#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7c s SER 2 N 0.00 0.79 -0.16 1.61 0.01 -1.26 -5.14 113.70 109.55 2e7c s SER 2 Ca 0.00 -0.01 -0.30 0.00 1.31 0.00 0.00 55.95 56.95 2e7c s SER 2 Cb 0.00 -0.23 0.13 0.00 0.21 0.00 0.00 66.02 66.13 2e7c s SER 2 CO 0.00 -0.16 1.03 -0.55 0.41 0.00 0.00 173.24 173.98 2e7c s SER 3 N 1.49 -0.33 0.00 2.44 0.15 -1.26 -5.15 113.70 111.04 2e7c s SER 3 Ca -0.03 0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.94 2e7c s SER 3 Cb -0.13 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 2e7c s SER 3 CO -0.03 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.70 2e7c n GLY 4 N 0.62 2.99 3.64 9.45 0.00 -1.26 -5.20 105.19 115.43 2e7c n GLY 4 Ca -0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 46.02 45.71 2e7c n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2e7c s SER 5 N 0.00 -0.12 -0.15 1.61 1.04 -1.26 -5.16 113.70 109.67 2e7c s SER 5 Ca 0.00 -0.17 -0.02 0.00 0.48 0.00 0.00 55.95 56.24 2e7c s SER 5 Cb 0.00 0.25 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 2e7c s SER 5 CO 0.00 -0.46 -0.08 -0.94 0.98 0.00 0.00 173.24 172.74 2e7c s SER 6 N -2.81 4.41 -0.05 7.02 1.04 -1.26 -4.59 113.70 117.46 2e7c s SER 6 Ca 0.12 -0.23 -0.00 0.00 0.48 0.00 0.00 55.95 56.32 2e7c s SER 6 Cb 0.02 -1.70 0.00 0.00 0.10 0.00 0.00 66.02 64.44 2e7c s SER 6 CO -0.03 0.16 0.04 0.61 0.98 0.00 0.00 173.24 175.00 2e7c n GLY 7 N 3.58 0.89 3.16 7.32 0.00 -1.26 -5.07 105.19 113.81 2e7c n GLY 7 Ca -0.18 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 2e7c n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2e7c s THR 8 N -3.01 0.75 -0.26 2.61 2.01 -1.26 -5.09 115.64 111.39 2e7c s THR 8 Ca 0.02 -1.73 -0.28 0.00 0.31 0.00 0.00 61.69 60.01 2e7c s THR 8 Cb -0.01 -1.43 -0.05 0.00 0.01 0.00 0.00 72.50 71.02 2e7c s THR 8 CO 0.03 -0.71 2.22 -0.76 -0.69 0.00 0.00 174.62 174.70 2e7c s LEU 9 N -2.67 3.43 0.11 4.42 1.02 -1.26 -4.96 118.68 118.78 2e7c s LEU 9 Ca 0.07 1.76 -0.06 0.00 0.02 0.00 0.00 54.13 55.92 2e7c s LEU 9 Cb 0.01 -3.41 -0.06 0.00 0.02 0.00 0.00 46.19 42.76 2e7c s LEU 9 CO -0.03 -2.05 0.37 0.00 0.02 0.00 0.00 176.35 174.66 2e7c s ALA 10 N 8.67 3.79 -0.02 4.21 0.00 -1.26 -5.11 121.76 132.04 2e7c s ALA 10 Ca 0.99 -0.53 -0.05 0.00 0.00 0.00 0.00 51.96 52.37 2e7c s ALA 10 Cb -0.31 -2.15 0.00 0.00 0.00 0.00 0.00 23.12 20.67 2e7c s ALA 10 CO 0.34 0.65 0.11 -0.65 0.00 0.00 0.00 175.76 176.21 2e7c s GLN 11 N -2.41 0.32 1.14 0.00 -0.21 -1.26 -5.17 119.66 112.08 2e7c s GLN 11 Ca 0.38 -0.19 -0.17 0.00 0.02 0.00 0.00 55.36 55.39 2e7c s GLN 11 Cb -0.13 0.14 0.26 0.00 1.00 0.00 0.00 33.01 34.28 2e7c s GLN 11 CO 0.22 -0.07 1.10 -1.25 -2.12 0.00 0.00 175.29 173.18 2e7c s PRO 12 N -0.80 -0.72 -0.46 2.91 0.04 -1.26 -4.82 135.00 129.89 2e7c s PRO 12 Ca -0.09 0.11 -0.40 0.00 0.04 0.00 0.00 61.00 60.67 2e7c s PRO 12 Cb -0.05 -1.64 -0.16 0.00 0.04 0.00 0.00 34.50 32.69 2e7c s PRO 12 CO 0.01 -3.42 2.19 0.28 0.04 0.00 0.00 177.00 176.10 2e7c n VAL 13 N -4.58 0.08 -3.86 -0.36 0.31 -1.26 -4.87 118.33 103.78 2e7c n VAL 13 Ca 0.10 -0.12 -0.08 0.00 -0.01 0.00 0.00 64.34 64.24 2e7c n VAL 13 Cb 0.59 -1.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.49 2e7c n VAL 13 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2e7c s THR 14 N 6.74 0.00 0.36 2.52 -1.32 -1.26 -5.16 115.64 117.52 2e7c s THR 14 Ca 1.16 -1.03 -0.26 0.00 -1.21 0.00 0.00 61.69 60.35 2e7c s THR 14 Cb -1.21 -1.97 -0.09 0.00 -1.51 0.00 0.00 72.50 67.72 2e7c s THR 14 CO 0.58 -0.01 1.06 -0.63 -2.21 0.00 0.00 174.62 173.41 2e7c s ILE 15 N -3.93 3.67 0.27 5.08 1.01 -1.26 -5.06 121.20 120.98 2e7c s ILE 15 Ca 0.13 1.40 0.07 0.00 0.00 0.00 0.00 60.65 62.25 2e7c s ILE 15 Cb -0.04 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 2e7c s ILE 15 CO 0.06 0.13 0.25 -0.13 0.00 0.00 0.00 174.94 175.25 2e7c s ARG 16 N -2.15 2.97 0.50 2.79 0.52 -1.26 -5.10 118.95 117.22 2e7c s ARG 16 Ca 0.53 -1.06 -0.19 0.00 -0.52 0.00 0.00 55.73 54.49 2e7c s ARG 16 Cb -0.25 -2.61 -0.08 0.00 0.52 0.00 0.00 34.95 32.54 2e7c s ARG 16 CO 0.32 0.33 1.03 -2.00 0.02 0.00 0.00 175.30 175.00 2e7c s GLU 17 N -3.91 3.76 0.32 3.54 2.12 -1.26 -4.97 118.70 118.30 2e7c s GLU 17 Ca 0.35 1.31 -0.28 0.00 0.36 0.00 0.00 54.97 56.71 2e7c s GLU 17 Cb -0.08 -2.09 -0.13 0.00 0.26 0.00 0.00 34.13 32.10 2e7c s GLU 17 CO 0.26 -0.46 1.27 -0.89 -0.54 0.00 0.00 175.26 174.90 2e7c n ILE 18 N -1.13 1.86 0.03 -3.70 5.41 -1.26 -4.93 119.36 115.64 2e7c n ILE 18 Ca 0.09 -0.47 -0.20 0.00 1.00 0.00 0.00 62.75 63.18 2e7c n ILE 18 Cb 0.53 -1.48 -0.14 0.00 -0.71 0.00 0.00 39.64 37.83 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 2.69 -0.04 -1.78 -1.39 0.00 -1.93 -3.48 119.26 113.34 2e7c h ALA 19 Ca -0.45 -0.74 0.03 0.00 0.00 0.00 0.00 54.91 53.74 2e7c h ALA 19 Cb 1.29 0.16 -0.24 0.00 0.00 0.00 0.00 17.79 19.00 2e7c h ALA 19 CO 0.64 0.41 0.28 -2.00 0.00 0.00 0.00 179.25 178.58 2e7c s GLU 20 N -2.41 0.63 0.50 0.00 2.12 -0.89 -4.83 118.70 113.82 2e7c s GLU 20 Ca -0.15 0.82 -0.21 0.00 0.36 0.00 0.00 54.97 55.79 2e7c s GLU 20 Cb 0.01 0.27 -0.07 0.00 0.26 0.00 0.00 34.13 34.61 2e7c s GLU 20 CO 0.80 -0.09 1.14 -1.25 -0.54 0.00 0.00 175.26 175.33 2e7c s PRO 21 N 0.58 3.55 0.91 4.30 0.04 -1.26 -1.25 135.00 141.88 2e7c s PRO 21 Ca -0.01 1.69 -0.12 0.00 0.04 0.00 0.00 61.00 62.60 2e7c s PRO 21 Cb -0.05 -2.20 0.14 0.00 0.04 0.00 0.00 34.50 32.43 2e7c s PRO 21 CO -0.06 -0.70 1.09 -1.25 0.04 0.00 0.00 177.00 176.12 2e7c s PRO 22 N -3.00 1.14 -0.30 0.56 0.04 -1.26 -3.56 135.00 128.61 2e7c s PRO 22 Ca 0.68 0.78 -0.11 0.00 0.04 0.00 0.00 61.00 62.40 2e7c s PRO 22 Cb -0.26 -1.80 0.18 0.00 0.04 0.00 0.00 34.50 32.66 2e7c s PRO 22 CO 0.30 -2.31 1.01 0.21 0.04 0.00 0.00 177.00 176.25 2e7c s LYS 23 N -4.94 0.20 -0.52 4.56 2.47 -1.14 -4.86 119.74 115.52 2e7c s LYS 23 Ca 0.64 0.27 -0.28 0.00 -1.56 0.00 0.00 55.97 55.03 2e7c s LYS 23 Cb -0.18 0.14 0.02 0.00 -1.46 0.00 0.00 37.83 36.35 2e7c s LYS 23 CO 0.57 -0.29 1.25 0.42 0.16 0.00 0.00 175.35 177.46 2e7c s ILE 24 N 2.95 4.02 -1.16 5.43 1.01 -1.26 -1.62 121.20 130.56 2e7c s ILE 24 Ca 0.12 0.97 -0.11 0.00 0.00 0.00 0.00 60.65 61.63 2e7c s ILE 24 Cb -0.07 -4.56 0.23 0.00 0.01 0.00 0.00 42.46 38.08 2e7c s ILE 24 CO -0.17 -1.12 1.26 -0.13 0.00 0.00 0.00 174.94 174.78 2e7c s ARG 25 N 4.90 4.16 0.34 2.79 1.81 -0.99 -5.03 118.95 126.93 2e7c s ARG 25 Ca 0.49 -2.96 -0.26 0.00 -1.72 0.00 0.00 55.73 51.28 2e7c s ARG 25 Cb -0.09 -4.78 -0.13 0.00 -0.45 0.00 0.00 34.95 29.50 2e7c s ARG 25 CO 0.29 -1.47 0.94 1.28 -0.68 0.00 0.00 175.30 175.65 2e7c n LEU 26 N 3.97 1.67 0.00 2.53 4.77 -1.26 -4.28 117.00 124.40 2e7c n LEU 26 Ca 0.30 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.38 2e7c n LEU 26 Cb 0.41 -1.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 2e7c n LEU 26 CO 0.54 -1.66 0.00 -0.81 -1.33 0.00 0.00 177.39 174.13 2e7c n PRO 27 N 0.57 0.07 0.00 3.23 -0.04 -1.26 -5.00 135.00 132.57 2e7c n PRO 27 Ca 0.10 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.59 2e7c n PRO 27 Cb 0.34 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.83 2e7c n PRO 27 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2e7c n ARG 28 N -0.69 0.35 -0.08 0.54 1.85 -1.26 -4.38 116.66 112.99 2e7c n ARG 28 Ca 0.00 -0.81 -0.10 0.00 -1.00 0.00 0.00 57.85 55.94 2e7c n ARG 28 Cb 0.00 -1.09 -0.15 0.00 -1.05 0.00 0.00 32.46 30.16 2e7c n ARG 28 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 2e7c n HIS 29 N 0.24 0.27 0.10 2.89 1.44 -1.26 -4.36 115.22 114.53 2e7c n HIS 29 Ca 0.04 0.09 -0.14 0.00 -2.01 0.00 0.00 57.72 55.70 2e7c n HIS 29 Cb 0.16 -1.05 -0.13 0.00 0.12 0.00 0.00 29.99 29.09 2e7c n HIS 29 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2e7c h LEU 30 N 0.00 0.35 -1.23 2.39 3.38 -1.96 -3.30 115.31 114.95 2e7c h LEU 30 Ca -0.48 -0.37 0.44 0.00 0.09 0.00 0.00 57.88 57.56 2e7c h LEU 30 Cb 2.17 -0.11 -0.15 0.00 0.09 0.00 