98 1cgp s ILE 60 CO 0.01 0.12 0.70 -0.07 0.00 0.00 0.00 174.94 175.70 1cgp h LEU 61 N 7.62 0.28 -7.01 2.97 3.38 -0.96 -3.44 115.31 118.15 1cgp h LEU 61 Ca -0.35 -0.48 0.31 0.00 0.09 0.00 0.00 57.88 57.46 1cgp h LEU 61 Cb 1.16 -0.09 -0.20 0.00 0.09 0.00 0.00 40.66 41.63 1cgp h LEU 61 CO 0.80 1.41 0.94 -0.94 0.09 0.00 0.00 178.44 180.74 1cgp s SER 62 N -6.74 -0.04 -0.13 -0.43 1.04 -1.09 -5.00 113.70 101.29 1cgp s SER 62 Ca -0.11 -0.00 -0.07 0.00 0.48 0.00 0.00 55.95 56.25 1cgp s SER 62 Cb 0.07 0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 1cgp s SER 62 CO 0.82 -0.08 0.12 -0.31 0.98 0.00 0.00 173.24 174.77 1cgp s TYR 63 N -2.14 3.51 -0.02 5.02 2.02 -1.26 -0.44 117.35 124.04 1cgp s TYR 63 Ca 0.11 0.45 0.04 0.00 -0.37 0.00 0.00 57.07 57.30 1cgp s TYR 63 Cb -0.01 -1.97 -0.03 0.00 -0.40 0.00 0.00 41.96 39.56 1cgp s TYR 63 CO -0.03 0.62 -0.13 -1.17 -1.57 0.00 0.00 175.55 173.27 1cgp s LEU 64 N -0.74 2.84 0.00 -1.29 2.96 -0.16 -4.96 118.68 117.33 1cgp s LEU 64 Ca 0.13 -0.21 0.01 0.00 -0.22 0.00 0.00 54.13 53.85 1cgp s LEU 64 Cb -0.12 -1.62 -0.00 0.00 0.50 0.00 0.00 46.19 44.95 1cgp s LEU 64 CO 0.03 0.32 0.05 0.59 -1.32 0.00 0.00 176.35 176.01 1cgp n ASN 65 N 2.01 2.27 -4.68 3.68 4.13 -1.26 -1.60 115.26 119.81 1cgp n ASN 65 Ca -0.17 -2.67 -0.39 0.00 1.68 0.00 0.00 54.58 53.04 1cgp n ASN 65 Cb 0.52 0.48 0.04 0.00 -1.54 0.00 0.00 39.78 39.29 1cgp n ASN 65 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1cgp n GLN 66 N -0.85 1.32 0.00 3.52 10.64 -0.53 -2.51 117.38 128.97 1cgp n GLN 66 Ca -0.11 0.49 0.00 0.00 -1.83 0.00 0.00 57.00 55.55 1cgp n GLN 66 Cb 0.48 -2.34 0.00 0.00 -0.86 0.00 0.00 30.24 27.51 1cgp n GLN 66 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1cgp n GLY 67 N 1.02 1.58 3.85 2.61 0.00 0.27 -5.02 105.19 109.50 1cgp n GLY 67 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1cgp n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cgp s ASP 68 N -1.73 6.77 0.36 1.61 1.01 -1.05 -4.83 116.67 118.82 1cgp s ASP 68 Ca 0.00 1.00 -0.25 0.00 0.71 0.00 0.00 52.55 54.01 1cgp s ASP 68 Cb 0.00 -2.26 -0.10 0.00 1.01 0.00 0.00 42.92 41.57 1cgp s ASP 68 CO 0.00 0.11 0.96 -0.36 0.21 0.00 0.00 175.17 176.09 1cgp s PHE 69 N -1.46 3.56 -0.03 4.23 0.08 -1.26 -0.99 117.98 122.11 1cgp s PHE 69 Ca 0.37 1.73 0.06 0.00 0.12 0.00 0.00 56.93 59.21 1cgp s PHE 69 Cb -0.15 -2.93 -0.01 0.00 -0.57 0.00 0.00 43.02 39.36 1cgp s PHE 69 CO 0.19 0.05 -0.22 0.42 -0.10 0.00 0.00 175.22 175.56 1cgp s ILE 70 N -1.76 1.74 0.00 0.64 1.01 -0.78 -4.79 121.20 117.26 1cgp s ILE 70 Ca 0.54 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 60.26 1cgp s ILE 70 Cb -0.17 -1.46 0.00 0.00 0.01 0.00 0.00 42.46 40.85 1cgp s ILE 70 CO 0.22 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.26 1cgp n GLY 71 N 2.71 0.66 0.29 6.18 0.00 -1.26 -0.75 105.19 113.01 1cgp n GLY 71 Ca -0.16 -0.48 -0.07 0.00 0.00 0.00 0.00 46.02 45.31 1cgp n GLY 71 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1cgp h GLU 72 N 0.57 0.99 0.00 1.61 9.09 -1.91 -3.31 114.58 121.62 1cgp h GLU 72 Ca 0.00 -0.18 0.00 0.00 0.05 0.00 0.00 59.36 59.23 1cgp h GLU 72 Cb 0.00 -0.16 0.00 0.00 -1.65 0.00 0.00 28.75 26.94 1cgp h GLU 72 CO 0.00 0.83 0.02 1.28 0.05 0.00 0.00 179.01 181.19 1cgp n LEU 73 N -4.41 0.00 -0.03 3.06 4.32 -1.26 -0.91 117.00 117.78 1cgp n LEU 73 Ca 0.05 0.25 0.03 0.00 -0.02 0.00 0.00 56.01 56.32 1cgp n LEU 73 Cb 0.17 -0.25 -0.15 0.00 -1.62 0.00 0.00 43.42 41.58 1cgp n LEU 73 CO 0.39 -0.25 -0.78 0.61 -1.22 0.00 0.00 177.39 176.14 1cgp n GLY 74 N -1.23 -1.05 0.45 -0.72 0.00 -1.25 -4.49 105.19 96.91 1cgp n GLY 74 Ca 0.00 -0.40 0.27 0.00 0.00 0.00 0.00 46.02 45.89 1cgp n GLY 74 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1cgp h LEU 75 N 0.00 0.00 0.01 0.99 5.85 -1.24 -2.05 115.31 118.87 1cgp h LEU 75 Ca -0.19 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.22 1cgp h LEU 75 Cb 1.45 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.43 1cgp h LEU 75 CO 0.01 0.00 -1.83 0.49 -0.34 0.00 0.00 178.44 176.78 1cgp n PHE 76 N -3.99 0.88 -4.41 1.25 3.72 -1.26 -4.90 117.46 108.74 1cgp n PHE 76 Ca 0.16 0.30 -0.25 0.00 -0.05 0.00 0.00 57.45 57.62 1cgp n PHE 76 Cb 0.93 -1.16 -0.17 0.00 -0.94 0.00 0.00 39.48 38.15 1cgp n PHE 76 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1cgp s GLU 77 N -2.58 1.59 -0.11 -1.08 -6.30 -0.77 -5.08 118.70 104.37 1cgp s GLU 77 Ca -0.07 -0.35 -0.34 0.00 -2.50 0.00 0.00 54.97 51.71 1cgp s GLU 77 Cb 0.08 -1.39 -0.11 0.00 0.00 0.00 0.00 34.13 32.71 1cgp s GLU 77 CO 0.82 -0.04 1.93 -1.91 0.02 0.00 0.00 175.26 176.08 1cgp n GLU 78 N 4.05 2.15 -1.37 4.30 4.07 -1.26 -3.60 120.64 128.98 1cgp n GLU 78 Ca -0.21 0.77 0.00 0.00 -0.06 0.00 0.00 57.16 57.66 1cgp n GLU 78 Cb 0.51 -2.69 0.00 0.00 -0.06 0.00 0.00 31.44 29.20 1cgp n GLU 78 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1cgp n GLY 79 N 4.62 0.99 3.83 8.31 0.00 -1.26 -5.08 105.19 116.60 1cgp n GLY 79 Ca 0.24 -0.39 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 