#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7c n SER 2 N 0.00 -0.88 -3.70 1.61 3.41 -1.26 -4.86 113.62 107.94 2e7c n SER 2 Ca 0.00 -0.98 -0.29 0.00 -0.26 0.00 0.00 58.87 57.34 2e7c n SER 2 Cb 0.00 -1.24 -0.15 0.00 -0.26 0.00 0.00 64.21 62.55 2e7c n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2e7c s SER 3 N -3.08 3.60 -0.06 4.04 0.15 -1.26 -5.11 113.70 111.98 2e7c s SER 3 Ca 0.49 -1.33 -0.30 0.00 0.70 0.00 0.00 55.95 55.52 2e7c s SER 3 Cb -0.29 -0.68 -0.03 0.00 -1.71 0.00 0.00 66.02 63.31 2e7c s SER 3 CO 0.80 -0.39 1.23 -0.83 1.20 0.00 0.00 173.24 175.25 2e7c s GLY 4 N 1.79 2.03 -0.14 9.45 0.00 -1.26 -5.02 107.32 114.16 2e7c s GLY 4 Ca 0.06 0.64 -0.09 0.00 0.00 0.00 0.00 44.72 45.33 2e7c s GLY 4 CO -0.22 2.28 0.16 -1.35 0.00 0.00 0.00 173.10 173.97 2e7c s SER 5 N 1.58 6.37 -0.16 1.64 1.04 -1.26 -5.01 113.70 117.89 2e7c s SER 5 Ca 0.57 0.43 -0.23 0.00 0.48 0.00 0.00 55.95 57.20 2e7c s SER 5 Cb -0.25 -2.10 -0.21 0.00 0.10 0.00 0.00 66.02 63.57 2e7c s SER 5 CO 0.22 0.32 0.50 -1.28 0.98 0.00 0.00 173.24 173.97 2e7c h SER 6 N 5.58 0.00 -5.04 7.02 0.87 -1.97 -3.50 113.55 116.51 2e7c h SER 6 Ca -0.50 -0.72 0.04 0.00 -1.23 0.00 0.00 61.79 59.38 2e7c h SER 6 Cb 1.20 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.11 2e7c h SER 6 CO 0.65 1.08 0.19 -0.83 -0.53 0.00 0.00 176.83 177.39 2e7c s GLY 7 N -4.34 0.05 -0.10 5.77 0.00 -1.26 -4.56 107.32 102.88 2e7c s GLY 7 Ca -0.20 -0.44 -0.04 0.00 0.00 0.00 0.00 44.72 44.05 2e7c s GLY 7 CO 0.58 -0.19 0.05 -1.59 0.00 0.00 0.00 173.10 171.95 2e7c s THR 8 N -3.76 4.73 -0.97 0.90 2.01 -0.82 -4.45 115.64 113.28 2e7c s THR 8 Ca 0.13 -0.09 -0.04 0.00 0.31 0.00 0.00 61.69 62.00 2e7c s THR 8 Cb -0.05 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.44 2e7c s THR 8 CO 0.08 0.60 0.58 -0.11 -0.69 0.00 0.00 174.62 175.08 2e7c n LEU 9 N 2.16 -2.58 -3.54 4.42 0.00 -1.26 -2.69 117.00 113.50 2e7c n LEU 9 Ca -0.19 -0.26 -0.26 0.00 0.00 0.00 0.00 56.01 55.30 2e7c n LEU 9 Cb 0.54 -2.15 0.03 0.00 0.00 0.00 0.00 43.42 41.84 2e7c n LEU 9 CO 0.29 0.28 0.09 0.00 0.00 0.00 0.00 177.39 178.05 2e7c n ALA 10 N -3.50 -1.18 -3.36 1.96 0.00 -1.26 -4.97 120.51 108.20 2e7c n ALA 10 Ca -0.04 0.25 -0.13 0.00 0.00 0.00 0.00 53.44 53.52 2e7c n ALA 10 Cb 0.56 -4.29 -0.10 0.00 0.00 0.00 0.00 19.45 15.62 2e7c n ALA 10 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2e7c s GLN 11 N -6.24 0.45 0.84 0.00 -0.21 -1.09 -5.08 119.66 108.32 2e7c s GLN 11 Ca 0.52 0.59 -0.11 0.00 0.02 0.00 0.00 55.36 56.38 2e7c s GLN 11 Cb -0.25 0.18 0.10 0.00 1.00 0.00 0.00 33.01 34.03 2e7c s GLN 11 CO 0.64 -0.07 1.09 -1.25 -2.12 0.00 0.00 175.29 173.58 2e7c s PRO 12 N 0.42 1.71 -0.13 2.91 0.04 -1.26 -1.94 135.00 136.74 2e7c s PRO 12 Ca -0.02 0.98 -0.29 0.00 0.04 0.00 0.00 61.00 61.71 2e7c s PRO 12 Cb -0.04 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2e7c s PRO 12 CO -0.02 -1.97 1.22 0.08 0.04 0.00 0.00 177.00 176.35 2e7c s VAL 13 N -2.92 4.32 -0.20 -0.36 1.01 -1.26 -4.87 120.40 116.12 2e7c s VAL 13 Ca 0.62 1.61 -0.43 0.00 0.00 0.00 0.00 61.98 63.79 2e7c s VAL 13 Cb -0.18 -4.04 -0.20 0.00 0.00 0.00 0.00 36.38 31.97 2e7c s VAL 13 CO 0.57 -0.09 1.32 0.41 0.00 0.00 0.00 175.10 177.31 2e7c n THR 14 N 5.08 0.01 -4.02 3.92 -1.04 -1.26 -4.94 114.28 112.04 2e7c n THR 14 Ca 0.13 -0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.90 2e7c n THR 14 Cb 0.45 -0.29 -0.03 0.00 -1.82 0.00 0.00 70.33 68.64 2e7c n THR 14 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2e7c s ILE 15 N 1.35 4.94 -0.41 12.58 -1.09 -1.26 -5.00 121.20 132.30 2e7c s ILE 15 Ca 0.96 -1.04 0.04 0.00 -2.23 0.00 0.00 60.65 58.39 2e7c s ILE 15 Cb -1.34 -3.62 0.38 0.00 -1.58 0.00 0.00 42.46 36.30 2e7c s ILE 15 CO 0.67 -0.24 1.31 -1.14 -1.23 0.00 0.00 174.94 174.31 2e7c n ARG 16 N -0.96 2.27 -2.64 2.79 0.63 -1.26 -4.93 116.66 112.56 2e7c n ARG 16 Ca -0.08 -1.56 -0.33 0.00 -0.92 0.00 0.00 57.85 54.96 2e7c n ARG 16 Cb 0.56 -1.74 -0.05 0.00 0.45 0.00 0.00 32.46 31.68 2e7c n ARG 