0.00 40.66 42.66 2e7c h LEU 30 CO 0.04 1.28 0.73 0.03 0.09 0.00 0.00 178.44 180.61 2e7c h ARG 31 N 0.07 0.04 -5.73 1.13 3.08 -1.76 -3.37 114.38 107.83 2e7c h ARG 31 Ca -0.11 -0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.27 2e7c h ARG 31 Cb 1.90 -0.01 -0.09 0.00 0.08 0.00 0.00 29.97 31.85 2e7c h ARG 31 CO 0.19 0.02 -0.52 1.14 -1.07 0.00 0.00 179.97 179.73 2e7c s GLN 32 N -5.39 3.32 -0.61 0.04 -2.07 -1.24 -4.98 119.66 108.72 2e7c s GLN 32 Ca -0.08 -0.21 -0.28 0.00 -1.82 0.00 0.00 55.36 52.97 2e7c s GLN 32 Cb 0.32 -3.08 -0.16 0.00 -1.09 0.00 0.00 33.01 29.00 2e7c s GLN 32 CO 0.81 0.76 1.90 2.41 -1.32 0.00 0.00 175.29 179.85 2e7c n THR 33 N 2.01 0.00 -1.58 3.63 -1.04 -1.26 -4.68 114.28 111.37 2e7c n THR 33 Ca -0.20 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.48 2e7c n THR 33 Cb 0.55 -0.39 -0.04 0.00 -1.82 0.00 0.00 70.33 68.64 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 5.98 1.10 -0.24 -1.42 5.04 -1.12 -4.87 117.35 121.82 2e7c s TYR 34 Ca 1.00 1.61 -0.21 0.00 -2.44 0.00 0.00 57.07 57.03 2e7c s TYR 34 Cb -1.05 -3.58 -0.02 0.00 0.35 0.00 0.00 41.96 37.67 2e7c s TYR 34 CO 0.43 -2.39 0.64 0.42 -1.34 0.00 0.00 175.55 173.31 2e7c s ILE 35 N 12.49 4.99 -0.03 3.14 -1.09 -1.26 -1.45 121.20 137.99 2e7c s ILE 35 Ca 0.96 1.17 -0.14 0.00 -2.23 0.00 0.00 60.65 60.41 2e7c s ILE 35 Cb -0.16 -3.95 0.02 0.00 -1.58 0.00 0.00 42.46 36.80 2e7c s ILE 35 CO 0.23 0.04 0.31 -0.60 -1.23 0.00 0.00 174.94 173.69 2e7c s ARG 36 N 2.38 0.62 0.78 2.79 6.06 -1.00 -5.04 118.95 125.54 2e7c s ARG 36 Ca 0.27 -0.11 -0.11 0.00 -2.50 0.00 0.00 55.73 53.29 2e7c s ARG 36 Cb -0.16 0.28 0.06 0.00 0.06 0.00 0.00 34.95 35.19 2e7c s ARG 36 CO 0.09 -0.16 1.09 0.15 -2.50 0.00 0.00 175.30 173.96 2e7c s LYS 37 N -1.11 2.23 0.37 5.12 1.02 -1.26 -0.21 119.74 125.90 2e7c s LYS 37 Ca -0.12 1.05 -0.26 0.00 0.02 0.00 0.00 55.97 56.66 2e7c s LYS 37 Cb -0.05 -1.90 -0.09 0.00 -0.52 0.00 0.00 37.83 35.27 2e7c s LYS 37 CO 0.04 -1.63 1.10 0.54 -0.92 0.00 0.00 175.35 174.47 2e7c s VAL 38 N -2.95 3.50 0.00 3.17 0.11 0.92 -2.98 120.40 122.17 2e7c s VAL 38 Ca 0.61 1.27 0.00 0.00 -2.93 0.00 0.00 61.98 60.93 2e7c s VAL 38 Cb -0.16 -3.72 0.00 0.00 -1.53 0.00 0.00 36.38 30.97 2e7c s VAL 38 CO 0.56 0.13 0.00 0.61 -3.33 0.00 0.00 175.10 173.07 2e7c n GLY 39 N 0.66 2.53 3.78 6.54 0.00 0.37 -4.73 105.19 114.34 2e7c n GLY 39 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 2e7c n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2e7c s GLU 40 N 0.00 3.75 0.18 1.61 0.41 -1.16 -4.12 118.70 119.37 2e7c s GLU 40 Ca 0.00 1.53 -0.31 0.00 -0.41 0.00 0.00 54.97 55.78 2e7c s GLU 40 Cb 0.00 -2.22 -0.09 0.00 -1.78 0.00 0.00 34.13 30.04 2e7c s GLU 40 CO 0.00 -0.50 1.41 -0.65 -0.49 0.00 0.00 175.26 175.03 2e7c s GLN 41 N -3.00 4.31 -0.02 1.61 -0.21 -1.26 -3.10 119.66 117.98 2e7c s GLN 41 Ca 0.66 2.17 -0.04 0.00 0.02 0.00 0.00 55.36 58.17 2e7c s GLN 41 Cb -0.22 -3.18 -0.04 0.00 1.00 0.00 0.00 33.01 30.57 2e7c s GLN 41 CO 0.26 -0.40 0.19 -0.51 -2.12 0.00 0.00 175.29 172.71 2e7c s LEU 42 N 0.35 4.37 -0.24 2.90 1.43 -1.21 -4.96 118.68 121.32 2e7c s LEU 42 Ca 0.62 0.40 -0.03 0.00 -1.03 0.00 0.00 54.13 54.09 2e7c s LEU 42 Cb -0.39 -2.54 0.11 0.00 0.03 0.00 0.00 46.19 43.40 2e7c s LEU 42 CO 0.36 0.28 0.27 0.21 0.23 0.00 0.00 176.35 177.71 2e7c s ASN 43 N -1.76 1.29 -0.28 2.29 3.84 -1.25 -3.48 114.94 115.58 2e7c s ASN 43 Ca 0.25 -0.31 0.00 0.00 0.21 0.00 0.00 52.86 53.02 2e7c s ASN 43 Cb -0.13 0.55 0.08 0.00 -0.55 0.00 0.00 41.25 41.20 2e7c s ASN 43 CO 0.16 -0.34 0.04 -0.76 -2.79 0.00 0.00 177.10 173.40 2e7c s LEU 44 N 2.37 2.74 -0.66 3.21 1.43 -0.47 -4.99 118.68 122.33 2e7c s LEU 44 Ca 0.09 -1.52 -0.18 0.00 -1.03 0.00 0.00 54.13 51.49 2e7c s LEU 44 Cb -0.15 -1.09 0.13 0.00 0.03 0.00 0.00 46.19 45.11 2e7c s LEU 44 CO -0.19 -0.34 0.73 -0.69 0.23 0.00 0.00 176.35 176.08 2e7c s VAL 45 N 1.43 4.99 -0.50 -1.59 1.01 -1.26 -1.53 120.40 122.95 2e7c