1cgp n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cgp s GLN 80 N -2.78 3.04 0.47 1.61 -0.21 -1.24 -4.97 119.66 115.58 1cgp s GLN 80 Ca 0.00 -0.79 -0.12 0.00 0.02 0.00 0.00 55.36 54.47 1cgp s GLN 80 Cb 0.00 -2.73 -0.06 0.00 1.00 0.00 0.00 33.01 31.22 1cgp s GLN 80 CO 0.00 0.50 0.86 -1.21 -2.12 0.00 0.00 175.29 173.32 1cgp s GLU 81 N -3.10 3.78 0.11 2.91 2.02 -1.26 -0.75 118.70 122.40 1cgp s GLU 81 Ca 0.32 0.61 -0.31 0.00 0.02 0.00 0.00 54.97 55.60 1cgp s GLU 81 Cb -0.10 -2.28 -0.08 0.00 0.10 0.00 0.00 34.13 31.77 1cgp s GLU 81 CO 0.25 -0.18 1.35 1.03 0.02 0.00 0.00 175.26 177.73 1cgp s ARG 82 N -4.17 4.34 0.46 1.61 0.52 0.67 -4.72 118.95 117.66 1cgp s ARG 82 Ca 0.53 2.02 0.26 0.00 -0.52 0.00 0.00 55.73 58.03 1cgp s ARG 82 Cb -0.10 -3.26 0.88 0.00 0.52 0.00 0.00 34.95 32.99 1cgp s ARG 82 CO 0.36 -0.40 1.80 0.66 0.02 0.00 0.00 175.30 177.74 1cgp h SER 83 N 6.76 0.00 -5.22 0.23 4.64 -1.91 -0.13 113.55 117.93 1cgp h SER 83 Ca -0.42 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.82 1cgp h SER 83 Cb 1.21 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.24 1cgp h SER 83 CO 0.85 0.14 0.01 0.00 -0.87 0.00 0.00 176.83 176.96 1cgp s ALA 84 N -3.52 -0.27 0.10 5.18 0.00 -1.26 -4.91 121.76 117.08 1cgp s ALA 84 Ca 0.02 -0.91 -0.10 0.00 0.00 0.00 0.00 51.96 50.97 1cgp s ALA 84 Cb 0.09 0.97 -0.06 0.00 0.00 0.00 0.00 23.12 24.11 1cgp s ALA 84 CO 0.62 -0.90 0.42 -1.58 0.00 0.00 0.00 175.76 174.33 1cgp s TRP 85 N -3.39 3.57 -0.22 0.00 0.51 0.36 -3.12 118.94 116.63 1cgp s TRP 85 Ca 0.21 0.80 0.01 0.00 -2.12 0.00 0.00 56.10 55.00 1cgp s TRP 85 Cb -0.02 -2.18 0.06 0.00 -0.81 0.00 0.00 33.47 30.52 1cgp s TRP 85 CO 0.12 0.49 -0.06 0.08 -0.51 0.00 0.00 176.95 177.06 1cgp s VAL 86 N -1.45 1.51 -0.04 4.03 1.01 -1.14 -0.53 120.40 123.79 1cgp s VAL 86 Ca 0.35 -1.15 0.04 0.00 0.00 0.00 0.00 61.98 61.22 1cgp s VAL 86 Cb -0.14 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 1cgp s VAL 86 CO 0.19 -0.05 -0.14 0.00 0.00 0.00 0.00 175.10 175.10 1cgp s ARG 87 N 1.41 2.47 -0.23 2.72 1.70 -0.39 -2.49 118.95 124.14 1cgp s ARG 87 Ca -0.05 -0.72 -0.29 0.00 -0.47 0.00 0.00 55.73 54.20 1cgp s ARG 87 Cb -0.18 -2.37 -0.02 0.00 -0.57 0.00 0.00 34.95 31.81 1cgp s ARG 87 CO -0.07 0.62 1.60 0.00 -1.08 0.00 0.00 175.30 176.37 1cgp s ALA 88 N -0.76 3.25 0.01 7.88 0.00 0.30 -1.29 121.76 131.14 1cgp s ALA 88 Ca 0.12 0.43 0.28 0.00 0.00 0.00 0.00 51.96 52.78 1cgp s ALA 88 Cb -0.11 -3.86 0.97 0.00 0.00 0.00 0.00 23.12 20.13 1cgp s ALA 88 CO 0.01 -1.98 1.84 0.87 0.00 0.00 0.00 175.76 176.50 1cgp h LYS 89 N 10.74 0.00 0.00 0.00 1.57 -0.53 0.61 116.57 128.96 1cgp h LYS 89 Ca -0.33 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.35 1cgp h LYS 89 Cb 1.15 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.44 1cgp h LYS 89 CO 1.01 0.10 -0.06 0.25 -0.57 0.00 0.00 179.45 180.19 1cgp n THR 90 N -3.20 0.00 -2.28 -0.16 -2.24 -0.88 -4.68 114.28 100.84 1cgp n THR 90 Ca 0.01 -0.59 -0.43 0.00 -2.27 0.00 0.00 64.05 60.77 1cgp n THR 90 Cb 0.41 0.36 -0.02 0.00 -2.10 0.00 0.00 70.33 68.97 1cgp n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cgp s ALA 91 N -2.00 3.55 -0.09 6.98 0.00 -1.26 -3.63 121.76 125.31 1cgp s ALA 91 Ca 0.10 0.52 0.02 0.00 0.00 0.00 0.00 51.96 52.59 1cgp s ALA 91 Cb -0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 1cgp s ALA 91 CO 0.07 -1.43 -0.13 0.00 0.00 0.00 0.00 175.76 174.26 1cgp s GLU 93 N -0.22 2.97 -0.12 0.00 2.12 -0.38 -0.19 118.70 122.88 1cgp s GLU 93 Ca 0.01 -1.01 0.02 0.00 0.36 0.00 0.00 54.97 54.35 1cgp s GLU 93 Cb -0.13 -3.92 -0.00 0.00 0.26 0.00 0.00 34.13 30.34 1cgp s GLU 93 CO 0.03 -0.72 -0.20 0.08 -0.54 0.00 0.00 175.26 173.91 1cgp s VAL 94 N 1.66 2.35 0.33 3.70 1.01 0.00 -0.17 120.40 129.27 1cgp s VAL 94 Ca 0.04 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 60.92 1cgp s VAL 94 Cb -0.19 -1.94 -0.10 0.00 0.00 0.00 0.00 36.38 34.15 1cgp s VAL 94 CO 0.09 0.54 0.84 0.00 0.00 0.00 0.00 175.10 176.57 1cgp s ALA 95 N 0.53 3.24 -0.07 5.51 0.00 0.39 -0.80 121.76 130.57 1cgp s ALA 95 Ca -0.13 0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.13 1cgp s ALA 95 Cb -0.17 -2.97 0.02 0.00 0.00 0.00 0.00 23.12 20.00 1cgp s ALA 95 CO 0.04 0.24 -0.10 -1.21 0.00 0.00 0.00 175.76 174.74 1cgp s GLU 96 N -2.58 1.46 0.07 0.00 2.02 -0.38 -1.01 118.70 118.28 1cgp s GLU 96 Ca 0.53 -0.31 0.07 0.00 0.02 0.00 0.00 54.97 55.27 1cgp s GLU 96 Cb -0.13 -1.30 -0.03 0.00 0.10 0.00 0.00 34.13 32.77 1cgp s GLU 96 CO 0.19 -0.04 -0.20 0.42 0.02 0.00 0.00 175.26 175.65 1cgp s ILE 97 N 0.88 1.58 0.30 -1.63 1.09 -0.80 -1.34 121.20 121.28 1cgp s ILE 97 Ca -0.11 -1.31 -0.29 0.00 -1.10 0.00 0.00 60.65 57.84 1cgp s ILE 97 Cb -0.15 -1.41 -0.10 0.00 -1.06 0.00 0.00 42.46 39.74 1cgp s ILE 97 CO 0.01 0.05 1.23 -0.44 -0.10 0.00 0.00 174.94 175.69 1cgp s SER 98 N -1.49 6.97 0.14 3.58 0.01 -1.26 -1.61 113.70 120.04 1cgp s SER 98 Ca 0.06 2.50 -0.21 0.00 1.31 0.00 0.00 55.95 59.61 1cgp s SER 98 Cb -0.09 -2.64 -0.00 0.00 0.21 0.00 0.00 66.02 63.50 1cgp s SER 98 CO 0.03 -0.39 1.67 1.88 0.41 0.00 0.00 173.24 176.83 1cgp h TYR 99 N 3.77 -0.37 -0.68 2.43 0.05 -1.45 -0.05 116.97 120.66 1cgp h TYR 99 Ca -0.48 0.02 0.20 0.00 0.05 0.00 0.00 58.73 58.53 1cgp h TYR 99 Cb 1.22 0.19 -0.03 0.00 1.01 0.00 0.00 36.73 39.12 1cgp h TYR 99 CO 0.58 -0.22 0.50 0.87 -1.05 0.00 0.00 178.16 178.84 1cgp h LYS 100 N -0.16 0.00 0.17 4.88 6.56 -1.92 0.25 116.57 126.34 1cgp h LYS 100 Ca 0.11 0.00 -0.36 0.00 -1.06 0.00 0.00 60.65 59.34 1cgp h LYS 100 Cb 0.32 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.98 1cgp h LYS 100 CO -0.27 0.00 -1.82 -0.22 -2.06 0.00 0.00 179.45 175.08 1cgp h LYS 101 N 0.00 0.35 -0.86 3.15 3.11 -1.64 -3.22 116.57 117.46 1cgp h LYS 101 Ca 0.32 -0.60 0.04 0.00 -2.81 0.00 0.00 60.65 57.60 1cgp h LYS 101 Cb 1.32 0.22 -0.05 0.00 -1.00 0.00 0.00 32.23 32.73 1cgp h LYS 101 CO -0.00 1.28 0.56 0.35 -2.81 0.00 0.00 179.45 178.83 1cgp h PHE 102 N 0.10 1.02 -0.77 1.91 3.57 0.12 0.17 116.94 123.06 1cgp h PHE 102 Ca -0.37 0.03 0.18 0.00 3.53 0.00 0.00 57.97 61.34 1cgp h PHE 102 Cb 2.08 -0.34 -0.12 0.00 2.79 0.00 0.00 35.95 40.36 1cgp h PHE 102 CO 0.09 0.59 0.14 0.00 -2.23 0.00 0.00 178.31 176.90 1cgp h ARG 103 N 1.05 0.20 -0.31 1.11 -0.00 -1.07 0.53 114.38 115.90 1cgp h ARG 103 Ca 0.35 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.98 59.80 1cgp h ARG 103 Cb 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 29.97 29.97 1cgp h ARG 103 CO -0.11 0.13 0.12 1.96 0.00 0.00 0.00 179.97 182.08 1cgp h GLN 104 N 0.21 0.47 -0.20 0.04 4.20 -0.71 -2.34 115.11 116.78 1cgp h GLN 104 Ca 0.44 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 59.07 1cgp h GLN 104 Cb 0.80 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 1cgp h GLN 104 CO -0.58 0.48 0.12 -0.07 -0.67 0.00 0.00 178.83 178.10 1cgp h LEU 105 N 0.35 0.23 -0.16 1.46 4.07 -0.20 -2.16 115.31 118.91 1cgp h LEU 105 Ca 0.10 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1cgp h LEU 105 Cb 0.19 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 1cgp h LEU 105 CO -0.01 0.18 0.10 0.40 -1.08 0.00 0.00 178.44 178.04 1cgp h ILE 106 N 0.27 1.06 -0.84 1.22 2.04 -0.72 0.21 117.51 120.75 1cgp h ILE 106 Ca 0.07 -0.14 0.06 0.00 1.00 0.00 0.00 64.86 65.85 1cgp h ILE 106 Cb -0.00 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 1cgp h ILE 106 CO -0.01 0.06 0.55 1.56 0.00 0.00 0.00 178.15 180.30 1cgp h GLN 107 N 0.20 0.93 -0.08 2.37 1.08 -1.36 -1.71 115.11 116.54 1cgp h GLN 107 Ca 0.06 -0.06 -0.20 0.00 -1.45 0.00 0.00 58.65 57.01 1cgp h GLN 107 Cb 0.00 -0.21 -0.00 0.00 -0.05 0.00 0.00 27.48 27.22 1cgp h GLN 107 CO -0.01 0.62 -0.76 0.28 -0.95 0.00 0.00 178.83 178.00 1cgp h VAL 108 N 0.96 1.36 -1.11 -0.54 2.07 -0.81 -3.44 116.25 114.75 1cgp h VAL 108 Ca 0.36 -2.15 0.05 0.00 0.82 0.00 0.00 66.70 65.77 1cgp h VAL 108 Cb 0.17 2.13 -0.22 0.00 -1.52 0.00 0.00 31.29 31.85 1cgp h VAL 108 CO -0.12 0.65 -0.31 0.21 0.02 0.00 0.00 177.57 178.02 1cgp s ASN 109 N -7.01 -1.22 0.62 0.57 3.04 0.69 -5.05 114.94 106.58 1cgp s ASN 109 Ca -0.06 0.69 0.28 0.00 0.04 0.00 0.00 52.86 53.81 1cgp s ASN 109 Cb 0.10 2.02 1.48 0.00 -1.54 0.00 0.00 41.25 43.31 1cgp s ASN 109 CO 0.85 -0.27 1.87 -0.65 -3.04 0.00 0.00 177.10 175.86 1cgp h PRO 110 N 8.02 0.00 0.00 0.43 0.11 -1.62 -3.15 132.00 135.79 1cgp h PRO 110 Ca -0.19 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 1cgp h PRO 110 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1cgp h PRO 110 CO 0.25 0.00 -0.06 0.22 -0.21 0.00 0.00 178.00 178.19 1cgp h ASP 111 N 0.00 0.00 -0.13 -2.05 3.58 -1.95 -0.08 116.42 115.79 1cgp h ASP 111 Ca 0.13 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.47 1cgp h ASP 111 Cb 1.03 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.08 1cgp h ASP 111 CO -0.00 0.06 -0.35 0.16 -2.88 0.00 0.00 179.24 176.23 1cgp h ILE 112 N 0.00 1.37 0.00 2.25 -0.00 -1.93 -0.05 117.51 119.16 1cgp h ILE 112 Ca -0.00 -1.64 -0.00 0.00 -0.00 0.00 0.00 64.86 63.21 1cgp h ILE 112 Cb 0.13 2.08 -0.00 0.00 -0.00 0.00 0.00 36.82 39.04 1cgp h ILE 112 CO 0.01 0.49 -0.00 0.25 -0.00 0.00 0.00 178.15 178.90 1cgp h LEU 113 N 0.06 0.00 0.56 0.16 5.85 -1.30 -0.46 115.31 120.18 1cgp h LEU 113 Ca -0.01 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1cgp h LEU 113 Cb 0.96 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.00 1cgp h LEU 113 CO 0.08 0.00 -0.27 0.24 -0.34 0.00 0.00 178.44 178.15 1cgp h MET 114 N 0.00 -0.72 -0.99 1.25 2.86 -0.88 -1.65 114.93 114.80 1cgp h MET 114 Ca -0.00 0.05 0.23 0.00 -2.06 0.00 0.00 59.70 57.92 1cgp h MET 114 Cb 0.00 0.16 -0.09 0.00 0.06 0.00 0.00 31.60 31.73 1cgp h MET 114 CO 0.00 -0.42 0.63 0.00 1.06 0.00 0.00 176.91 178.18 1cgp h ARG 115 N -1.09 0.49 0.39 1.72 3.08 0.54 -0.51 114.38 119.00 1cgp h ARG 115 Ca -0.08 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 1cgp h ARG 115 Cb 0.63 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1cgp h ARG 115 CO 0.13 0.33 -0.19 1.25 -1.07 0.00 0.00 179.97 180.41 1cgp h LEU 116 N 0.51 -0.44 -1.70 3.04 6.46 -1.27 -2.78 115.31 119.14 1cgp h LEU 116 Ca 0.56 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 58.18 1cgp h LEU 116 Cb 1.24 0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 41.27 1cgp h LEU 116 CO -0.29 -0.06 0.08 0.28 -0.62 0.00 0.00 178.44 177.83 1cgp h SER 117 N -0.89 0.24 -0.22 1.25 0.02 -0.61 0.13 113.55 113.48 1cgp h SER 117 Ca -0.05 -0.02 0.04 0.00 -0.84 0.00 0.00 61.79 60.92 1cgp h SER 117 Cb 0.55 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1cgp h SER 117 CO 0.09 0.23 0.00 0.00 -1.14 0.00 0.00 176.83 176.01 1cgp h ALA 118 N 1.81 0.20 -0.20 3.77 0.00 -1.10 -0.30 119.26 123.44 1cgp h ALA 118 Ca 0.07 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1cgp h ALA 118 Cb 0.06 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1cgp h ALA 118 CO -0.01 -0.43 0.08 1.96 0.00 0.00 0.00 179.25 180.85 1cgp h GLN 119 N 0.07 0.17 -0.45 0.00 4.20 -0.74 0.08 115.11 118.45 1cgp h GLN 119 Ca 0.11 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.82 1cgp h GLN 119 Cb 0.13 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1cgp h GLN 119 CO -0.18 0.11 0.30 0.52 -0.67 0.00 0.00 178.83 178.91 1cgp h MET 120 N 0.18 0.55 -0.17 1.46 2.86 -0.88 -1.27 114.93 117.67 1cgp h MET 120 Ca 0.09 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.67 1cgp h MET 120 Cb 0.05 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1cgp h MET 120 CO -0.08 0.36 0.02 0.00 1.06 0.00 0.00 176.91 178.27 1cgp h ALA 121 N 1.73 0.22 -0.29 6.32 0.00 0.78 0.16 119.26 128.18 1cgp h ALA 121 Ca 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1cgp h ALA 121 Cb -0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1cgp h ALA 121 CO -0.04 -0.10 0.05 0.00 0.00 0.00 0.00 179.25 179.16 1cgp h ARG 122 N 0.05 0.41 -0.48 0.00 2.47 -0.87 -0.68 114.38 115.28 1cgp h ARG 122 Ca 0.05 -0.06 -0.07 0.00 -1.26 0.00 0.00 59.98 58.63 1cgp h ARG 122 Cb 0.34 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.57 1cgp h ARG 122 CO 0.01 0.41 0.01 0.00 0.56 0.00 0.00 179.97 180.96 1cgp h ARG 123 N 0.41 0.83 -0.96 0.04 3.08 -0.67 0.07 114.38 117.18 1cgp h ARG 123 Ca 0.10 -0.26 0.03 0.00 0.07 0.00 0.00 59.98 59.92 1cgp h ARG 123 Cb 0.20 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.12 1cgp h ARG 123 CO -0.00 0.87 0.63 -0.07 -1.07 0.00 0.00 179.97 180.34 1cgp h LEU 124 N 0.69 1.07 0.11 3.04 3.38 0.50 0.10 115.31 124.20 1cgp h LEU 124 Ca 0.14 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1cgp h LEU 124 Cb 0.49 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1cgp h LEU 124 CO 0.02 0.75 -0.05 -0.61 0.09 0.00 0.00 178.44 178.63 1cgp h GLN 125 N 1.25 -0.15 -0.08 1.13 -0.00 -0.57 -1.85 115.11 114.84 1cgp h GLN 125 Ca 0.37 0.01 -0.15 0.00 -0.00 0.00 0.00 58.65 58.88 1cgp h GLN 125 Cb -0.05 0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.46 1cgp h GLN 125 CO -0.10 -0.04 -0.62 -0.39 0.00 0.00 0.00 178.83 177.68 1cgp h VAL 126 N -0.21 1.38 0.00 2.39 -1.51 -0.51 -2.98 116.25 114.81 1cgp h VAL 126 Ca -0.02 -1.99 -0.11 0.00 -1.23 0.00 0.00 66.70 63.35 1cgp h VAL 126 Cb 0.17 2.00 -0.02 0.00 -2.13 0.00 0.00 31.29 31.31 1cgp h VAL 126 CO 0.03 0.59 -0.52 0.74 -1.23 0.00 0.00 177.57 177.18 1cgp h THR 127 N 0.20 1.27 -0.73 7.19 2.02 -0.79 -1.62 112.91 120.46 1cgp h THR 127 Ca -0.01 -1.85 -0.07 0.00 0.77 0.00 0.00 66.41 65.25 1cgp h THR 127 Cb 1.13 2.03 -0.03 0.00 -1.74 0.00 0.00 68.15 69.54 1cgp h THR 127 CO 0.10 0.51 0.19 0.28 0.37 0.00 0.00 175.52 176.97 1cgp h SER 128 N 0.00 1.08 -0.33 4.18 0.02 -1.32 -1.66 113.55 115.52 1cgp h SER 128 Ca -0.01 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.72 1cgp h SER 128 Cb 0.99 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 1cgp h SER 128 CO 0.07 1.02 0.18 -0.08 -1.14 0.00 0.00 176.83 176.88 1cgp h GLU 129 N 1.09 0.46 -0.96 3.45 4.81 -1.24 -0.83 114.58 121.36 1cgp h GLU 129 Ca 0.23 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.44 1cgp h GLU 129 Cb 0.35 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 1cgp h GLU 129 CO -0.00 0.39 0.63 -0.22 -0.73 0.00 0.00 179.01 179.08 1cgp h LYS 130 N 0.41 1.18 -0.25 1.92 3.64 -1.10 -0.01 116.57 122.36 1cgp h LYS 130 Ca 0.11 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 1cgp h LYS 130 Cb 0.07 -0.27 -0.03 0.00 -0.41 0.00 0.00 32.23 31.59 1cgp h LYS 130 CO -0.02 0.78 0.04 0.28 -2.27 0.00 0.00 179.45 178.26 1cgp h VAL 131 N 1.22 0.86 -0.39 2.00 2.07 -0.85 -2.47 116.25 118.69 1cgp h VAL 131 Ca 0.38 -0.04 0.08 0.00 0.82 0.00 0.00 66.70 67.93 1cgp h VAL 131 Cb -0.01 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 30.42 1cgp h VAL 131 CO -0.11 0.02 -0.06 1.23 0.02 0.00 0.00 177.57 178.67 1cgp h GLY 132 N 0.13 0.32 0.97 2.17 0.00 0.40 -1.84 103.07 105.21 1cgp h GLY 132 Ca 0.12 0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.55 1cgp h GLY 132 CO -0.17 -0.13 0.14 3.43 0.00 0.00 0.00 176.54 179.81 1cgp h ASN 133 N 0.04 0.23 -0.47 0.19 2.35 -1.05 0.11 115.58 116.98 1cgp h ASN 133 Ca 0.19 -0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.99 1cgp h ASN 133 Cb 0.29 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.56 1cgp h ASN 133 CO -0.38 0.17 0.19 -0.07 -1.65 0.00 0.00 177.43 175.69 1cgp h LEU 134 N 0.29 0.22 -0.35 1.61 3.38 -1.11 0.14 115.31 119.49 1cgp h LEU 134 Ca 0.09 0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.94 1cgp h LEU 134 Cb -0.02 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1cgp h LEU 134 CO -0.03 0.16 -0.41 0.00 0.09 0.00 0.00 178.44 178.25 1cgp h ALA 135 N 1.29 0.52 0.00 1.53 0.00 -1.13 -3.39 119.26 118.08 1cgp h ALA 135 Ca 0.22 -0.46 -0.37 0.00 0.00 0.00 0.00 54.91 54.29 1cgp h ALA 135 Cb 0.19 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1cgp h ALA 135 CO -0.20 0.64 -2.39 1.19 0.00 0.00 0.00 179.25 178.50 1cgp n PHE 136 N -4.08 0.04 -4.38 0.00 3.72 0.35 -5.00 117.46 108.11 1cgp n PHE 136 Ca -0.03 0.01 -0.34 0.00 -0.05 0.00 0.00 57.45 57.04 1cgp n PHE 136 Cb 0.56 -1.01 -0.11 0.00 -0.94 0.00 0.00 39.48 37.98 1cgp n PHE 136 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1cgp s LEU 137 N -5.77 3.33 0.77 4.37 1.02 0.46 -5.05 118.68 117.82 1cgp s LEU 137 Ca -0.16 -0.07 -0.11 0.00 0.02 0.00 0.00 54.13 53.81 1cgp s LEU 137 Cb 0.07 -1.80 0.05 0.00 0.02 0.00 0.00 46.19 44.53 1cgp s LEU 137 CO 0.77 0.21 1.08 1.51 0.02 0.00 0.00 176.35 179.95 1cgp s ASP 138 N 0.12 4.68 0.29 2.29 -4.77 -1.26 -4.54 116.67 113.48 1cgp s ASP 138 Ca -0.00 1.53 0.01 0.00 -3.30 0.00 0.00 52.55 50.78 1cgp s ASP 138 Cb -0.13 -2.30 0.69 0.00 -1.09 0.00 0.00 42.92 40.09 1cgp s ASP 138 CO 0.02 -1.88 1.61 0.58 0.70 0.00 0.00 175.17 176.20 1cgp h VAL 139 N -1.02 0.18 -0.61 2.11 2.07 -1.95 0.61 116.25 117.63 1cgp h VAL 139 Ca -0.46 -0.03 0.08 0.00 0.82 0.00 0.00 66.70 67.12 1cgp h VAL 139 Cb 1.24 0.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1cgp h VAL 139 CO 0.56 0.02 0.26 0.74 0.02 0.00 0.00 177.57 179.17 1cgp h THR 140 N 0.09 0.82 -0.33 2.57 2.02 -1.99 0.28 112.91 116.38 1cgp h THR 140 Ca 0.55 -0.16 -0.07 0.00 0.77 0.00 0.00 66.41 67.50 1cgp h THR 140 Cb 1.12 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1cgp h THR 140 CO -0.78 0.09 -0.07 1.23 0.37 0.00 0.00 175.52 176.36 1cgp h GLY 141 N 0.47 0.69 1.00 2.16 0.00 -0.19 0.46 103.07 107.67 1cgp h GLY 141 Ca 0.30 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 1cgp h GLY 141 CO -0.27 0.51 -0.10 3.21 0.00 0.00 0.00 176.54 179.89 1cgp h ARG 142 N 0.42 -0.27 -0.54 4.80 3.08 -0.15 -0.11 114.38 121.62 1cgp h ARG 142 Ca 0.09 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.15 1cgp h ARG 142 Cb 0.56 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 1cgp h ARG 142 CO 0.03 -0.18 0.33 0.82 -1.07 0.00 0.00 179.97 179.90 1cgp h ILE 143 N -0.28 1.15 0.67 2.04 2.04 -0.36 -0.88 117.51 121.89 1cgp h ILE 143 Ca -0.03 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1cgp h ILE 143 Cb 0.21 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1cgp h ILE 143 CO 0.05 0.16 -0.48 0.00 0.00 0.00 0.00 178.15 177.88 1cgp h ALA 144 N 1.62 -1.22 -0.99 1.87 0.00 -0.16 0.12 119.26 120.50 1cgp h ALA 144 Ca 0.19 -0.22 0.15 0.00 0.00 0.00 0.00 54.91 55.03 1cgp h ALA 144 Cb -0.03 0.63 -0.09 0.00 0.00 0.00 0.00 17.79 18.30 1cgp h ALA 144 CO -0.04 -1.20 0.62 1.96 0.00 0.00 0.00 179.25 180.59 1cgp h GLN 145 N -1.09 0.84 0.52 0.00 1.08 -0.66 -1.17 115.11 114.62 1cgp h GLN 145 Ca -0.09 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.04 1cgp h GLN 145 Cb 0.90 -0.19 0.01 0.00 -0.05 0.00 0.00 27.48 28.14 1cgp h GLN 145 CO 0.05 0.55 -0.25 1.15 -0.95 0.00 0.00 178.83 179.38 1cgp h THR 146 N 0.86 0.49 -0.78 -0.54 2.02 -0.73 -0.79 112.91 113.44 1cgp h THR 146 Ca 0.52 -0.01 0.05 0.00 0.77 0.00 0.00 66.41 67.74 1cgp h THR 146 Cb 0.68 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 1cgp h THR 146 CO -0.29 0.00 0.51 -0.07 0.37 0.00 0.00 175.52 176.04 1cgp h LEU 147 N -0.70 0.77 0.54 2.58 3.38 0.37 -0.33 115.31 121.92 1cgp h LEU 147 Ca -0.07 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1cgp h LEU 147 Cb 0.53 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1cgp h LEU 147 CO 0.12 0.51 -0.43 0.25 0.09 0.00 0.00 178.44 178.98 1cgp h LEU 148 N 0.89 -1.14 -0.91 1.67 5.85 -1.22 -1.95 115.31 118.50 1cgp h LEU 148 Ca 0.33 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 59.07 1cgp h LEU 148 Cb 0.16 0.36 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1cgp h LEU 148 CO -0.11 -0.62 0.08 0.78 -0.34 0.00 0.00 178.44 178.23 1cgp h ASN 149 N -0.95 0.83 -0.86 1.25 2.35 0.05 -2.35 115.58 115.90 1cgp h ASN 149 Ca -0.06 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 1cgp h ASN 149 Cb 0.81 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.92 1cgp h ASN 149 CO -0.00 0.85 0.51 -0.07 -1.65 0.00 0.00 177.43 177.07 1cgp h LEU 150 N 0.83 1.04 -0.34 1.61 3.38 -1.03 -1.60 115.31 119.21 1cgp h LEU 150 Ca 0.17 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1cgp