16 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 2e7c s GLU 17 N -1.78 4.08 0.29 -0.14 -1.05 -1.26 -4.97 118.70 113.87 2e7c s GLU 17 Ca 0.28 1.01 -0.26 0.00 -0.15 0.00 0.00 54.97 55.86 2e7c s GLU 17 Cb 0.23 -2.17 -0.16 0.00 -0.44 0.00 0.00 34.13 31.59 2e7c s GLU 17 CO 0.07 -0.13 0.48 -0.89 0.95 0.00 0.00 175.26 175.74 2e7c n ILE 18 N -1.07 1.66 0.02 1.83 5.41 -1.26 -4.91 119.36 121.04 2e7c n ILE 18 Ca 0.07 -0.50 -0.22 0.00 1.00 0.00 0.00 62.75 63.10 2e7c n ILE 18 Cb 0.54 -0.20 -0.14 0.00 -0.71 0.00 0.00 39.64 39.13 2e7c n ILE 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2e7c h ALA 19 N 0.94 0.22 -2.64 -1.39 0.00 -1.94 -3.47 119.26 110.97 2e7c h ALA 19 Ca -0.33 -1.16 -0.12 0.00 0.00 0.00 0.00 54.91 53.30 2e7c h ALA 19 Cb 1.42 0.53 -0.27 0.00 0.00 0.00 0.00 17.79 19.47 2e7c h ALA 19 CO 0.54 0.95 -0.32 -2.00 0.00 0.00 0.00 179.25 178.43 2e7c s GLU 20 N -2.51 0.37 0.56 0.00 2.56 -1.24 -4.88 118.70 113.56 2e7c s GLU 20 Ca -0.20 0.81 -0.19 0.00 0.00 0.00 0.00 54.97 55.40 2e7c s GLU 20 Cb 0.05 0.02 -0.05 0.00 2.00 0.00 0.00 34.13 36.15 2e7c s GLU 20 CO 0.78 -0.17 1.13 -1.25 -0.56 0.00 0.00 175.26 175.18 2e7c s PRO 21 N 1.56 3.26 0.51 4.30 0.04 -1.26 -0.43 135.00 142.99 2e7c s PRO 21 Ca -0.08 1.57 -0.21 0.00 0.04 0.00 0.00 61.00 62.32 2e7c s PRO 21 Cb -0.09 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 2e7c s PRO 21 CO -0.13 -0.92 1.14 -1.25 0.04 0.00 0.00 177.00 175.89 2e7c s PRO 22 N -3.43 3.50 -0.30 0.56 0.04 -1.26 -3.51 135.00 130.61 2e7c s PRO 22 Ca 0.72 1.67 -0.04 0.00 0.04 0.00 0.00 61.00 63.39 2e7c s PRO 22 Cb -0.23 -2.15 0.17 0.00 0.04 0.00 0.00 34.50 32.33 2e7c s PRO 22 CO 0.29 -0.74 0.63 0.21 0.04 0.00 0.00 177.00 177.43 2e7c s LYS 23 N -3.07 0.56 -0.62 4.56 2.36 -0.58 -4.92 119.74 118.03 2e7c s LYS 23 Ca 0.69 1.11 -0.25 0.00 -2.55 0.00 0.00 55.97 54.98 2e7c s LYS 23 Cb -0.26 0.64 0.04 0.00 -1.05 0.00 0.00 37.83 37.21 2e7c s LYS 23 CO 0.30 -0.49 1.06 0.42 1.55 0.00 0.00 175.35 178.19 2e7c s ILE 24 N 2.87 4.18 -0.23 5.43 1.01 -1.26 -0.59 121.20 132.60 2e7c s ILE 24 Ca 0.13 0.28 -0.20 0.00 0.00 0.00 0.00 60.65 60.85 2e7c s ILE 24 Cb -0.14 -4.68 -0.02 0.00 0.01 0.00 0.00 42.46 37.63 2e7c s ILE 24 CO -0.20 -1.38 0.60 -0.13 0.00 0.00 0.00 174.94 173.83 2e7c s ARG 25 N 4.50 4.14 -0.08 2.79 0.52 -0.45 -5.00 118.95 125.38 2e7c s ARG 25 Ca 0.32 0.51 -0.10 0.00 -0.52 0.00 0.00 55.73 55.94 2e7c s ARG 25 Cb -0.12 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.69 2e7c s ARG 25 CO 0.17 -0.32 0.23 -0.51 0.02 0.00 0.00 175.30 174.90 2e7c s LEU 26 N 2.18 4.41 0.00 2.53 1.43 -1.26 -3.21 118.68 124.76 2e7c s LEU 26 Ca 0.26 0.63 -0.03 0.00 -1.03 0.00 0.00 54.13 53.95 2e7c s LEU 26 Cb -0.16 -2.25 0.05 0.00 0.03 0.00 0.00 46.19 43.86 2e7c s LEU 26 CO 0.09 0.36 0.16 -0.81 0.23 0.00 0.00 176.35 176.39 2e7c n PRO 27 N 2.03 -1.35 0.00 1.29 -0.04 -1.26 -4.97 135.00 130.70 2e7c n PRO 27 Ca -0.18 -0.26 0.11 0.00 -0.04 0.00 0.00 63.50 63.13 2e7c n PRO 27 Cb 0.54 -0.25 0.04 0.00 -0.04 0.00 0.00 33.50 33.79 2e7c n PRO 27 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2e7c n ARG 28 N -2.01 0.96 0.00 0.54 0.63 -1.26 -3.95 116.66 111.56 2e7c n ARG 28 Ca 0.02 -0.77 0.11 0.00 -0.92 0.00 0.00 57.85 56.30 2e7c n ARG 28 Cb 0.09 -1.48 -0.01 0.00 0.45 0.00 0.00 32.46 31.50 2e7c n ARG 28 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 2e7c n HIS 29 N -0.35 0.00 -0.08 -0.14 1.44 -1.26 -4.27 115.22 110.56 2e7c n HIS 29 Ca 0.09 0.00 -0.06 0.00 -2.01 0.00 0.00 57.72 55.73 2e7c n HIS 29 Cb 0.43 -0.00 -0.14 0.00 0.12 0.00 0.00 29.99 30.40 2e7c n HIS 29 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2e7c n LEU 30 N -0.12 0.00 -0.31 2.39 4.77 -1.26 -4.39 117.00 118.08 2e7c n LEU 30 Ca 0.09 0.00 0.28 0.00 -0.03 0.00 0.00 56.01 56.35 2e7c n LEU 30 Cb 0.46 0.39 0.62 0.00 -2.33 0.00 0.00 43.42 42.55 2e7c n LEU 30 CO 0.29 0.39 1.26 0.03 -1.33 0.00 0.00 177.39 178.03 2e7c h ARG 31 N 0.00 0.21 -6.23 3.23 3.08 -1.74 -3.40 114.38 109.53 2e7c h ARG 31 