#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b6f s ALA 18 N 0.00 -1.88 0.84 4.61 0.00 -1.26 -5.17 121.76 118.91 2b6f s ALA 18 Ca 0.00 1.38 -0.11 0.00 0.00 0.00 0.00 51.96 53.23 2b6f s ALA 18 Cb 0.00 -0.29 0.10 0.00 0.00 0.00 0.00 23.12 22.93 2b6f s ALA 18 CO 0.00 -0.43 1.10 -1.25 0.00 0.00 0.00 175.76 175.18 2b6f s PRO 19 N -1.70 1.72 0.32 0.00 0.04 -1.26 -4.98 135.00 129.15 2b6f s PRO 19 Ca -0.01 0.71 -0.29 0.00 0.04 0.00 0.00 61.00 61.45 2b6f s PRO 19 Cb -0.01 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.56 2b6f s PRO 19 CO -0.00 -1.89 1.37 -1.83 0.04 0.00 0.00 177.00 174.69 2b6f s GLU 20 N -5.06 4.29 0.00 4.56 -1.05 -1.26 -4.52 118.70 115.65 2b6f s GLU 20 Ca 0.62 2.30 0.00 0.00 -0.15 0.00 0.00 54.97 57.74 2b6f s GLU 20 Cb -0.16 -3.06 0.00 0.00 -0.44 0.00 0.00 34.13 30.47 2b6f s GLU 20 CO 0.55 -0.31 0.00 0.41 0.95 0.00 0.00 175.26 176.86 2b6f n GLY 21 N 1.10 -0.50 3.38 -3.83 0.00 -1.26 -5.14 105.19 98.94 2b6f n GLY 21 Ca 0.02 0.34 -0.38 0.00 0.00 0.00 0.00 46.02 45.99 2b6f n GLY 21 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2b6f n PRO 22 N 0.00 0.31 -2.80 1.61 -0.02 -1.26 -3.65 135.00 129.19 2b6f n PRO 22 Ca 0.00 0.12 -0.11 0.00 -2.02 0.00 0.00 63.50 61.50 2b6f n PRO 22 Cb 0.00 -1.45 0.05 0.00 -0.02 0.00 0.00 33.50 32.08 2b6f n PRO 22 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b6f n GLY 23 N 2.06 -0.65 3.82 -1.23 0.00 -1.26 -5.00 105.19 102.91 2b6f n GLY 23 Ca 0.10 0.37 -0.30 0.00 0.00 0.00 0.00 46.02 46.19 2b6f n GLY 23 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b6f s PRO 24 N -4.00 2.34 0.00 1.61 0.04 -1.24 -5.06 135.00 128.69 2b6f s PRO 24 Ca 0.33 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.04 2b6f s PRO 24 Cb -0.04 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2b6f s PRO 24 CO 0.55 -1.45 0.00 -1.13 0.04 0.00 0.00 177.00 175.01 2b6f n SER 25 N -3.32 0.00 -3.15 6.66 3.41 -1.26 -5.14 113.62 110.81 2b6f n SER 25 Ca 0.07 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.72 2b6f n SER 25 Cb 0.56 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.51 2b6f n SER 25 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2b6f s GLY 26 N -0.11 -1.24 0.00 5.00 0.00 -1.26 -5.15 107.32 104.57 2b6f s GLY 26 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 44.72 45.88 2b6f s GLY 26 CO 0.00 3.71 0.00 0.61 0.00 0.00 0.00 173.10 177.42 2b6f n GLY 27 N 5.40 2.51 0.07 0.20 0.00 -1.26 -4.91 105.19 107.20 2b6f n GLY 27 Ca 0.05 -0.98 0.04 0.00 0.00 0.00 0.00 46.02 45.13 2b6f