s VAL 45 Ca 0.04 -1.36 -0.15 0.00 0.00 0.00 0.00 61.98 60.51 2e7c s VAL 45 Cb -0.18 -4.50 0.11 0.00 0.00 0.00 0.00 36.38 31.81 2e7c s VAL 45 CO -0.14 -1.11 0.44 -0.69 0.00 0.00 0.00 175.10 173.59 2e7c s VAL 46 N 2.13 5.11 0.44 2.92 1.01 -1.00 -4.74 120.40 126.26 2e7c s VAL 46 Ca 0.13 -1.35 -0.24 0.00 0.00 0.00 0.00 61.98 60.53 2e7c s VAL 46 Cb -0.21 -4.19 -0.08 0.00 0.00 0.00 0.00 36.38 31.91 2e7c s VAL 46 CO 0.02 -0.74 1.17 -2.16 0.00 0.00 0.00 175.10 173.39 2e7c s PRO 47 N 1.59 3.85 0.00 2.72 0.04 -1.26 -2.99 135.00 138.96 2e7c s PRO 47 Ca 0.04 1.81 -0.00 0.00 0.04 0.00 0.00 61.00 62.89 2e7c s PRO 47 Cb -0.27 -2.50 -0.00 0.00 0.04 0.00 0.00 34.50 31.77 2e7c s PRO 47 CO 0.04 -0.49 -0.00 -0.59 0.04 0.00 0.00 177.00 176.00 2e7c s PHE 48 N -1.50 0.04 0.42 0.56 -0.12 -1.25 -2.35 117.98 113.79 2e7c s PHE 48 Ca 0.61 -0.08 0.08 0.00 -0.05 0.00 0.00 56.93 57.49 2e7c s PHE 48 Cb -0.30 -0.03 0.01 0.00 -0.63 0.00 0.00 43.02 42.07 2e7c s PHE 48 CO 0.36 -0.03 0.53 -0.65 -0.05 0.00 0.00 175.22 175.39 2e7c s GLN 49 N -0.23 2.75 0.00 1.99 -0.21 -0.64 -4.67 119.66 118.64 2e7c s GLN 49 Ca -0.03 -1.32 0.00 0.00 0.02 0.00 0.00 55.36 54.03 2e7c s GLN 49 Cb -0.02 -2.67 0.00 0.00 1.00 0.00 0.00 33.01 31.32 2e7c s GLN 49 CO -0.00 -0.27 0.00 0.41 -2.12 0.00 0.00 175.29 173.30 2e7c n GLY 50 N -1.80 3.63 3.40 3.09 0.00 -1.23 -2.88 105.19 109.40 2e7c n GLY 50 Ca 0.07 -1.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.75 1.15 -0.02 1.61 1.02 -0.38 -4.61 119.74 115.76 2e7c s LYS 51 Ca 0.00 -0.38 -0.25 0.00 0.02 0.00 0.00 55.97 55.35 2e7c s LYS 51 Cb 0.00 0.52 -0.19 0.00 -0.52 0.00 0.00 37.83 37.64 2e7c s LYS 51 CO 0.00 -0.46 1.22 -1.00 -0.92 0.00 0.00 175.35 174.19 2e7c h PRO 52 N 2.39 -0.07 -2.99 -1.68 0.13 -1.91 -2.35 132.00 125.51 2e7c h PRO 52 Ca -0.32 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.23 2e7c h PRO 52 Cb 1.26 0.02 -0.40 0.00 0.13 0.00 0.00 31.00 32.00 2e7c h PRO 52 CO 0.41 0.39 -0.78 0.50 -0.23 0.00 0.00 178.00 178.29 2e7c s ARG 53 N -4.21 0.72 0.05 0.86 3.00 -1.26 -5.07 118.95 113.05 2e7c s ARG 53 Ca -0.15 -1.29 -0.31 0.00 -1.00 0.00 0.00 55.73 52.98 2e7c s ARG 53 Cb 0.02 -1.73 -0.07 0.00 0.00 0.00 0.00 34.95 33.17 2e7c s ARG 53 CO 0.64 -1.10 1.41 -1.25 0.00 0.00 0.00 175.30 174.99 2e7c s PRO 54 N 1.22 4.30 0.24 5.12 0.04 -1.26 -4.98 135.00 139.67 2e7c s PRO 54 Ca 0.14 2.03 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 2e7c s PRO 54 Cb -0.21 -3.44 -0.09 0.00 0.04 0.00 0.00 34.50 30.80 2e7c s PRO 54 CO -0.13 -0.52 1.27 -1.14 0.04 0.00 0.00 177.00 176.52 2e7c s GLN 55 N 1.85 4.43 -0.07 4.56 0.74 -1.09 -4.95 119.66 125.14 2e7c s GLN 55 Ca 0.65 2.04 0.01 0.00 0.05 0.00 0.00 55.36 58.10 2e7c s GLN 55 Cb -0.34 -3.17 -0.03 0.00 1.10 0.00 0.00 33.01 30.57 2e7c s GLN 55 CO 0.29 -0.15 -0.08 0.08 -0.55 0.00 0.00 175.29 174.87 2e7c s VAL 56 N -0.39 3.56 -0.04 1.34 1.01 -1.26 -1.35 120.40 123.26 2e7c s VAL 56 Ca 0.53 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 62.01 2e7c s VAL 56 Cb -0.36 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 33.57 2e7c s VAL 56 CO 0.42 0.59 -0.13 -0.69 0.00 0.00 0.00 175.10 175.29 2e7c s VAL 57 N -0.71 1.15 -0.10 2.92 1.01 -0.65 -4.94 120.40 119.08 2e7c s VAL 57 Ca 0.11 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2e7c s VAL 57 Cb -0.11 -1.01 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 2e7c s VAL 57 CO 0.01 0.34 -0.20 0.26 0.00 0.00 0.00 175.10 175.52 2e7c s TRP 58 N 0.24 2.63 0.02 5.22 0.52 -1.26 -1.93 118.94 124.38 2e7c s TRP 58 Ca -0.06 -0.75 0.00 0.00 0.02 0.00 0.00 56.10 55.31 2e7c s TRP 58 Cb -0.12 -1.72 -0.02 0.00 -1.15 0.00 0.00 33.47 30.46 2e7c s TRP 58 CO 0.02 -0.25 -0.03 0.95 0.02 0.00 0.00 176.95 177.66 2e7c s THR 59 N 0.12 0.13 -0.62 2.01 -4.23 -0.91 -4.41 115.64 107.74 2e7c s THR 59 Ca -0.10 -0.93 -0.02 0.00 -1.18 0.00 0.00 61.69 59.46 2e7c s THR 59 Cb -0.16 -0.30 0.16 0.00 1.34 0.00 0.00 72.50 73.54 2e7c s