Ca -0.42 -0.01 -0.65 0.00 0.07 0.00 0.00 59.98 58.97 2e7c h ARG 31 Cb 1.95 -0.05 -0.10 0.00 0.08 0.00 0.00 29.97 31.85 2e7c h ARG 31 CO 0.02 0.14 -0.62 1.14 -1.07 0.00 0.00 179.97 179.58 2e7c s GLN 32 N -5.25 2.78 -0.47 0.04 -2.07 -1.26 -5.02 119.66 108.41 2e7c s GLN 32 Ca -0.07 -0.72 -0.44 0.00 -1.82 0.00 0.00 55.36 52.30 2e7c s GLN 32 Cb 0.24 -2.67 -0.19 0.00 -1.09 0.00 0.00 33.01 29.30 2e7c s GLN 32 CO 0.80 0.57 1.88 2.41 -1.32 0.00 0.00 175.29 179.62 2e7c n THR 33 N 0.59 0.04 -1.78 3.63 -1.04 -1.26 -4.77 114.28 109.69 2e7c n THR 33 Ca -0.10 -0.02 -0.43 0.00 -2.04 0.00 0.00 64.05 61.46 2e7c n THR 33 Cb 0.52 -0.64 -0.03 0.00 -1.82 0.00 0.00 70.33 68.36 2e7c n THR 33 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2e7c s TYR 34 N 4.57 1.46 -0.26 -1.42 5.04 -1.14 -4.90 117.35 120.70 2e7c s TYR 34 Ca 1.11 0.40 -0.08 0.00 -2.44 0.00 0.00 57.07 56.07 2e7c s TYR 34 Cb -1.42 -4.03 -0.02 0.00 0.35 0.00 0.00 41.96 36.84 2e7c s TYR 34 CO 0.72 -3.90 0.09 0.42 -1.34 0.00 0.00 175.55 171.53 2e7c s ILE 35 N 6.96 4.37 -0.02 3.14 -1.09 -1.26 -0.40 121.20 132.89 2e7c s ILE 35 Ca 0.90 -0.24 -0.09 0.00 -2.23 0.00 0.00 60.65 58.99 2e7c s ILE 35 Cb -0.31 -3.09 0.01 0.00 -1.58 0.00 0.00 42.46 37.49 2e7c s ILE 35 CO 0.35 0.27 0.20 -0.13 -1.23 0.00 0.00 174.94 174.39 2e7c s ARG 36 N 1.61 0.46 0.54 2.79 1.81 -0.93 -5.04 118.95 120.18 2e7c s ARG 36 Ca 0.06 -0.16 -0.12 0.00 -1.72 0.00 0.00 55.73 53.79 2e7c s ARG 36 Cb -0.16 0.20 -0.05 0.00 -0.45 0.00 0.00 34.95 34.49 2e7c s ARG 36 CO 0.04 -0.11 0.94 0.15 -0.68 0.00 0.00 175.30 175.65 2e7c s LYS 37 N -0.95 3.72 0.64 3.54 1.02 -1.26 -0.92 119.74 125.53 2e7c s LYS 37 Ca -0.10 0.69 -0.15 0.00 0.02 0.00 0.00 55.97 56.43 2e7c s LYS 37 Cb -0.05 -2.18 -0.01 0.00 -0.52 0.00 0.00 37.83 35.06 2e7c s LYS 37 CO 0.02 -0.35 1.10 0.14 -0.92 0.00 0.00 175.35 175.34 2e7c s VAL 38 N -2.83 3.38 0.00 3.17 -7.23 -0.20 -3.51 120.40 113.18 2e7c s VAL 38 Ca 0.55 0.65 0.00 0.00 -1.81 0.00 0.00 61.98 61.37 2e7c s VAL 38 Cb -0.10 -3.18 0.00 0.00 0.56 0.00 0.00 36.38 33.66 2e7c s VAL 38 CO 0.42 -0.39 0.00 0.61 -0.31 0.00 0.00 175.10 175.43 2e7c n GLY 39 N -0.62 1.14 3.70 2.32 0.00 0.19 -4.70 105.19 107.22 2e7c n GLY 39 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2e7c n GLY 39 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2e7c n GLU 40 N 0.00 1.61 -2.13 1.61 -0.58 -1.23 -3.67 120.64 116.25 2e7c n GLU 40 Ca 0.00 0.59 -0.42 0.00 -0.42 0.00 0.00 57.16 56.91 2e7c n GLU 40 Cb 0.00 -2.42 -0.03 0.00 -0.57 0.00 0.00 31.44 28.42 2e7c n GLU 40 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2e7c s GLN 41 N -2.63 4.32 0.02 3.49 -0.21 -1.26 -2.72 119.66 120.67 2e7c s GLN 41 Ca 0.69 2.15 -0.03 0.00 0.02 0.00 0.00 55.36 58.19 2e7c s GLN 41 Cb -0.45 -3.19 -0.04 0.00 1.00 0.00 0.00 33.01 30.33 2e7c s GLN 41 CO 0.52 -0.39 0.22 -0.51 -2.12 0.00 0.00 175.29 173.00 2e7c s LEU 42 N 0.40 4.36 -0.12 2.90 1.43 -1.16 -4.96 118.68 121.53 2e7c s LEU 42 Ca 0.61 0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 54.04 2e7c s LEU 42 Cb -0.39 -2.77 0.06 0.00 0.03 0.00 0.00 46.19 43.12 2e7c s LEU 42 CO 0.36 0.22 0.24 0.21 0.23 0.00 0.00 176.35 177.61 2e7c s ASN 43 N -2.10 0.20 -0.20 2.29 2.47 -1.26 -2.78 114.94 113.56 2e7c s ASN 43 Ca 0.30 0.54 -0.04 0.00 0.42 0.00 0.00 52.86 54.08 2e7c s ASN 43 Cb -0.13 0.56 0.07 0.00 -1.45 0.00 0.00 41.25 40.30 2e7c s ASN 43 CO 0.21 -0.22 0.08 -0.76 -3.72 0.00 0.00 177.10 172.70 2e7c s LEU 44 N 2.04 0.61 -0.44 3.21 1.43 -0.64 -4.98 118.68 119.90 2e7c s LEU 44 Ca -0.02 -0.79 -0.13 0.00 -1.03 0.00 0.00 54.13 52.17 2e7c s LEU 44 Cb -0.12 -0.35 0.07 0.00 0.03 0.00 0.00 46.19 45.82 2e7c s LEU 44 CO -0.08 -0.36 0.33 0.54 0.23 0.00 0.00 176.35 177.01 2e7c s VAL 45 N 2.06 4.84 -0.48 -1.59 0.11 -1.26 -0.94 120.40 123.13 2e7c s VAL 45 Ca 0.03 -1.14 -0.12 0.00 -2.93 0.00 0.00 61.98 57.82 2e7c s VAL 45 Cb -0.16 -3.88 0.11 0.00 -1.53 0.00 0.00 36.38 30.91 2e7c s VAL 45 CO -0.13 -0.51 0.37 -0.69 -3.33 0.00 0.00 175.10 170.81 