n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b6f n ALA 28 N -0.96 0.85 -0.66 4.61 0.00 -1.26 -4.65 120.51 118.44 2b6f n ALA 28 Ca 0.00 0.08 -0.31 0.00 0.00 0.00 0.00 53.44 53.21 2b6f n ALA 28 Cb 0.00 -0.96 0.18 0.00 0.00 0.00 0.00 19.45 18.67 2b6f n ALA 28 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2b6f s GLN 29 N -3.12 0.78 0.03 0.00 0.74 -1.26 -4.79 119.66 112.04 2b6f s GLN 29 Ca -0.01 1.49 0.00 0.00 0.05 0.00 0.00 55.36 56.89 2b6f s GLN 29 Cb 0.02 -1.70 0.00 0.00 1.10 0.00 0.00 33.01 32.43 2b6f s GLN 29 CO 0.07 -2.78 0.00 0.41 -0.55 0.00 0.00 175.29 172.45 2b6f n GLY 30 N 0.31 -2.70 0.00 2.59 0.00 -1.26 -4.99 105.19 99.14 2b6f n GLY 30 Ca 0.11 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.74 2b6f n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b6f n GLY 31 N -1.95 -0.55 3.38 -0.02 0.00 -1.26 -5.13 105.19 99.65 2b6f n GLY 31 Ca -0.00 0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 2b6f n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b6f s SER 32 N -4.00 -0.74 0.00 1.61 1.04 -1.26 -4.98 113.70 105.37 2b6f s SER 32 Ca 0.00 0.67 0.00 0.00 0.48 0.00 0.00 55.95 57.10 2b6f s SER 32 Cb 0.00 -0.90 0.00 0.00 0.10 0.00 0.00 66.02 65.22 2b6f s SER 32 CO 0.00 -5.15 0.00 0.00 0.98 0.00 0.00 173.24 169.07 2b6f n ILE 33 N -5.46 0.00 0.00 -1.02 3.06 -1.26 -5.02 119.36 109.66 2b6f n ILE 33 Ca 0.15 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.40 2b6f n ILE 33 Cb 0.61 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.79 2b6f n ILE 33 CO 0.00 0.00 0.00 1.57 -2.50 0.00 0.00 176.55 175.62 2b6f n HIS 34 N -1.52 0.00 -3.49 9.51 -0.00 -1.26 -5.03 115.22 113.44 2b6f n HIS 34 Ca 0.00 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.05 2b6f n HIS 34 Cb 0.00 -0.16 -0.04 0.00 -0.12 0.00 0.00 29.99 29.67 2b6f n HIS 34 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2b6f s SER 35 N -1.77 -0.53 0.00 0.26 0.15 -1.26 -5.18 113.70 105.37 2b6f s SER 35 Ca 0.00 0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.93 2b6f s SER 35 Cb 0.00 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 2b6f s SER 35 CO 0.00 -0.70 0.00 0.61 1.20 0.00 0.00 173.24 174.35 2b6f n GLY 36 N 0.21 2.55 3.59 9.45 0.00 -1.26 -5.09 105.19 114.63 2b6f n GLY 36 Ca -0.15 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 2b6f n GLY 36 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2b6f s ARG 37 N 1.47 3.63 -0.31 1.61 3.52 -1.26 -4.95 118.95 122.66 2b6f s ARG 37 Ca 0.00 0.51 -0.01 0.00 -0.13 0.00 0.00 55.73 56.10 2b6f s ARG 37 Cb 0.00 -3.96 0.13 0.00 -1.56 0.00 0.00 34.95 