THR 59 CO 0.06 -0.50 0.42 -0.75 -0.54 0.00 0.00 174.62 173.31 2e7c s LYS 60 N -1.51 2.50 -0.72 3.99 2.47 0.68 -1.35 119.74 125.80 2e7c s LYS 60 Ca -0.15 -2.58 -0.04 0.00 -1.56 0.00 0.00 55.97 51.64 2e7c s LYS 60 Cb -0.10 -3.67 0.00 0.00 -1.46 0.00 0.00 37.83 32.61 2e7c s LYS 60 CO -0.01 -1.17 0.54 0.41 0.16 0.00 0.00 175.35 175.28 2e7c n GLY 61 N 3.37 0.16 1.14 5.54 0.00 -0.96 -3.84 105.19 110.61 2e7c n GLY 61 Ca 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.24 0.40 3.57 -0.02 0.00 -1.26 -5.07 105.19 101.56 2e7c n GLY 62 Ca -0.01 -0.45 -0.07 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.02 -1.97 0.74 4.61 0.00 -1.25 -5.15 121.76 115.72 2e7c s ALA 63 Ca 0.00 1.47 -0.12 0.00 0.00 0.00 0.00 51.96 53.31 2e7c s ALA 63 Cb -0.00 -0.28 0.04 0.00 0.00 0.00 0.00 23.12 22.88 2e7c s ALA 63 CO 0.04 -0.50 1.10 -1.25 0.00 0.00 0.00 175.76 175.14 2e7c s PRO 64 N -2.10 2.40 0.62 0.00 0.04 -1.26 -0.23 135.00 134.47 2e7c s PRO 64 Ca 0.05 1.23 0.05 0.00 0.04 0.00 0.00 61.00 62.37 2e7c s PRO 64 Cb -0.01 -1.91 0.09 0.00 0.04 0.00 0.00 34.50 32.72 2e7c s PRO 64 CO -0.04 -1.54 0.86 -0.51 0.04 0.00 0.00 177.00 175.80 2e7c s LEU 65 N -5.63 3.11 -0.82 -3.56 1.43 -1.26 -4.66 118.68 107.29 2e7c s LEU 65 Ca 0.63 -0.56 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2e7c s LEU 65 Cb -0.18 -1.93 0.22 0.00 0.03 0.00 0.00 46.19 44.32 2e7c s LEU 65 CO 0.52 -1.50 0.75 0.47 0.23 0.00 0.00 176.35 176.82 2e7c n ASP 66 N -2.46 3.97 -0.35 2.29 9.92 -1.26 -4.92 116.55 123.73 2e7c n ASP 66 Ca 0.14 -3.23 0.32 0.00 -0.53 0.00 0.00 54.79 51.49 2e7c n ASP 66 Cb 0.61 -0.92 0.56 0.00 -0.64 0.00 0.00 41.12 40.72 2e7c n ASP 66 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2e7c n THR 67 N 1.88 -0.28 -0.30 -3.53 -2.24 -1.26 0.61 114.28 109.16 2e7c n THR 67 Ca 0.23 1.64 0.09 0.00 -2.27 0.00 0.00 64.05 63.75 2e7c n THR 67 Cb 0.37 -2.68 0.22 0.00 -2.10 0.00 0.00 70.33 66.13 2e7c n THR 67 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2e7c h SER 68 N 0.00 -0.38 0.02 3.42 0.87 -2.05 -2.73 113.55 112.70 2e7c h SER 68 Ca 0.75 0.23 -0.39 0.00 -1.23 0.00 0.00 61.79 61.16 2e7c h SER 68 Cb 2.25 0.40 -0.06 0.00 -0.44 0.00 0.00 62.40 64.54 2e7c h SER 68 CO -0.51 -0.24 -2.42 0.54 -0.53 0.00 0.00 176.83 173.67 2e7c n ARG 69 N -5.40 0.66 -3.11 2.24 1.74 0.20 -4.93 116.66 108.07 2e7c n ARG 69 Ca 0.18 0.16 -0.39 0.00 -0.77 0.00 0.00 57.85 57.03 2e7c n ARG 69 Cb 0.60 -1.55 -0.05 0.00 -1.02 0.00 0.00 32.46 30.44 2e7c n ARG 69 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2e7c s VAL 70 N -2.53 4.95 -0.64 1.55 1.01 -0.03 -4.32 120.40 120.39 2e7c s VAL 70 Ca -0.33 1.38 0.01 0.00 0.00 0.00 0.00 61.98 63.04 2e7c s VAL 70 Cb 0.09 -4.00 0.16 0.00 0.00 0.00 0.00 36.38 32.62 2e7c s VAL 70 CO 0.62 0.34 0.43 -1.00 0.00 0.00 0.00 175.10 175.49 2e7c s HIS 71 N 0.28 3.42 -0.20 5.22 3.76 -0.92 -4.02 115.29 122.83 2e7c s HIS 71 Ca 0.35 -3.03 -0.07 0.00 -0.15 0.00 0.00 55.06 52.15 2e7c s HIS 71 Cb -0.18 -2.99 -0.04 0.00 1.11 0.00 0.00 32.58 30.48 2e7c s HIS 71 CO 0.18 -0.74 0.06 0.54 -0.85 0.00 0.00 174.74 173.93 2e7c s VAL 72 N -0.57 4.63 0.15 -0.90 0.11 -1.26 -2.74 120.40 119.81 2e7c s VAL 72 Ca 0.20 -0.08 0.03 0.00 -2.93 0.00 0.00 61.98 59.19 2e7c s VAL 72 Cb -0.18 -3.10 -0.04 0.00 -1.53 0.00 0.00 36.38 31.53 2e7c s VAL 72 CO -0.06 0.43 0.25 -0.13 -3.33 0.00 0.00 175.10 172.26 2e7c s ARG 73 N 0.72 3.34 -0.08 1.54 1.81 0.11 -4.99 118.95 121.40 2e7c s ARG 73 Ca 0.03 -0.64 -0.01 0.00 -1.72 0.00 0.00 55.73 53.40 2e7c s ARG 73 Cb -0.13 -2.91 0.03 0.00 -0.45 0.00 0.00 34.95 31.48 2e7c s ARG 73 CO 0.02 0.52 -0.03 0.99 -0.68 0.00 0.00 175.30 176.12 2e7c s THR 74 N -1.73 0.64 -0.06 0.02 2.01 -1.26 -0.73 115.64 114.53 2e7c s THR 74 Ca 0.34 -0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.34 2e7c s THR 74 Cb -0.11 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 2e7c s THR 74 CO 0.28 0.30 -0.25 -0.55 -0.69 0.00 0.00 174.62 