2e7c s VAL 46 N 1.56 4.61 0.64 2.04 1.01 -1.16 -4.73 120.40 124.38 2e7c s VAL 46 Ca 0.04 -1.53 -0.16 0.00 0.00 0.00 0.00 61.98 60.33 2e7c s VAL 46 Cb -0.23 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 2e7c s VAL 46 CO 0.05 -0.72 1.11 -2.16 0.00 0.00 0.00 175.10 173.39 2e7c s PRO 47 N 1.47 2.89 -0.14 2.72 0.04 -1.20 -3.51 135.00 137.27 2e7c s PRO 47 Ca 0.04 1.42 -0.19 0.00 0.04 0.00 0.00 61.00 62.32 2e7c s PRO 47 Cb -0.26 -1.96 0.05 0.00 0.04 0.00 0.00 34.50 32.37 2e7c s PRO 47 CO 0.02 -1.19 0.50 -0.59 0.04 0.00 0.00 177.00 175.78 2e7c s PHE 48 N -2.25 -0.51 0.27 0.56 -0.12 -1.25 -1.34 117.98 113.34 2e7c s PHE 48 Ca 0.68 1.16 0.07 0.00 -0.05 0.00 0.00 56.93 58.79 2e7c s PHE 48 Cb -0.21 0.21 -0.03 0.00 -0.63 0.00 0.00 43.02 42.35 2e7c s PHE 48 CO 0.39 -0.34 0.20 -0.65 -0.05 0.00 0.00 175.22 174.78 2e7c s GLN 49 N -0.19 2.85 0.00 1.99 -1.52 0.24 -4.64 119.66 118.39 2e7c s GLN 49 Ca -0.04 -1.12 0.00 0.00 -1.95 0.00 0.00 55.36 52.25 2e7c s GLN 49 Cb -0.03 -2.52 0.00 0.00 -0.22 0.00 0.00 33.01 30.23 2e7c s GLN 49 CO 0.03 0.35 0.00 0.41 -0.25 0.00 0.00 175.29 175.82 2e7c n GLY 50 N -1.19 4.42 3.16 3.09 0.00 -1.23 -1.53 105.19 111.91 2e7c n GLY 50 Ca -0.07 -1.22 -0.08 0.00 0.00 0.00 0.00 46.02 44.65 2e7c n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e7c s LYS 51 N -3.38 0.77 0.01 1.61 3.01 0.43 -4.22 119.74 117.97 2e7c s LYS 51 Ca 0.00 -1.12 -0.23 0.00 -1.01 0.00 0.00 55.97 53.61 2e7c s LYS 51 Cb 0.00 0.28 -0.17 0.00 -1.01 0.00 0.00 37.83 36.93 2e7c s LYS 51 CO 0.00 -0.21 1.30 -1.00 0.51 0.00 0.00 175.35 175.95 2e7c h PRO 52 N 2.91 0.17 -3.15 -1.68 0.13 -1.96 -3.31 132.00 125.11 2e7c h PRO 52 Ca -0.34 -0.09 -0.58 0.00 -0.87 0.00 0.00 66.00 64.12 2e7c h PRO 52 Cb 1.18 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.91 2e7c h PRO 52 CO 0.60 0.61 -0.77 1.03 -0.23 0.00 0.00 178.00 179.24 2e7c s ARG 53 N -4.28 0.74 -0.05 0.86 0.52 -1.26 -5.07 118.95 110.40 2e7c s ARG 53 Ca -0.15 -1.24 -0.30 0.00 -0.52 0.00 0.00 55.73 53.52 2e7c s ARG 53 Cb 0.03 -1.83 -0.05 0.00 0.52 0.00 0.00 34.95 33.62 2e7c s ARG 53 CO 0.71 -1.07 1.49 -1.25 0.02 0.00 0.00 175.30 175.20 2e7c s PRO 54 N 1.32 4.23 0.74 3.54 0.04 -1.26 -4.95 135.00 138.66 2e7c s PRO 54 Ca 0.13 2.02 -0.12 0.00 0.04 0.00 0.00 61.00 63.07 2e7c s PRO 54 Cb -0.20 -3.76 0.04 0.00 0.04 0.00 0.00 34.50 30.62 2e7c s PRO 54 CO -0.17 -0.71 1.09 -1.14 0.04 0.00 0.00 177.00 176.11 2e7c s GLN 55 N 3.23 2.46 -0.07 4.56 2.00 0.03 -4.85 119.66 127.02 2e7c s GLN 55 Ca 0.66 1.19 -0.00 0.00 -2.00 0.00 0.00 55.36 55.21 2e7c s GLN 55 Cb -0.31 -1.92 0.02 0.00 0.80 0.00 0.00 33.01 31.61 2e7c s GLN 55 CO 0.26 -1.49 -0.04 0.08 -0.50 0.00 0.00 175.29 173.60 2e7c s VAL 56 N -2.79 0.61 -0.18 1.34 1.01 -1.26 -2.17 120.40 116.96 2e7c s VAL 56 Ca 0.62 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.53 2e7c s VAL 56 Cb -0.17 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.54 2e7c s VAL 56 CO 0.52 0.28 -0.17 -0.69 0.00 0.00 0.00 175.10 175.04 2e7c s VAL 57 N 1.50 2.31 -0.22 2.92 1.01 -0.39 -5.01 120.40 122.52 2e7c s VAL 57 Ca -0.01 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.02 2e7c s VAL 57 Cb -0.13 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2e7c s VAL 57 CO -0.04 0.52 0.11 0.26 0.00 0.00 0.00 175.10 175.95 2e7c s TRP 58 N 1.23 3.24 0.05 5.22 0.52 -1.26 -2.65 118.94 125.28 2e7c s TRP 58 Ca 0.03 0.03 0.03 0.00 0.02 0.00 0.00 56.10 56.20 2e7c s TRP 58 Cb -0.14 -2.20 -0.03 0.00 -1.15 0.00 0.00 33.47 29.96 2e7c s TRP 58 CO -0.09 -0.01 -0.09 0.95 0.02 0.00 0.00 176.95 177.74 2e7c s THR 59 N 0.98 0.63 -0.80 2.01 -4.23 -0.94 -2.39 115.64 110.89 2e7c s THR 59 Ca 0.05 -1.20 0.01 0.00 -1.18 0.00 0.00 61.69 59.38 2e7c s THR 59 Cb -0.14 -0.78 0.20 0.00 1.34 0.00 0.00 72.50 73.12 2e7c s THR 59 CO 0.03 -0.41 0.64 -0.75 -0.54 0.00 0.00 174.62 173.60 2e7c s LYS 60 N -1.82 2.91 0.00 3.99 2.47 -0.12 -0.87 119.74 126.29 2e7c s LYS 60 Ca -0.07 -3.25 0.00 0.00 -1.56 0.00 0.00 55.97 51.09 2e7c s LYS 60 Cb -0.09 -3.73 0.00 0.00 -1.46 0.00 0.00 37.83 32.55 2e7c s LYS 60 CO 0.00 -1.26 0.00 0.41 0.16 0.00 0.00 175.35 174.66 2e7c n GLY 61 N 2.27 3.06 0.00 5.54 0.00 -0.95 -4.43 105.19 110.68 2e7c n GLY 61 Ca 0.20 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2e7c n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e7c n GLY 62 N 0.00 0.03 3.98 -0.02 0.00 -1.26 -5.02 105.19 102.89 2e7c n GLY 62 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 2e7c n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e7c s ALA 63 N -0.71 4.24 0.38 4.61 0.00 -1.26 -4.97 121.76 124.04 2e7c s ALA 63 Ca 0.00 -1.50 -0.26 0.00 0.00 0.00 0.00 51.96 50.20 2e7c s ALA 63 Cb 0.00 -1.63 -0.09 0.00 0.00 0.00 0.00 23.12 21.40 2e7c s ALA 63 CO 0.00 -0.06 1.20 -1.25 0.00 0.00 0.00 175.76 175.65 2e7c s PRO 64 N -4.18 4.16 0.77 0.00 0.04 -1.26 -0.94 135.00 133.58 2e7c s PRO 64 Ca 0.46 1.93 -0.17 0.00 0.04 0.00 0.00 61.00 63.27 2e7c s PRO 64 Cb -0.09 -2.81 -0.10 0.00 0.04 0.00 0.00 34.50 31.54 2e7c s PRO 64 CO 0.31 -0.26 -0.09 1.28 0.04 0.00 0.00 177.00 178.28 2e7c n LEU 65 N 0.33 -2.72 0.05 -3.56 4.77 -1.01 -4.76 117.00 110.10 2e7c n LEU 65 Ca 0.03 0.46 0.21 0.00 -0.03 0.00 0.00 56.01 56.67 2e7c n LEU 65 Cb 0.45 -0.97 0.73 0.00 -2.33 0.00 0.00 43.42 41.31 2e7c n LEU 65 CO 0.53 -4.57 1.19 0.44 -1.33 0.00 0.00 177.39 173.65 2e7c h ASP 66 N -0.58 0.00 -4.76 -1.43 5.19 -1.94 -3.44 116.42 109.45 2e7c h ASP 66 Ca -0.44 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 55.78 2e7c h ASP 66 Cb 1.36 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.82 2e7c h ASP 66 CO 0.35 0.00 -0.27 0.35 -3.12 0.00 0.00 179.24 176.55 2e7c n THR 67 N -3.99 -0.41 -0.06 0.35 -2.24 -1.26 -4.75 114.28 101.93 2e7c n THR 67 Ca 0.09 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.78 2e7c n THR 67 Cb 0.62 -1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 67.77 2e7c n THR 67 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2e7c n SER 68 N -1.82 2.90 0.00 3.42 7.64 -1.26 -4.80 113.62 119.70 2e7c n SER 68 Ca -0.05 -0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.79 2e7c n SER 68 Cb 0.55 -0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2e7c n SER 68 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2e7c n ARG 69 N -2.90 2.42 -2.88 1.43 0.00 -1.26 -5.03 116.66 108.44 2e7c n ARG 69 Ca -0.21 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.24 2e7c n ARG 69 Cb 0.71 -0.80 -0.05 0.00 -0.00 0.00 0.00 32.46 32.33 2e7c n ARG 69 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2e7c s VAL 70 N -1.53 4.65 -0.38 8.89 1.01 -1.26 -4.75 120.40 127.02 2e7c s VAL 70 Ca 0.00 1.81 -0.04 0.00 0.00 0.00 0.00 61.98 63.75 2e7c s VAL 70 Cb 0.00 -4.20 0.09 0.00 0.00 0.00 0.00 36.38 32.27 2e7c s VAL 70 CO 0.00 0.34 0.16 -2.28 0.00 0.00 0.00 175.10 173.32 2e7c s HIS 71 N -0.00 3.47 -0.16 5.22 2.46 -1.24 -4.73 115.29 120.31 2e7c s HIS 71 Ca 0.42 -2.15 -0.05 0.00 0.47 0.00 0.00 55.06 53.75 2e7c s HIS 71 Cb -0.22 -2.90 -0.03 0.00 -0.13 0.00 0.00 32.58 29.30 2e7c s HIS 71 CO 0.26 -0.91 0.02 0.08 -2.47 0.00 0.00 174.74 171.72 2e7c s VAL 72 N 1.21 4.40 -0.53 0.89 1.01 -1.26 -3.20 120.40 122.92 2e7c s VAL 72 Ca 0.04 -0.18 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 2e7c s VAL 72 Cb -0.22 -2.95 0.14 0.00 0.00 0.00 0.00 36.38 33.35 2e7c s VAL 72 CO -0.02 0.49 0.39 -0.13 0.00 0.00 0.00 175.10 175.82 2e7c s ARG 73 N 0.23 2.53 -0.07 2.72 0.52 -0.10 -4.95 118.95 119.82 2e7c s ARG 73 Ca 0.01 -2.03 -0.18 0.00 -0.52 0.00 0.00 55.73 53.02 2e7c s ARG 73 Cb -0.13 -3.87 -0.05 0.00 0.52 0.00 0.00 34.95 31.42 2e7c s ARG 73 CO 0.01 -1.18 0.49 0.99 0.02 0.00 0.00 175.30 175.64 2e7c s THR 74 N 0.87 5.09 -0.02 0.02 2.01 -1.26 -0.14 115.64 122.22 2e7c s THR 74 Ca 0.10 1.00 0.03 0.00 0.31 0.00 0.00 61.69 63.14 2e7c s THR 74 Cb -0.23 -3.83 -0.01 0.00 0.01 0.00 0.00 72.50 68.45 2e7c s THR 74 CO -0.03 0.39 -0.12 -0.55 -0.69 0.00 0.00 174.62 173.63 2e7c s SER 75 N 0.13 1.40 0.35 3.53 0.15 -0.73 -4.96 113.70 113.57 