29.55 2b6f s ARG 37 CO 0.00 -1.52 0.23 0.42 -0.81 0.00 0.00 175.30 173.63 2b6f s ILE 38 N 4.79 -0.21 -0.93 4.11 1.01 -1.26 -5.08 121.20 123.63 2b6f s ILE 38 Ca 0.48 -0.78 -0.20 0.00 0.00 0.00 0.00 60.65 60.15 2b6f s ILE 38 Cb -0.08 -0.97 0.11 0.00 0.01 0.00 0.00 42.46 41.54 2b6f s ILE 38 CO 0.30 -0.64 1.18 0.00 0.00 0.00 0.00 174.94 175.78 2b6f s ALA 39 N 2.02 3.23 0.15 9.38 0.00 -1.26 -4.94 121.76 130.34 2b6f s ALA 39 Ca 0.11 -2.61 0.01 0.00 0.00 0.00 0.00 51.96 49.47 2b6f s ALA 39 Cb -0.16 -4.13 -0.00 0.00 0.00 0.00 0.00 23.12 18.83 2b6f s ALA 39 CO -0.27 -3.09 0.18 0.00 0.00 0.00 0.00 175.76 172.58 2b6f n ALA 40 N 7.06 0.06 -1.77 0.00 0.00 -1.26 -4.96 120.51 119.63 2b6f n ALA 40 Ca 0.24 -0.80 -0.38 0.00 0.00 0.00 0.00 53.44 52.50 2b6f n ALA 40 Cb 0.49 0.64 -0.04 0.00 0.00 0.00 0.00 19.45 20.54 2b6f n ALA 40 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2b6f s VAL 41 N -2.61 3.62 -0.08 0.00 1.01 -1.26 -3.01 120.40 118.08 2b6f s VAL 41 Ca 0.15 1.40 -0.16 0.00 0.00 0.00 0.00 61.98 63.37 2b6f s VAL 41 Cb 0.00 -3.80 0.03 0.00 0.00 0.00 0.00 36.38 32.61 2b6f s VAL 41 CO 0.11 0.16 0.39 -1.00 0.00 0.00 0.00 175.10 174.76 2b6f s HIS 42 N -1.44 -0.34 -0.83 5.22 4.02 -1.05 -4.97 115.29 115.90 2b6f s HIS 42 Ca 0.52 0.70 -0.23 0.00 1.02 0.00 0.00 55.06 57.06 2b6f s HIS 42 Cb -0.26 0.15 0.06 0.00 -1.02 0.00 0.00 32.58 31.51 2b6f s HIS 42 CO 0.33 -0.34 1.23 -0.80 1.02 0.00 0.00 174.74 176.19 2b6f s ASN 43 N -0.67 6.34 -0.17 1.40 0.01 -1.26 -1.93 114.94 118.66 2b6f s ASN 43 Ca -0.08 -1.13 -0.21 0.00 -0.71 0.00 0.00 52.86 50.74 2b6f s ASN 43 Cb -0.04 -2.50 -0.03 0.00 0.41 0.00 0.00 41.25 39.09 2b6f s ASN 43 CO 0.03 -1.52 0.63 0.54 -1.51 0.00 0.00 177.10 175.27 2b6f s VAL 44 N 4.63 5.04 0.34 1.60 0.11 -0.98 -4.75 120.40 126.39 2b6f s VAL 44 Ca 0.35 1.21 -0.26 0.00 -2.93 0.00 0.00 61.98 60.35 2b6f s VAL 44 Cb -0.07 -3.95 -0.13 0.00 -1.53 0.00 0.00 36.38 30.69 2b6f s VAL 44 CO 0.03 0.15 0.79 -2.65 -3.33 0.00 0.00 175.10 170.09 2b6f n PRO 45 N 4.75 0.92 0.09 1.54 -0.02 -1.26 -2.73 135.00 138.29 2b6f n PRO 45 Ca -0.02 0.33 -0.02 0.00 -2.02 0.00 0.00 63.50 61.77 2b6f n PRO 45 Cb 0.50 -1.65 0.23 0.00 -0.02 0.00 0.00 33.50 32.55 2b6f n PRO 45 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2b6f h LEU 46 N 1.39 0.26 -1.61 2.45 3.38 -1.86 -2.89 115.31 116.42 2b6f h LEU 46 Ca -0.39 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2b6f h LEU 46 Cb 1.37 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2b6f h LEU 46 CO 0.56 0.64 0.00 0.77 0.09 0.00 0.00 178.44 180.50 