173.70 2e7c s SER 75 N 1.73 3.05 0.34 3.53 0.15 -0.42 -4.99 113.70 117.11 2e7c s SER 75 Ca 0.03 -0.51 0.19 0.00 0.70 0.00 0.00 55.95 56.36 2e7c s SER 75 Cb -0.13 -0.86 1.25 0.00 -1.71 0.00 0.00 66.02 64.57 2e7c s SER 75 CO -0.05 0.24 1.47 0.47 1.20 0.00 0.00 173.24 176.57 2e7c n ASP 76 N 2.97 0.32 0.21 5.45 9.92 -1.26 -0.47 116.55 133.68 2e7c n ASP 76 Ca -0.17 1.55 -0.10 0.00 -0.53 0.00 0.00 54.79 55.53 2e7c n ASP 76 Cb 0.52 -0.75 -0.05 0.00 -0.64 0.00 0.00 41.12 40.20 2e7c n ASP 76 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 2e7c h PHE 77 N 0.00 -0.55 -3.57 1.24 0.04 -1.95 -3.47 116.94 108.69 2e7c h PHE 77 Ca 0.79 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 61.48 2e7c h PHE 77 Cb 2.08 0.18 -0.13 0.00 2.20 0.00 0.00 35.95 40.28 2e7c h PHE 77 CO -0.02 -0.31 -0.17 0.16 -0.60 0.00 0.00 178.31 177.37 2e7c s ASP 78 N -4.89 -0.10 0.13 2.17 -4.77 0.38 -3.93 116.67 105.66 2e7c s ASP 78 Ca -0.10 -0.53 0.02 0.00 -3.30 0.00 0.00 52.55 48.65 2e7c s ASP 78 Cb 0.01 0.45 -0.04 0.00 -1.09 0.00 0.00 42.92 42.26 2e7c s ASP 78 CO 0.30 -0.87 0.27 0.28 0.70 0.00 0.00 175.17 175.85 2e7c s THR 79 N -3.86 5.33 -0.03 2.11 -1.32 -1.16 -1.30 115.64 115.42 2e7c s THR 79 Ca 0.07 -0.63 0.02 0.00 -1.21 0.00 0.00 61.69 59.94 2e7c s THR 79 Cb 0.02 -3.72 0.01 0.00 -1.51 0.00 0.00 72.50 67.30 2e7c s THR 79 CO -0.08 -0.05 -0.08 -0.69 -2.21 0.00 0.00 174.62 171.51 2e7c s VAL 80 N -1.71 0.70 -0.12 5.08 1.01 0.09 -2.39 120.40 123.07 2e7c s VAL 80 Ca 0.35 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.05 2e7c s VAL 80 Cb -0.11 -0.64 -0.01 0.00 0.00 0.00 0.00 36.38 35.62 2e7c s VAL 80 CO 0.28 0.23 -0.18 0.12 0.00 0.00 0.00 175.10 175.56 2e7c s PHE 81 N 0.35 2.70 0.03 5.22 2.19 -0.58 0.04 117.98 127.94 2e7c s PHE 81 Ca -0.05 -0.87 -0.05 0.00 0.33 0.00 0.00 56.93 56.29 2e7c s PHE 81 Cb -0.10 -1.79 -0.01 0.00 -1.31 0.00 0.00 43.02 39.81 2e7c s PHE 81 CO 0.00 -0.34 0.08 0.12 1.83 0.00 0.00 175.22 176.92 2e7c s PHE 82 N 0.42 0.21 -0.03 10.12 2.19 -1.11 -1.36 117.98 128.42 2e7c s PHE 82 Ca -0.13 -0.51 -0.02 0.00 0.33 0.00 0.00 56.93 56.60 2e7c s PHE 82 Cb -0.17 -0.15 0.02 0.00 -1.31 0.00 0.00 43.02 41.41 2e7c s PHE 82 CO 0.06 -0.34 0.07 0.08 1.83 0.00 0.00 175.22 176.92 2e7c s VAL 83 N -2.46 -0.03 0.21 3.12 1.01 -1.23 -2.16 120.40 118.87 2e7c s VAL 83 Ca -0.06 0.10 -0.09 0.00 0.00 0.00 0.00 61.98 61.93 2e7c s VAL 83 Cb -0.02 -0.12 0.15 0.00 0.00 0.00 0.00 36.38 36.39 2e7c s VAL 83 CO -0.04 0.04 1.82 -0.09 0.00 0.00 0.00 175.10 176.83 2e7c h ARG 84 N 6.67 0.72 -2.87 2.72 2.43 -1.92 -3.21 114.38 118.92 2e7c h ARG 84 Ca -0.35 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 58.58 2e7c h ARG 84 Cb 1.17 -0.16 -0.31 0.00 -0.42 0.00 0.00 29.97 30.24 2e7c h ARG 84 CO 0.46 0.48 -0.49 1.14 -1.51 0.00 0.00 179.97 180.05 2e7c s GLN 85 N -6.09 0.19 -0.89 0.20 -2.07 -1.26 -4.52 119.66 105.22 2e7c s GLN 85 Ca -0.13 0.71 -0.16 0.00 -1.82 0.00 0.00 55.36 53.96 2e7c s GLN 85 Cb 0.16 -0.03 0.17 0.00 -1.09 0.00 0.00 33.01 32.22 2e7c s GLN 85 CO 0.76 -0.24 0.96 0.00 -1.32 0.00 0.00 175.29 175.46 2e7c s ALA 86 N 2.04 3.73 0.48 2.60 0.00 -1.18 -4.75 121.76 124.68 2e7c s ALA 86 Ca -0.03 -3.05 -0.18 0.00 0.00 0.00 0.00 51.96 48.71 2e7c s ALA 86 Cb -0.11 -3.80 -0.09 0.00 0.00 0.00 0.00 23.12 19.12 2e7c s ALA 86 CO -0.09 -2.64 0.96 0.00 0.00 0.00 0.00 175.76 173.99 2e7c s ALA 87 N 1.44 3.07 0.45 0.00 0.00 -1.26 -0.47 121.76 124.98 2e7c s ALA 87 Ca 0.26 0.23 0.38 0.00 0.00 0.00 0.00 51.96 52.83 2e7c s ALA 87 Cb -0.07 -3.11 1.42 0.00 0.00 0.00 0.00 23.12 21.37 2e7c s ALA 87 CO -0.09 -0.11 1.34 0.54 0.00 0.00 0.00 175.76 177.44 2e7c n ARG 88 N -1.27 -0.01 0.03 0.00 1.74 -1.26 0.14 116.66 116.02 2e7c n ARG 88 Ca 0.06 0.98 -0.13 0.00 -0.77 0.00 0.00 57.85 58.00 2e7c n ARG 88 Cb 0.54 -2.14 -0.09 0.00 -1.02 0.00 0.00 32.46 29.75 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 -0.10 -1.30 0.55 0.87 -1.96 -3.12 113.55 108.49 