2e7c s SER 75 Ca 0.27 -0.22 0.29 0.00 0.70 0.00 0.00 55.95 56.99 2e7c s SER 75 Cb -0.16 -0.22 1.16 0.00 -1.71 0.00 0.00 66.02 65.09 2e7c s SER 75 CO 0.12 0.13 1.14 -0.90 1.20 0.00 0.00 173.24 174.94 2e7c n ASP 76 N 2.93 0.10 0.00 5.45 5.75 -1.26 -1.20 116.55 128.32 2e7c n ASP 76 Ca -0.15 0.91 0.00 0.00 -0.01 0.00 0.00 54.79 55.54 2e7c n ASP 76 Cb 0.55 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 2e7c n ASP 76 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2e7c n PHE 77 N -3.88 0.00 -4.05 2.11 3.72 -1.26 -4.64 117.46 109.45 2e7c n PHE 77 Ca 0.31 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.63 2e7c n PHE 77 Cb 1.27 -0.40 -0.10 0.00 -0.94 0.00 0.00 39.48 39.31 2e7c n PHE 77 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2e7c s ASP 78 N -2.72 0.41 0.25 4.37 1.47 -0.34 -3.85 116.67 116.27 2e7c s ASP 78 Ca 0.00 -0.86 0.05 0.00 1.18 0.00 0.00 52.55 52.92 2e7c s ASP 78 Cb 0.00 0.18 -0.03 0.00 -0.34 0.00 0.00 42.92 42.73 2e7c s ASP 78 CO 0.00 -0.53 0.36 0.28 0.68 0.00 0.00 175.17 175.95 2e7c s THR 79 N -3.31 5.04 -0.00 2.11 -1.32 -1.23 -1.78 115.64 115.15 2e7c s THR 79 Ca 0.01 -1.03 0.03 0.00 -1.21 0.00 0.00 61.69 59.49 2e7c s THR 79 Cb 0.03 -3.76 -0.01 0.00 -1.51 0.00 0.00 72.50 67.26 2e7c s THR 79 CO -0.08 -0.31 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.24 2e7c s VAL 80 N -2.02 0.69 -0.05 5.08 1.01 0.80 -2.96 120.40 122.96 2e7c s VAL 80 Ca 0.35 -0.42 0.05 0.00 0.00 0.00 0.00 61.98 61.97 2e7c s VAL 80 Cb -0.09 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 2e7c s VAL 80 CO 0.29 0.17 -0.20 0.12 0.00 0.00 0.00 175.10 175.48 2e7c s PHE 81 N -0.27 2.54 0.04 5.22 5.36 -0.12 -0.92 117.98 129.84 2e7c s PHE 81 Ca 0.03 -0.37 -0.07 0.00 -0.96 0.00 0.00 56.93 55.56 2e7c s PHE 81 Cb -0.04 -1.59 -0.00 0.00 -0.34 0.00 0.00 43.02 41.04 2e7c s PHE 81 CO -0.00 0.03 0.14 0.12 -1.46 0.00 0.00 175.22 174.04 2e7c s PHE 82 N -0.54 0.14 -0.19 10.12 5.36 -1.19 -1.63 117.98 130.04 2e7c s PHE 82 Ca 0.07 -0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 55.59 2e7c s PHE 82 Cb -0.11 -0.09 0.09 0.00 -0.34 0.00 0.00 43.02 42.57 2e7c s PHE 82 CO 0.01 -0.40 0.26 0.08 -1.46 0.00 0.00 175.22 173.71 2e7c s VAL 83 N -2.62 -0.40 0.12 3.12 1.01 -1.12 -3.65 120.40 116.87 2e7c s VAL 83 Ca -0.05 -0.01 -0.23 0.00 0.00 0.00 0.00 61.98 61.69 2e7c s VAL 83 Cb -0.01 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 2e7c s VAL 83 CO -0.04 -0.11 1.17 -1.14 0.00 0.00 0.00 175.10 174.98 2e7c n ARG 84 N 5.34 -0.33 -3.69 2.72 3.00 -1.26 -2.99 116.66 119.44 2e7c n ARG 84 Ca -0.05 1.15 -0.17 0.00 -0.00 0.00 0.00 57.85 58.77 2e7c n ARG 84 Cb 0.50 -1.69 -0.16 0.00 0.00 0.00 0.00 32.46 31.10 2e7c n ARG 84 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 2e7c s GLN 85 N -5.40 -0.02 0.90 -0.14 -2.07 -1.26 -4.16 119.66 107.51 2e7c s GLN 85 Ca -0.09 0.41 -0.11 0.00 -1.82 0.00 0.00 55.36 53.74 2e7c s GLN 85 Cb 0.09 -0.35 0.13 0.00 -1.09 0.00 0.00 33.01 31.79 2e7c s GLN 85 CO 0.47 -0.28 1.09 0.00 -1.32 0.00 0.00 175.29 175.26 2e7c s ALA 86 N 1.93 1.51 -0.20 2.60 0.00 -1.10 -4.66 121.76 121.83 2e7c s ALA 86 Ca 0.01 -0.04 -0.27 0.00 0.00 0.00 0.00 51.96 51.65 2e7c s ALA 86 Cb -0.12 -3.20 0.08 0.00 0.00 0.00 0.00 23.12 19.88 2e7c s ALA 86 CO -0.04 -2.39 0.75 0.00 0.00 0.00 0.00 175.76 174.08 2e7c s ALA 87 N -2.91 -1.80 0.50 0.00 0.00 -1.26 -0.64 121.76 115.64 2e7c s ALA 87 Ca 0.64 1.78 0.45 0.00 0.00 0.00 0.00 51.96 54.83 2e7c s ALA 87 Cb -0.18 -0.84 1.56 0.00 0.00 0.00 0.00 23.12 23.66 2e7c s ALA 87 CO 0.57 -0.34 1.42 0.54 0.00 0.00 0.00 175.76 177.95 2e7c n ARG 88 N 2.03 -0.00 0.24 0.00 1.74 -1.26 0.79 116.66 120.18 2e7c n ARG 88 Ca -0.15 1.00 -0.15 0.00 -0.77 0.00 0.00 57.85 57.77 2e7c n ARG 88 Cb 0.56 -2.27 -0.08 0.00 -1.02 0.00 0.00 32.46 29.64 2e7c n ARG 88 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2e7c h SER 89 N 0.00 -0.46 -0.89 0.55 0.87 -1.96 -2.87 113.55 108.80 2e7c h SER 89 Ca 0.85 0.00 0.23 0.00 -1.23 0.00 0.00 61.79 61.65 2e7c