h LEU 150 Cb 0.38 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1cgp h LEU 150 CO 0.01 0.81 0.00 0.00 0.09 0.00 0.00 178.44 179.35 1cgp n ALA 151 N -2.37 1.70 0.00 1.53 0.00 -0.74 -0.69 120.51 119.93 1cgp n ALA 151 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1cgp n ALA 151 Cb 0.06 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1cgp n ALA 151 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1cgp n LYS 152 N -0.22 3.31 -2.32 0.00 3.00 -0.64 -4.95 118.16 116.34 1cgp n LYS 152 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.90 1cgp n LYS 152 Cb 0.03 -0.42 -0.03 0.00 0.00 0.00 0.00 35.03 34.60 1cgp n LYS 152 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1cgp s GLN 153 N -0.67 4.47 -0.89 1.64 -1.52 0.13 -4.88 119.66 117.95 1cgp s GLN 153 Ca 0.00 1.94 -0.25 0.00 -1.95 0.00 0.00 55.36 55.09 1cgp s GLN 153 Cb 0.00 -3.22 -0.18 0.00 -0.22 0.00 0.00 33.01 29.40 1cgp s GLN 153 CO 0.00 -0.12 2.28 -0.35 -0.25 0.00 0.00 175.29 176.85 1cgp n PRO 154 N 2.38 0.37 0.00 2.91 -0.04 -1.26 -1.50 135.00 137.86 1cgp n PRO 154 Ca 0.04 -1.11 0.00 0.00 -0.04 0.00 0.00 63.50 62.39 1cgp n PRO 154 Cb 0.44 -3.66 0.00 0.00 -0.04 0.00 0.00 33.50 30.24 1cgp n PRO 154 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1cgp n ASP 155 N 18.57 0.00 -4.67 3.54 5.68 -1.26 -5.10 116.55 133.30 1cgp n ASP 155 Ca 0.45 0.00 -0.44 0.00 -0.50 0.00 0.00 54.79 54.29 1cgp n ASP 155 Cb 0.44 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.38 1cgp n ASP 155 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1cgp n ALA 156 N 0.00 1.45 -2.42 2.12 0.00 -0.56 -4.93 120.51 116.16 1cgp n ALA 156 Ca 0.00 0.26 -0.29 0.00 0.00 0.00 0.00 53.44 53.41 1cgp n ALA 156 Cb 0.00 -2.59 -0.03 0.00 0.00 0.00 0.00 19.45 16.82 1cgp n ALA 156 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1cgp s MET 157 N 3.86 3.69 0.22 0.00 -1.94 0.17 -4.91 119.30 120.39 1cgp s MET 157 Ca 0.89 0.15 -0.08 0.00 -1.71 0.00 0.00 55.69 54.94 1cgp s MET 157 Cb -0.54 -2.58 -0.07 0.00 2.01 0.00 0.00 34.83 33.65 1cgp s MET 157 CO 0.44 0.16 0.51 0.99 -0.01 0.00 0.00 175.02 177.11 1cgp s THR 158 N -2.13 5.00 -0.31 2.05 2.01 -1.26 0.24 115.64 121.23 1cgp s THR 158 Ca 0.46 0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.77 1cgp s THR 158 Cb -0.11 -3.64 0.10 0.00 0.01 0.00 0.00 72.50 68.87 1cgp s THR 158 CO 0.29 -0.08 0.08 -2.28 -0.69 0.00 0.00 174.62 171.94 1cgp s HIS 159 N -1.82 2.07 0.00 4.92 5.04 -0.20 -4.69 115.29 120.61 1cgp s HIS 159 Ca 0.45 -1.94 0.00 0.00 -1.54 0.00 0.00 55.06 52.04 1cgp s HIS 159 Cb -0.11 -1.91 0.00 0.00 0.04 0.00 0.00 32.58 30.60 1cgp s HIS 159 CO 0.23 -0.88 0.00 -0.35 -2.34 0.00 0.00 174.74 171.40 1cgp n PRO 160 N 4.74 0.00 -3.80 2.88 -0.04 -1.26 -3.04 135.00 134.49 1cgp n PRO 160 Ca -0.01 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.08 1cgp n PRO 160 Cb 0.42 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.76 1cgp n PRO 160 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1cgp s ASP 161 N 0.00 5.19 0.00 3.54 1.01 -1.26 -4.93 116.67 120.22 1cgp s ASP 161 Ca 0.00 -1.25 0.00 0.00 0.71 0.00 0.00 52.55 52.01 1cgp s ASP 161 Cb 0.00 -1.82 0.00 0.00 1.01 0.00 0.00 42.92 42.11 1cgp s ASP 161 CO 0.00 -0.33 0.00 0.61 0.21 0.00 0.00 175.17 175.66 1cgp n GLY 162 N 4.74 2.66 3.96 0.21 0.00 -1.17 -4.97 105.19 110.62 1cgp n GLY 162 Ca -0.12 -2.08 -0.22 0.00 0.00 0.00 0.00 46.02 43.60 1cgp n GLY 162 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1cgp s MET 163 N -1.99 3.42 -0.09 1.61 -1.94 -0.19 -1.03 119.30 119.09 1cgp s MET 163 Ca 0.00 -0.73 0.01 0.00 -1.71 0.00 0.00 55.69 53.26 1cgp s MET 163 Cb 0.00 -2.90 0.02 0.00 2.01 0.00 0.00 34.83 33.96 1cgp s MET 163 CO 0.00 0.45 -0.10 -1.14 -0.01 0.00 0.00 175.02 174.22 1cgp s GLN 164 N -3.81 1.58 0.07 2.03 0.74 0.14 -1.27 119.66 119.13 1cgp s GLN 164 Ca 0.34 -0.32 0.05 0.00 0.05 0.00 0.00 55.36 55.49 1cgp s GLN 164 Cb -0.09 -1.48 -0.03 0.00 1.10 0.00 0.00 33.01 32.51 1cgp s GLN 164 CO 0.29 -0.13 -0.15 0.96 -0.55 0.00 0.00 175.29 175.71 1cgp s ILE 165 N 1.22 1.18 -0.21 -2.34 -4.36 0.28 -0.65 121.20 116.31 1cgp s ILE 165 Ca -0.04 -1.29 -0.02 0.00 -0.26 0.00 0.00 60.65 59.03 1cgp s ILE 165 Cb -0.14 -1.11 0.00 0.00 1.25 0.00 0.00 42.46 42.46 1cgp s ILE 165 CO -0.03 -0.18 -0.09 -0.75 0.24 0.00 0.00 174.94 174.13 1cgp s LYS 166 N -1.68 3.26 -0.29 0.37 2.20 -1.26 -0.03 119.74 122.30 1cgp s LYS 166 Ca -0.01 -0.69 -0.14 0.00 -0.36 0.00 0.00 55.97 54.77 1cgp s LYS 166 Cb -0.10 -2.88 0.12 0.00 -1.51 0.00 0.00 37.83 33.47 1cgp s LYS 166 CO 0.02 -0.20 0.79 -1.50 -0.36 0.00 0.00 175.35 174.09 1cgp s ILE 167 N 1.42 -0.39 0.72 5.43 2.07 -1.26 -4.98 121.20 124.22 1cgp s ILE 167 Ca 0.05 0.00 -0.14 0.00 -1.41 0.00 0.00 60.65 59.16 1cgp s ILE 167 Cb -0.14 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.49 1cgp s ILE 167 CO -0.06 0.00 1.13 0.42 -1.91 0.00 0.00 174.94 174.52 1cgp s THR 168 N 2.11 2.91 0.30 4.00 -4.23 -1.26 -4.76 115.64 114.70 1cgp