2e7c h SER 89 Ca 0.79 -0.41 0.41 0.00 -1.23 0.00 0.00 61.79 61.36 2e7c h SER 89 Cb 2.99 0.03 -0.12 0.00 -0.44 0.00 0.00 62.40 64.86 2e7c h SER 89 CO -0.14 0.38 0.85 0.44 -0.53 0.00 0.00 176.83 177.83 2e7c h ASP 90 N -0.62 0.25 -3.66 6.23 3.32 0.82 -3.40 116.42 119.37 2e7c h ASP 90 Ca -0.01 0.12 -0.55 0.00 0.02 0.00 0.00 57.03 56.60 2e7c h ASP 90 Cb 0.50 0.10 0.11 0.00 0.22 0.00 0.00 39.33 40.27 2e7c h ASP 90 CO 0.02 -0.14 0.63 -0.24 -1.72 0.00 0.00 179.24 177.79 2e7c n SER 91 N -4.64 3.19 0.00 6.45 2.88 -1.15 -4.84 113.62 115.50 2e7c n SER 91 Ca 0.36 1.19 0.00 0.00 -1.33 0.00 0.00 58.87 59.09 2e7c n SER 91 Cb 1.37 -1.55 0.00 0.00 -0.75 0.00 0.00 64.21 63.28 2e7c n SER 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2e7c n GLY 92 N 0.63 -0.69 2.86 0.46 0.00 0.29 -4.96 105.19 103.78 2e7c n GLY 92 Ca 0.04 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.27 1.24 0.10 1.61 2.12 -1.26 -0.31 118.70 120.94 2e7c s GLU 93 Ca 0.00 -0.16 -0.02 0.00 0.36 0.00 0.00 54.97 55.14 2e7c s GLU 93 Cb 0.00 -1.44 -0.05 0.00 0.26 0.00 0.00 34.13 32.90 2e7c s GLU 93 CO 0.00 -0.29 0.29 0.71 -0.54 0.00 0.00 175.26 175.43 2e7c s TYR 94 N 1.78 3.50 -0.13 5.30 1.51 0.91 -2.26 117.35 127.97 2e7c s TYR 94 Ca 0.05 0.39 -0.01 0.00 -1.01 0.00 0.00 57.07 56.48 2e7c s TYR 94 Cb -0.13 -1.87 0.04 0.00 -0.11 0.00 0.00 41.96 39.89 2e7c s TYR 94 CO -0.07 0.51 -0.01 -2.00 -1.11 0.00 0.00 175.55 172.87 2e7c s GLU 95 N -2.62 0.89 -0.30 -0.62 2.12 -0.46 0.11 118.70 117.81 2e7c s GLU 95 Ca 0.38 -0.19 -0.08 0.00 0.36 0.00 0.00 54.97 55.44 2e7c s GLU 95 Cb -0.12 -1.54 0.00 0.00 0.26 0.00 0.00 34.13 32.73 2e7c s GLU 95 CO 0.27 -0.41 0.11 -1.17 -0.54 0.00 0.00 175.26 173.52 2e7c s LEU 96 N 1.85 3.95 -0.13 2.70 0.20 -0.79 -2.13 118.68 124.33 2e7c s LEU 96 Ca 0.03 -0.62 0.03 0.00 0.69 0.00 0.00 54.13 54.25 2e7c s LEU 96 Cb -0.14 -1.93 0.01 0.00 -0.43 0.00 0.00 46.19 43.69 2e7c s LEU 96 CO -0.07 -0.19 -0.21 -0.44 -0.29 0.00 0.00 176.35 175.15 2e7c s SER 97 N 1.55 3.01 -0.39 3.68 0.01 -0.81 -1.14 113.70 119.61 2e7c s SER 97 Ca 0.04 -0.57 -0.20 0.00 1.31 0.00 0.00 55.95 56.53 2e7c s SER 97 Cb -0.17 -1.39 0.01 0.00 0.21 0.00 0.00 66.02 64.68 2e7c s SER 97 CO 0.04 0.08 0.58 -0.69 0.41 0.00 0.00 173.24 173.67 2e7c s VAL 98 N 0.76 4.92 -0.15 3.43 1.01 -0.02 -1.64 120.40 128.70 2e7c s VAL 98 Ca -0.09 0.23 -0.15 0.00 0.00 0.00 0.00 61.98 61.97 2e7c s VAL 98 Cb -0.16 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 2e7c s VAL 98 CO -0.00 -0.41 0.33 -1.58 0.00 0.00 0.00 175.10 173.44 2e7c s GLN 99 N 2.61 4.28 0.13 2.72 0.74 -0.46 -0.21 119.66 129.46 2e7c s GLN 99 Ca 0.21 0.17 0.03 0.00 0.05 0.00 0.00 55.36 55.81 2e7c s GLN 99 Cb -0.15 -3.43 -0.04 0.00 1.10 0.00 0.00 33.01 30.49 2e7c s GLN 99 CO 0.16 0.21 -0.07 0.42 -0.55 0.00 0.00 175.29 175.46 2e7c s ILE 100 N 0.52 0.90 0.01 -2.34 1.01 0.14 -2.65 121.20 118.78 2e7c s ILE 100 Ca 0.18 -1.99 -0.02 0.00 0.00 0.00 0.00 60.65 58.82 2e7c s ILE 100 Cb -0.13 -1.79 -0.00 0.00 0.01 0.00 0.00 42.46 40.54 2e7c s ILE 100 CO 0.05 -0.78 0.34 -0.62 0.00 0.00 0.00 174.94 173.92 2e7c n GLU 101 N -0.13 -0.02 -0.00 2.79 1.02 -1.26 -2.96 120.64 120.08 2e7c n GLU 101 Ca -0.11 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 2e7c n GLU 101 Cb 0.61 -0.50 -0.01 0.00 -0.02 0.00 0.00 31.44 31.52 2e7c n GLU 101 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2e7c n ASN 102 N -2.66 3.77 -4.91 1.62 4.13 -1.26 -5.04 115.26 110.91 2e7c n ASN 102 Ca 0.00 -0.11 -0.27 0.00 1.68 0.00 0.00 54.58 55.88 2e7c n ASN 102 Cb 0.01 1.04 -0.02 0.00 -1.54 0.00 0.00 39.78 39.27 2e7c n ASN 102 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 2e7c s MET 103 N -1.86 3.59 0.12 3.52 -1.94 -1.15 -5.11 119.30 116.46 2e7c s MET 103 Ca -0.00 -0.04 -0.18 0.00 -1.71 0.00 0.00 55.69 53.76 2e7c s MET 103 Cb 0.01 -2.60 0.04 0.00 2.01 0.00 0.00 34.83 34.29 2e7c s MET 103 CO 0.04 0.13 0.44 0.21 -0.01 0.00 0.00 175.02 175.83 2e7c