h SER 89 Cb 3.38 0.12 -0.17 0.00 -0.44 0.00 0.00 62.40 65.29 2e7c h SER 89 CO -0.05 -0.31 -0.02 0.47 -0.53 0.00 0.00 176.83 176.39 2e7c n ASP 90 N -5.31 -0.14 -3.67 6.23 9.92 0.24 -4.50 116.55 119.32 2e7c n ASP 90 Ca -0.11 1.51 -0.52 0.00 -0.53 0.00 0.00 54.79 55.14 2e7c n ASP 90 Cb 0.24 -0.53 -0.08 0.00 -0.64 0.00 0.00 41.12 40.10 2e7c n ASP 90 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2e7c n SER 91 N -5.32 0.86 0.00 -2.24 7.64 -1.08 -4.73 113.62 108.75 2e7c n SER 91 Ca 0.20 0.84 0.00 0.00 1.01 0.00 0.00 58.87 60.91 2e7c n SER 91 Cb 0.64 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 2e7c n SER 91 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2e7c n GLY 92 N 3.91 1.16 2.82 0.23 0.00 -0.69 -5.01 105.19 107.60 2e7c n GLY 92 Ca 0.30 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2e7c n GLY 92 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2e7c s GLU 93 N 3.06 1.04 -0.23 1.61 2.12 -1.26 -1.90 118.70 123.15 2e7c s GLU 93 Ca 0.00 -0.76 -0.22 0.00 0.36 0.00 0.00 54.97 54.35 2e7c s GLU 93 Cb 0.00 -2.30 -0.02 0.00 0.26 0.00 0.00 34.13 32.08 2e7c s GLU 93 CO 0.00 -0.68 0.70 0.71 -0.54 0.00 0.00 175.26 175.45 2e7c s TYR 94 N 1.63 3.33 -0.25 5.30 1.51 0.28 -2.24 117.35 126.91 2e7c s TYR 94 Ca -0.01 0.97 -0.09 0.00 -1.01 0.00 0.00 57.07 56.93 2e7c s TYR 94 Cb -0.18 -2.90 -0.04 0.00 -0.11 0.00 0.00 41.96 38.73 2e7c s TYR 94 CO -0.10 -0.29 0.12 -2.00 -1.11 0.00 0.00 175.55 172.17 2e7c s GLU 95 N 2.39 3.85 -0.16 -0.62 2.12 -0.05 0.85 118.70 127.08 2e7c s GLU 95 Ca 0.30 -0.38 -0.03 0.00 0.36 0.00 0.00 54.97 55.22 2e7c s GLU 95 Cb -0.16 -3.45 -0.02 0.00 0.26 0.00 0.00 34.13 30.76 2e7c s GLU 95 CO 0.09 -0.09 -0.06 -1.17 -0.54 0.00 0.00 175.26 173.49 2e7c s LEU 96 N 1.43 3.06 0.01 2.70 0.20 0.12 -2.22 118.68 124.00 2e7c s LEU 96 Ca 0.06 -0.23 0.03 0.00 0.69 0.00 0.00 54.13 54.68 2e7c s LEU 96 Cb -0.15 -1.74 -0.01 0.00 -0.43 0.00 0.00 46.19 43.86 2e7c s LEU 96 CO 0.06 0.13 -0.09 -0.44 -0.29 0.00 0.00 176.35 175.72 2e7c s SER 97 N 0.59 1.03 -0.14 3.68 0.01 -1.09 0.15 113.70 117.94 2e7c s SER 97 Ca -0.04 -0.28 -0.01 0.00 1.31 0.00 0.00 55.95 56.93 2e7c s SER 97 Cb -0.15 -0.07 -0.02 0.00 0.21 0.00 0.00 66.02 65.99 2e7c s SER 97 CO 0.03 0.02 -0.10 -0.69 0.41 0.00 0.00 173.24 172.91 2e7c s VAL 98 N -0.54 3.36 -0.14 3.43 1.01 -0.53 -1.26 120.40 125.73 2e7c s VAL 98 Ca 0.00 -0.55 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 2e7c s VAL 98 Cb -0.05 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 2e7c s VAL 98 CO 0.00 0.52 0.09 -1.58 0.00 0.00 0.00 175.10 174.13 2e7c s GLN 99 N 0.30 3.62 0.11 2.72 0.74 -0.92 -0.43 119.66 125.81 2e7c s GLN 99 Ca -0.08 -0.26 0.02 0.00 0.05 0.00 0.00 55.36 55.10 2e7c s GLN 99 Cb -0.15 -3.15 -0.04 0.00 1.10 0.00 0.00 33.01 30.76 2e7c s GLN 99 CO 0.05 0.55 -0.07 0.42 -0.55 0.00 0.00 175.29 175.68 2e7c s ILE 100 N -0.39 0.81 0.03 -2.34 -1.09 0.27 -0.79 121.20 117.71 2e7c s ILE 100 Ca 0.10 -1.97 -0.07 0.00 -2.23 0.00 0.00 60.65 56.49 2e7c s ILE 100 Cb -0.12 -1.74 -0.01 0.00 -1.58 0.00 0.00 42.46 39.00 2e7c s ILE 100 CO 0.02 -0.83 0.75 -0.62 -1.23 0.00 0.00 174.94 173.03 2e7c n GLU 101 N -0.09 -0.09 -0.41 2.79 1.02 -1.26 -2.52 120.64 120.07 2e7c n GLU 101 Ca -0.11 0.75 0.06 0.00 -0.02 0.00 0.00 57.16 57.84 2e7c n GLU 101 Cb 0.61 -1.11 0.11 0.00 -0.02 0.00 0.00 31.44 31.03 2e7c n GLU 101 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2e7c n ASN 102 N -3.36 1.57 -4.11 1.62 2.85 -1.26 -5.05 115.26 107.52 2e7c n ASN 102 Ca 0.00 -2.92 -0.08 0.00 -0.11 0.00 0.00 54.58 51.48 2e7c n ASN 102 Cb 0.06 -0.39 -0.10 0.00 1.24 0.00 0.00 39.78 40.59 2e7c n ASN 102 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 2e7c s MET 103 N -2.05 0.70 0.15 1.20 -1.94 -1.05 -5.17 119.30 111.14 2e7c s MET 103 Ca 0.26 -1.28 -0.18 0.00 -1.71 0.00 0.00 55.69 52.79 2e7c s MET 103 Cb 0.25 0.15 0.04 0.00 2.01 0.00 0.00 34.83 37.28 2e7c s MET 103 CO -0.02 -0.12 0.47 0.21 -0.01 0.00 0.00 175.02 175.55 2e7c s LYS 104 N -3.93 