2b6f h SER 47 N 0.21 0.00 -0.38 -0.43 4.64 -1.89 -2.83 113.55 112.87 2b6f h SER 47 Ca 0.02 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.19 2b6f h SER 47 Cb 0.80 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.81 2b6f h SER 47 CO 0.06 0.00 0.01 1.33 -0.87 0.00 0.00 176.83 177.36 2b6f n VAL 48 N -2.72 2.52 -3.46 0.95 0.24 -1.09 -4.97 118.33 109.80 2b6f n VAL 48 Ca -0.00 -2.37 -0.37 0.00 -2.04 0.00 0.00 64.34 59.55 2b6f n VAL 48 Cb 0.18 -0.31 -0.07 0.00 -1.47 0.00 0.00 33.84 32.17 2b6f n VAL 48 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2b6f s LEU 49 N -3.11 4.20 -0.27 1.34 1.43 -1.07 -4.43 118.68 116.78 2b6f s LEU 49 Ca 0.45 0.51 -0.15 0.00 -1.03 0.00 0.00 54.13 53.91 2b6f s LEU 49 Cb 0.39 -2.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 2b6f s LEU 49 CO 0.04 0.02 0.37 -0.63 0.23 0.00 0.00 176.35 176.38 2b6f s ILE 50 N 0.86 5.17 -0.35 -0.59 1.01 -0.84 -5.03 121.20 121.44 2b6f s ILE 50 Ca 0.18 0.54 -0.00 0.00 0.00 0.00 0.00 60.65 61.36 2b6f s ILE 50 Cb -0.14 -3.70 0.12 0.00 0.01 0.00 0.00 42.46 38.74 2b6f s ILE 50 CO 0.06 0.14 0.16 -0.13 0.00 0.00 0.00 174.94 175.18 2b6f s ARG 51 N 2.07 0.72 -0.35 2.79 0.52 -1.26 -3.06 118.95 120.37 2b6f s ARG 51 Ca 0.15 -1.26 0.05 0.00 -0.52 0.00 0.00 55.73 54.15 2b6f s ARG 51 Cb -0.16 -1.77 0.60 0.00 0.52 0.00 0.00 34.95 34.14 2b6f s ARG 51 CO 0.10 -1.09 1.75 -0.35 0.02 0.00 0.00 175.30 175.74 2b6f n PRO 52 N 4.42 2.51 -3.49 3.54 -0.04 -1.26 -4.77 135.00 135.91 2b6f n PRO 52 Ca 0.03 -2.62 -0.26 0.00 -0.04 0.00 0.00 63.50 60.61 2b6f n PRO 52 Cb 0.39 -2.04 -0.13 0.00 -0.04 0.00 0.00 33.50 31.67 2b6f n PRO 52 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2b6f s LEU 53 N -2.75 0.44 0.78 1.53 0.20 -1.26 -5.15 118.68 112.47 2b6f s LEU 53 Ca 0.49 -1.36 -0.11 0.00 0.69 0.00 0.00 54.13 53.84 2b6f s LEU 53 Cb 0.40 -0.16 0.06 0.00 -0.43 0.00 0.00 46.19 46.06 2b6f s LEU 53 CO 0.10 -0.40 1.09 -2.16 -0.29 0.00 0.00 176.35 174.69 2b6f s PRO 54 N 1.94 2.26 0.21 0.98 0.04 -1.26 -5.07 135.00 134.10 2b6f s PRO 54 Ca 0.11 0.75 -0.13 0.00 0.04 0.00 0.00 61.00 61.77 2b6f s PRO 54 Cb -0.17 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.44 2b6f s PRO 54 CO -0.28 -1.53 0.43 -1.12 0.04 0.00 0.00 177.00 174.54 2b6f s SER 55 N -3.83 -0.09 -0.44 6.66 0.01 -1.26 -5.11 113.70 109.63 2b6f s SER 55 Ca 0.60 -0.82 -0.22 0.00 1.31 0.00 0.00 55.95 56.82 2b6f s SER 55 Cb -0.15 0.54 0.02 0.00 0.21 0.00 0.00 66.02 66.65 2b6f s SER 55 CO 0.55 -1.05 0.74 0.54 0.41 0.00 0.00 173.24 174.43 2b6f s VAL 56 N -3.97 4.70 0.23 