s LYS 104 N -3.93 1.09 0.08 2.03 2.36 -1.26 0.25 119.74 120.37 2e7c s LYS 104 Ca 0.44 -0.60 -0.12 0.00 -2.55 0.00 0.00 55.97 53.14 2e7c s LYS 104 Cb -0.10 0.48 0.01 0.00 -1.05 0.00 0.00 37.83 37.18 2e7c s LYS 104 CO 0.34 -0.43 0.28 0.34 1.55 0.00 0.00 175.35 177.43 2e7c s ASP 105 N -2.66 -0.05 0.06 1.43 -1.08 0.71 -4.88 116.67 110.20 2e7c s ASP 105 Ca 0.01 -0.42 -0.05 0.00 -0.52 0.00 0.00 52.55 51.57 2e7c s ASP 105 Cb 0.01 0.38 -0.02 0.00 -1.46 0.00 0.00 42.92 41.83 2e7c s ASP 105 CO -0.10 -0.73 0.10 0.42 0.52 0.00 0.00 175.17 175.38 2e7c s THR 106 N -3.43 0.16 0.08 1.71 -4.23 -1.26 -0.84 115.64 107.83 2e7c s THR 106 Ca 0.01 -1.36 -0.26 0.00 -1.18 0.00 0.00 61.69 58.90 2e7c s THR 106 Cb 0.02 -1.28 0.08 0.00 1.34 0.00 0.00 72.50 72.66 2e7c s THR 106 CO -0.09 -0.75 0.78 0.00 -0.54 0.00 0.00 174.62 174.02 2e7c s ALA 107 N -3.56 -1.70 0.09 3.99 0.00 -0.29 -4.89 121.76 115.40 2e7c s ALA 107 Ca 0.03 0.70 0.05 0.00 0.00 0.00 0.00 51.96 52.74 2e7c s ALA 107 Cb 0.04 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 2e7c s ALA 107 CO -0.09 -0.76 -0.14 0.99 0.00 0.00 0.00 175.76 175.76 2e7c s THR 108 N -3.40 1.17 -0.03 0.00 2.01 -1.26 -1.88 115.64 112.25 2e7c s THR 108 Ca 0.04 -1.45 -0.02 0.00 0.31 0.00 0.00 61.69 60.57 2e7c s THR 108 Cb -0.01 -1.23 0.02 0.00 0.01 0.00 0.00 72.50 71.28 2e7c s THR 108 CO -0.09 -0.30 0.07 -0.63 -0.69 0.00 0.00 174.62 172.98 2e7c s ILE 109 N -1.60 -0.02 -0.21 1.82 1.01 0.30 -4.95 121.20 117.54 2e7c s ILE 109 Ca 0.02 0.07 -0.07 0.00 0.00 0.00 0.00 60.65 60.66 2e7c s ILE 109 Cb -0.08 -0.11 -0.04 0.00 0.01 0.00 0.00 42.46 42.24 2e7c s ILE 109 CO 0.02 0.03 0.07 -0.13 0.00 0.00 0.00 174.94 174.93 2e7c s ARG 110 N 0.41 3.84 -0.09 2.79 0.52 -1.26 -0.06 118.95 125.10 2e7c s ARG 110 Ca -0.03 -0.40 0.02 0.00 -0.52 0.00 0.00 55.73 54.80 2e7c s ARG 110 Cb -0.05 -3.28 0.01 0.00 0.52 0.00 0.00 34.95 32.16 2e7c s ARG 110 CO -0.01 0.07 -0.13 0.42 0.02 0.00 0.00 175.30 175.66 2e7c s ILE 111 N 0.94 1.31 -0.09 1.52 1.01 0.58 -2.79 121.20 123.67 2e7c s ILE 111 Ca 0.04 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.17 2e7c s ILE 111 Cb -0.14 -1.21 0.00 0.00 0.01 0.00 0.00 42.46 41.13 2e7c s ILE 111 CO 0.03 0.40 -0.20 -0.60 0.00 0.00 0.00 174.94 174.57 2e7c s ARG 112 N 0.91 2.62 -0.23 2.79 3.52 -0.53 -0.55 118.95 127.48 2e7c s ARG 112 Ca -0.09 -0.73 -0.06 0.00 -0.13 0.00 0.00 55.73 54.72 2e7c s ARG 112 Cb -0.15 -2.03 -0.02 0.00 -1.56 0.00 0.00 34.95 31.19 2e7c s ARG 112 CO 0.00 0.12 0.03 0.08 -0.81 0.00 0.00 175.30 174.72 2e7c s VAL 113 N 0.49 4.02 -0.02 7.11 1.01 -1.26 -2.37 120.40 129.37 2e7c s VAL 113 Ca -0.17 -0.27 -0.05 0.00 0.00 0.00 0.00 61.98 61.49 2e7c s VAL 113 Cb -0.17 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 2e7c s VAL 113 CO 0.06 0.37 0.21 0.68 0.00 0.00 0.00 175.10 176.43 2e7c s VAL 114 N 1.49 5.39 0.04 2.92 -7.23 0.71 -4.80 120.40 118.92 2e7c s VAL 114 Ca 0.06 0.06 -0.30 0.00 -1.81 0.00 0.00 61.98 59.98 2e7c s VAL 114 Cb -0.15 -3.53 -0.07 0.00 0.56 0.00 0.00 36.38 33.19 2e7c s VAL 114 CO 0.01 0.40 1.54 -1.61 -0.31 0.00 0.00 175.10 175.14 2e7c s GLU 115 N -1.69 4.23 -0.69 4.82 2.02 -1.26 -0.06 118.70 126.08 2e7c s GLU 115 Ca 0.25 2.17 -0.34 0.00 0.02 0.00 0.00 54.97 57.08 2e7c s GLU 115 Cb -0.13 -3.58 -0.19 0.00 0.10 0.00 0.00 34.13 30.34 2e7c s GLU 115 CO 0.15 -0.66 2.20 0.36 0.02 0.00 0.00 175.26 177.33 2e7c n LYS 116 N 5.48 0.00 -1.26 1.61 2.85 -1.26 -4.61 118.16 120.96 2e7c n LYS 116 Ca 0.15 0.00 -0.49 0.00 -1.05 0.00 0.00 58.31 56.92 2e7c n LYS 116 Cb 0.42 -1.36 -0.07 0.00 -0.65 0.00 0.00 35.03 33.37 2e7c n LYS 116 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2e7c n ALA 117 N 8.22 -1.04 0.00 0.58 0.00 -1.26 -5.07 120.51 121.94 2e7c n ALA 117 Ca 0.55 0.36 0.00 0.00 0.00 0.00 0.00 53.44 54.35 2e7c n ALA 117 Cb -0.00 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.06 2e7c n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91