s THR 168 Ca -0.07 0.39 0.03 0.00 -1.18 0.00 0.00 61.69 60.85 1cgp s THR 168 Cb -0.07 -2.86 0.29 0.00 1.34 0.00 0.00 72.50 71.20 1cgp s THR 168 CO -0.18 -0.29 1.87 0.03 -0.54 0.00 0.00 174.62 175.50 1cgp h ARG 169 N -0.46 0.92 -0.42 3.99 -0.00 -1.93 -2.22 114.38 114.26 1cgp h ARG 169 Ca -0.46 -0.06 0.04 0.00 -0.50 0.00 0.00 59.98 59.00 1cgp h ARG 169 Cb 1.26 -0.21 -0.05 0.00 0.00 0.00 0.00 29.97 30.97 1cgp h ARG 169 CO 0.51 0.61 -0.27 1.96 0.00 0.00 0.00 179.97 182.78 1cgp h GLN 170 N 0.95 -0.03 -0.30 0.04 1.08 -1.91 -0.86 115.11 114.08 1cgp h GLN 170 Ca 0.45 0.00 0.07 0.00 -1.45 0.00 0.00 58.65 57.72 1cgp h GLN 170 Cb 0.43 0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.79 1cgp h GLN 170 CO -0.21 -0.02 -0.29 0.93 -0.95 0.00 0.00 178.83 178.29 1cgp h GLU 171 N -0.03 -0.26 -0.64 1.46 4.39 -1.77 -0.16 114.58 117.56 1cgp h GLU 171 Ca 0.07 0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.84 1cgp h GLU 171 Cb 0.20 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.86 1cgp h GLU 171 CO -0.41 -0.18 0.36 0.82 -1.16 0.00 0.00 179.01 178.44 1cgp h ILE 172 N -0.27 0.97 -0.64 3.13 2.04 -1.39 0.93 117.51 122.28 1cgp h ILE 172 Ca 0.15 -0.23 0.12 0.00 1.00 0.00 0.00 64.86 65.91 1cgp h ILE 172 Cb 0.51 0.25 -0.12 0.00 -0.74 0.00 0.00 36.82 36.72 1cgp h ILE 172 CO -0.45 0.12 -0.22 1.23 0.00 0.00 0.00 178.15 178.83 1cgp h GLY 173 N 0.66 0.31 2.00 5.37 0.00 0.40 0.24 103.07 112.05 1cgp h GLY 173 Ca 0.28 0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.89 1cgp h GLY 173 CO -0.17 -0.24 -0.01 1.46 0.00 0.00 0.00 176.54 177.58 1cgp h GLN 174 N -0.05 0.00 0.09 4.80 4.20 0.56 0.79 115.11 125.50 1cgp h GLN 174 Ca 0.29 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.74 1cgp h GLN 174 Cb 0.51 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1cgp h GLN 174 CO -0.68 0.01 -1.39 0.82 -0.67 0.00 0.00 178.83 176.92 1cgp h ILE 175 N 0.00 1.00 0.17 2.54 2.04 0.11 -1.42 117.51 121.96 1cgp h ILE 175 Ca -0.00 -2.36 -0.34 0.00 1.00 0.00 0.00 64.86 63.16 1cgp h ILE 175 Cb 0.32 2.65 0.01 0.00 -0.74 0.00 0.00 36.82 39.06 1cgp h ILE 175 CO 0.00 0.66 -1.67 0.58 0.00 0.00 0.00 178.15 177.73 1cgp h VAL 176 N -0.40 1.03 -0.42 1.67 2.07 -0.73 -3.46 116.25 116.01 1cgp h VAL 176 Ca -0.31 -2.62 0.00 0.00 0.82 0.00 0.00 66.70 64.59 1cgp h VAL 176 Cb 1.69 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 34.24 1cgp h VAL 176 CO 0.02 0.84 0.00 0.61 0.02 0.00 0.00 177.57 179.06 1cgp n GLY 177 N 1.79 0.77 3.73 2.17 0.00 0.26 -4.98 105.19 108.93 1cgp n GLY 177 Ca -0.21 -0.70 -0.03 0.00 0.00 0.00 0.00 46.02 45.08 1cgp n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cgp s SER 179 N -2.95 6.36 0.55 0.00 1.04 -1.26 -4.58 113.70 112.86 1cgp s SER 179 Ca 0.13 1.57 0.24 0.00 0.48 0.00 0.00 55.95 58.36 1cgp s SER 179 Cb -0.00 -2.50 1.53 0.00 0.10 0.00 0.00 66.02 65.14 1cgp s SER 179 CO 0.01 -0.77 2.18 0.08 0.98 0.00 0.00 173.24 175.72 1cgp h ARG 180 N 0.49 0.00 0.60 4.02 0.11 -1.90 0.28 114.38 117.98 1cgp h ARG 180 Ca -0.46 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.59 1cgp h ARG 180 Cb 1.19 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.28 1cgp h ARG 180 CO 0.61 0.03 -0.29 0.93 0.10 0.00 0.00 179.97 181.35 1cgp h GLU 181 N 0.00 -0.78 -0.30 0.08 3.07 -1.94 0.85 114.58 115.56 1cgp h GLU 181 Ca -0.00 0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.88 1cgp h GLU 181 Cb 0.07 0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 1cgp h GLU 181 CO 0.00 -0.48 0.07 1.15 -1.40 0.00 0.00 179.01 178.35 1cgp h THR 182 N -0.91 1.15 -0.30 1.13 2.02 -0.88 0.47 112.91 115.58 1cgp h THR 182 Ca -0.08 -0.53 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 1cgp h THR 182 Cb 0.65 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 1cgp h THR 182 CO 0.14 0.19 0.18 0.58 0.37 0.00 0.00 175.52 176.98 1cgp h VAL 183 N 0.43 1.10 0.44 3.16 2.07 -0.76 -0.61 116.25 122.08 1cgp h VAL 183 Ca 0.10 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1cgp h VAL 183 Cb 0.18 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1cgp h VAL 183 CO -0.00 0.10 -0.33 1.23 0.02 0.00 0.00 177.57 178.59 1cgp h GLY 184 N 0.39 -0.83 -0.72 2.17 0.00 0.12 -0.77 103.07 103.43 1cgp h GLY 184 Ca 0.11 0.37 0.24 0.00 0.00 0.00 0.00 47.33 48.05 1cgp h GLY 184 CO -0.02 -0.30 0.05 -0.09 0.00 0.00 0.00 176.54 176.18 1cgp h ARG 185 N -0.76 0.06 0.02 4.80 9.65 -0.67 0.18 114.38 127.67 1cgp h ARG 185 Ca -0.04 -0.00 -0.24 0.00 -1.10 0.00 0.00 59.98 58.59 1cgp h ARG 185 Cb 0.65 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.19 1cgp h ARG 185 CO 0.01 0.04 -1.23 0.82 2.80 0.00 0.00 179.97 182.41 1cgp h ILE 186 N 0.07 1.45 -0.62 1.20 2.04 -0.91 -3.15 117.51 117.60 1cgp h ILE 186 Ca 0.54 -3.17 0.01 0.00 1.00 0.00 0.00 64.86 63.23 1cgp h ILE 186 Cb 1.07 2.76 -0.03 0.00 -0.74 0.00 0.00 36.82 39.88 1cgp h ILE 186 CO -0.81 0.85 0.41 0.25 0.00 0.00 0.00 178.15 178.85 1cgp h LEU 187 N 0.01 0.70 -0.68 1.44 5.85 0.55 0.32 115.31 123.50 1cgp h LEU 187 