1.18 0.11 2.03 2.20 -1.26 0.95 119.74 121.02 2e7c s LYS 104 Ca 0.11 -0.69 -0.03 0.00 -0.36 0.00 0.00 55.97 55.00 2e7c s LYS 104 Cb 0.08 0.51 -0.03 0.00 -1.51 0.00 0.00 37.83 36.87 2e7c s LYS 104 CO -0.07 -0.49 0.07 0.34 -0.36 0.00 0.00 175.35 174.85 2e7c s ASP 105 N -2.81 0.31 0.02 1.43 -1.08 0.43 -4.93 116.67 110.04 2e7c s ASP 105 Ca 0.04 -1.05 -0.05 0.00 -0.52 0.00 0.00 52.55 50.96 2e7c s ASP 105 Cb 0.01 0.29 -0.01 0.00 -1.46 0.00 0.00 42.92 41.75 2e7c s ASP 105 CO -0.10 -0.71 0.10 0.42 0.52 0.00 0.00 175.17 175.39 2e7c s THR 106 N -3.98 0.11 0.06 1.71 -4.23 -1.26 -1.46 115.64 106.58 2e7c s THR 106 Ca 0.17 -0.87 -0.19 0.00 -1.18 0.00 0.00 61.69 59.61 2e7c s THR 106 Cb 0.07 -0.57 0.04 0.00 1.34 0.00 0.00 72.50 73.38 2e7c s THR 106 CO -0.03 -0.48 0.45 0.00 -0.54 0.00 0.00 174.62 174.02 2e7c s ALA 107 N -1.83 -1.12 0.01 3.99 0.00 0.40 -4.93 121.76 118.28 2e7c s ALA 107 Ca -0.12 0.36 0.07 0.00 0.00 0.00 0.00 51.96 52.28 2e7c s ALA 107 Cb -0.06 0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.46 2e7c s ALA 107 CO -0.01 -0.51 -0.22 0.99 0.00 0.00 0.00 175.76 176.02 2e7c s THR 108 N -2.68 1.74 -0.01 0.00 2.01 -1.26 -0.70 115.64 114.73 2e7c s THR 108 Ca -0.04 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 60.91 2e7c s THR 108 Cb -0.00 -1.47 0.01 0.00 0.01 0.00 0.00 72.50 71.04 2e7c s THR 108 CO -0.04 0.38 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.61 2e7c s ILE 109 N -0.63 0.33 -0.20 1.82 1.01 0.25 -4.95 121.20 118.83 2e7c s ILE 109 Ca 0.08 -0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.58 2e7c s ILE 109 Cb -0.09 -0.32 -0.02 0.00 0.01 0.00 0.00 42.46 42.04 2e7c s ILE 109 CO 0.00 0.13 -0.02 -0.13 0.00 0.00 0.00 174.94 174.92 2e7c s ARG 110 N 0.29 3.52 -0.12 2.79 0.52 -1.26 0.10 118.95 124.80 2e7c s ARG 110 Ca -0.03 -0.57 0.01 0.00 -0.52 0.00 0.00 55.73 54.63 2e7c s ARG 110 Cb -0.06 -3.03 -0.01 0.00 0.52 0.00 0.00 34.95 32.37 2e7c s ARG 110 CO -0.00 -0.04 -0.17 0.42 0.02 0.00 0.00 175.30 175.53 2e7c s ILE 111 N 1.11 2.73 -0.07 1.52 1.01 -0.80 -2.86 121.20 123.84 2e7c s ILE 111 Ca 0.02 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.93 2e7c s ILE 111 Cb -0.14 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.21 2e7c s ILE 111 CO 0.01 0.54 -0.19 -0.60 0.00 0.00 0.00 174.94 174.70 2e7c s ARG 112 N 0.29 2.30 0.01 2.79 3.52 0.46 -1.71 118.95 126.61 2e7c s ARG 112 Ca -0.12 -0.67 0.06 0.00 -0.13 0.00 0.00 55.73 54.86 2e7c s ARG 112 Cb -0.16 -1.84 -0.03 0.00 -1.56 0.00 0.00 34.95 31.36 2e7c s ARG 112 CO 0.06 0.16 -0.16 0.08 -0.81 0.00 0.00 175.30 174.64 2e7c s VAL 113 N 0.33 2.96 0.00 7.11 1.01 -1.26 -2.20 120.40 128.36 2e7c s VAL 113 Ca -0.13 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 60.91 2e7c s VAL 113 Cb -0.16 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 2e7c s VAL 113 CO 0.05 0.43 -0.14 0.68 0.00 0.00 0.00 175.10 176.13 2e7c s VAL 114 N -0.86 1.07 0.56 2.92 -7.23 -0.10 -4.82 120.40 111.94 2e7c s VAL 114 Ca 0.14 -0.68 -0.21 0.00 -1.81 0.00 0.00 61.98 59.42 2e7c s VAL 114 Cb -0.11 -0.92 -0.05 0.00 0.56 0.00 0.00 36.38 35.87 2e7c s VAL 114 CO 0.04 0.22 1.22 -0.62 -0.31 0.00 0.00 175.10 175.65 2e7c n GLU 115 N 2.53 1.39 -3.26 4.82 -0.58 -1.26 -1.03 120.64 123.24 2e7c n GLU 115 Ca -0.15 0.52 -0.18 0.00 -0.42 0.00 0.00 57.16 56.92 2e7c n GLU 115 Cb 0.55 -2.41 0.00 0.00 -0.57 0.00 0.00 31.44 29.01 2e7c n GLU 115 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 2e7c s LYS 116 N -2.82 2.99 -0.03 3.49 0.00 -1.26 -4.74 119.74 117.37 2e7c s LYS 116 Ca 0.73 -1.09 0.02 0.00 0.00 0.00 0.00 55.97 55.64 2e7c s LYS 116 Cb -0.43 -2.78 0.01 0.00 0.00 0.00 0.00 37.83 34.62 2e7c s LYS 116 CO 0.48 -0.09 -0.07 0.00 0.00 0.00 0.00 175.35 175.67 2e7c s ALA 117 N -2.26 0.76 -2.82 0.59 0.00 -1.26 -5.05 121.76 111.71 2e7c s ALA 117 Ca 0.49 -0.25 0.25 0.00 0.00 0.00 0.00 51.96 52.46 2e7c s ALA 117 Cb -0.10 -0.31 0.50 0.00 0.00 0.00 0.00 23.12 23.21 2e7c s ALA 117 CO 0.32 0.10 1.44 0.41 0.00 0.00 0.00 175.76 178.03