Ca -0.10 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1cgp h LEU 187 Cb 1.87 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.69 1cgp h LEU 187 CO 0.13 0.51 0.41 0.11 -0.34 0.00 0.00 178.44 179.25 1cgp h LYS 188 N 0.83 0.93 -0.70 1.25 1.57 -1.50 0.14 116.57 119.09 1cgp h LYS 188 Ca 0.23 -0.09 0.08 0.00 -1.87 0.00 0.00 60.65 59.00 1cgp h LYS 188 Cb -0.08 -0.19 -0.06 0.00 0.08 0.00 0.00 32.23 31.97 1cgp h LYS 188 CO -0.05 0.66 0.37 1.98 -0.57 0.00 0.00 179.45 181.84 1cgp h MET 189 N 0.93 0.63 0.00 3.15 4.05 -1.21 0.97 114.93 123.45 1cgp h MET 189 Ca 0.24 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.62 1cgp h MET 189 Cb -0.02 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 30.63 1cgp h MET 189 CO -0.05 0.42 -0.05 -0.07 0.23 0.00 0.00 176.91 177.39 1cgp h LEU 190 N 0.65 0.00 -0.00 3.39 3.38 0.10 -1.12 115.31 121.71 1cgp h LEU 190 Ca 0.33 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.28 1cgp h LEU 190 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1cgp h LEU 190 CO -0.23 0.05 -0.09 -0.33 0.09 0.00 0.00 178.44 177.93 1cgp h GLU 191 N 0.00 0.07 -0.17 1.13 5.08 0.15 -0.24 114.58 120.59 1cgp h GLU 191 Ca -0.00 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1cgp h GLU 191 Cb 0.52 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.73 1cgp h GLU 191 CO 0.01 0.81 -0.18 -0.44 -1.00 0.00 0.00 179.01 178.21 1cgp h ASP 192 N -0.66 -0.58 0.00 1.42 3.32 -0.84 0.27 116.42 119.36 1cgp h ASP 192 Ca -0.01 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1cgp h ASP 192 Cb 0.84 0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1cgp h ASP 192 CO 0.02 -0.23 0.00 0.00 -1.72 0.00 0.00 179.24 177.31 1cgp n GLN 193 N -5.33 0.09 -1.34 3.56 6.02 -0.44 -4.84 117.38 115.10 1cgp n GLN 193 Ca -0.02 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.85 1cgp n GLN 193 Cb 0.24 -1.14 -0.05 0.00 1.02 0.00 0.00 30.24 30.31 1cgp n GLN 193 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1cgp n ASN 194 N -0.64 -5.39 -0.10 1.08 5.03 0.96 -4.85 115.26 111.35 1cgp n ASN 194 Ca 0.01 0.29 -0.12 0.00 0.87 0.00 0.00 54.58 55.63 1cgp n ASN 194 Cb 0.00 -3.93 -0.15 0.00 -1.02 0.00 0.00 39.78 34.68 1cgp n ASN 194 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1cgp n LEU 195 N -1.35 0.82 -4.30 3.41 4.77 -0.21 -4.91 117.00 115.24 1cgp n LEU 195 Ca -0.12 -0.02 -0.31 0.00 -0.03 0.00 0.00 56.01 55.53 1cgp n LEU 195 Cb 0.55 0.11 -0.16 0.00 -2.33 0.00 0.00 43.42 41.59 1cgp n LEU 195 CO 0.18 0.61 -0.57 -0.51 -1.33 0.00 0.00 177.39 175.77 1cgp s ILE 196 N -2.50 2.05 -0.17 -0.08 1.10 -0.58 -2.81 121.20 118.21 1cgp s ILE 196 Ca -0.16 -1.10 -0.03 0.00 -0.51 0.00 0.00 60.65 58.86 1cgp s ILE 196 Cb 0.07 -1.71 -0.02 0.00 0.15 0.00 0.00 42.46 40.95 1cgp s ILE 196 CO 0.77 0.58 -0.07 -0.44 -2.11 0.00 0.00 174.94 173.67 1cgp s SER 197 N -0.46 4.41 0.03 4.50 0.01 -0.86 -3.85 113.70 117.49 1cgp s SER 197 Ca 0.05 -0.26 0.01 0.00 1.31 0.00 0.00 55.95 57.06 1cgp s SER 197 Cb -0.11 -1.72 -0.02 0.00 0.21 0.00 0.00 66.02 64.38 1cgp s SER 197 CO 0.01 0.12 -0.05 0.00 0.41 0.00 0.00 173.24 173.72 1cgp s ALA 198 N 0.67 0.35 -0.35 1.44 0.00 -1.26 -1.54 121.76 121.08 1cgp s ALA 198 Ca -0.04 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.22 1cgp s ALA 198 Cb -0.15 0.13 0.31 0.00 0.00 0.00 0.00 23.12 23.41 1cgp s ALA 198 CO 0.02 -0.14 1.34 1.58 0.00 0.00 0.00 175.76 178.57 1cgp n HIS 199 N 1.33 -0.87 0.00 0.00 -0.00 -1.26 -4.99 115.22 109.43 1cgp n HIS 199 Ca -0.22 -0.99 0.00 0.00 0.46 0.00 0.00 57.72 56.97 1cgp n HIS 199 Cb 0.56 1.26 0.00 0.00 -0.12 0.00 0.00 29.99 31.69 1cgp n HIS 199 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1cgp n GLY 200 N 0.39 2.55 3.49 1.57 0.00 -1.26 -4.94 105.19 106.99 1cgp n GLY 200 Ca -0.05 -0.59 -0.28 0.00 0.00 0.00 0.00 46.02 45.11 1cgp n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cgp s LYS 201 N 0.00 1.78 0.05 1.61 -2.85 -1.26 -4.01 119.74 115.06 1cgp s LYS 201 Ca 0.00 -1.34 0.09 0.00 -1.00 0.00 0.00 55.97 53.72 1cgp s LYS 201 Cb 0.00 -2.03 -0.03 0.00 -2.06 0.00 0.00 37.83 33.71 1cgp s LYS 201 CO 0.00 0.43 -0.26 0.95 0.10 0.00 0.00 175.35 176.57 1cgp s THR 202 N -1.53 2.13 -0.28 3.79 -4.23 0.96 -4.56 115.64 111.91 1cgp s THR 202 Ca 0.21 -1.41 -0.03 0.00 -1.18 0.00 0.00 61.69 59.28 1cgp s THR 202 Cb -0.09 -1.83 0.03 0.00 1.34 0.00 0.00 72.50 71.96 1cgp s THR 202 CO 0.12 0.34 -0.00 -0.63 -0.54 0.00 0.00 174.62 173.90 1cgp s ILE 203 N -0.82 3.17 -0.23 2.99 1.09 -0.59 -0.56 121.20 126.25 1cgp s ILE 203 Ca 0.12 -1.13 -0.19 0.00 -1.10 0.00 0.00 60.65 58.35 1cgp s ILE 203 Cb -0.10 -2.71 -0.03 0.00 -1.06 0.00 0.00 42.46 38.56 1cgp s ILE 203 CO 0.02 0.02 0.57 -0.69 -0.10 0.00 0.00 174.94 174.77 1cgp s VAL 204 N 1.33 5.05 -2.00 2.92 1.01 -0.40 -2.03 120.40 126.28 1cgp s VAL 204 Ca -0.02 1.02 0.19 0.00 0.00 0.00 0.00 61.98 63.17 1cgp s VAL 204 Cb -0.18 -3.88 0.53 0.00 0.00 0.00 0.00 36.38 32.84 1cgp s VAL 204 CO -0.01 0.10 1.50 1.33 0.00 0.00 0.00 175.10 178.02