3.43 0.11 -1.26 -5.03 120.40 118.61 2b6f s VAL 56 Ca 0.18 0.35 -0.16 0.00 -2.93 0.00 0.00 61.98 59.42 2b6f s VAL 56 Cb 0.00 -4.28 -0.08 0.00 -1.53 0.00 0.00 36.38 30.49 2b6f s VAL 56 CO 0.04 -0.67 0.67 -0.76 -3.33 0.00 0.00 175.10 171.04 2b6f s LEU 57 N 3.14 4.25 -0.13 2.54 1.43 -1.26 -5.06 118.68 123.60 2b6f s LEU 57 Ca 0.28 1.25 -0.14 0.00 -1.03 0.00 0.00 54.13 54.49 2b6f s LEU 57 Cb -0.13 -3.65 -0.05 0.00 0.03 0.00 0.00 46.19 42.39 2b6f s LEU 57 CO 0.21 -0.02 0.32 -0.62 0.23 0.00 0.00 176.35 176.47 2b6f s ASP 58 N -1.90 6.52 0.49 2.29 -1.08 -1.26 -4.98 116.67 116.74 2b6f s ASP 58 Ca 0.45 0.61 0.28 0.00 -0.52 0.00 0.00 52.55 53.38 2b6f s ASP 58 Cb -0.14 -2.19 0.85 0.00 -1.46 0.00 0.00 42.92 39.98 2b6f s ASP 58 CO 0.20 0.15 1.80 1.55 0.52 0.00 0.00 175.17 179.39 2b6f h PRO 59 N 6.20 0.00 0.10 4.34 0.13 -2.00 -3.02 132.00 137.75 2b6f h PRO 59 Ca -0.44 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.47 2b6f h PRO 59 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2b6f h PRO 59 CO 0.72 0.00 -1.08 0.00 -0.23 0.00 0.00 178.00 177.40 2b6f h ALA 60 N 2.00 0.09 -0.11 -0.56 0.00 -2.00 -3.19 119.26 115.50 2b6f h ALA 60 Ca 0.00 -0.93 -0.08 0.00 0.00 0.00 0.00 54.91 53.90 2b6f h ALA 60 Cb 0.76 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2b6f h ALA 60 CO 0.00 0.60 -0.29 -0.22 0.00 0.00 0.00 179.25 179.35 2b6f h LYS 61 N -0.47 0.20 -0.30 0.00 3.64 -2.00 -2.47 116.57 115.18 2b6f h LYS 61 Ca -0.23 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 58.96 2b6f h LYS 61 Cb 1.60 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.39 2b6f h LYS 61 CO 0.05 0.48 -0.29 0.28 -2.27 0.00 0.00 179.45 177.70 2b6f h VAL 62 N 0.18 1.28 -0.40 2.00 2.07 -1.65 -2.77 116.25 116.96 2b6f h VAL 62 Ca 0.03 -1.39 -0.02 0.00 0.82 0.00 0.00 66.70 66.14 2b6f h VAL 62 Cb 0.61 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 2b6f h VAL 62 CO 0.04 0.45 0.17 1.56 0.02 0.00 0.00 177.57 179.81 2b6f h GLN 63 N 0.53 0.59 -0.97 1.57 1.08 -1.43 0.20 115.11 116.67 2b6f h GLN 63 Ca 0.07 -0.10 0.09 0.00 -1.45 0.00 0.00 58.65 57.25 2b6f h GLN 63 Cb 0.76 -0.10 -0.07 0.00 -0.05 0.00 0.00 27.48 28.02 2b6f h GLN 63 CO 0.06 0.54 0.62 1.03 -0.95 0.00 0.00 178.83 180.13 2b6f h SER 64 N 0.50 0.95 0.02 1.46 0.87 -1.29 0.51 113.55 116.57 2b6f h SER 64 Ca 0.13 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 2b6f h SER 64 Cb 0.16 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2b6f h SER 64 CO -0.01 0.57 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.78 2b6f h LEU 65 N 1.06 -0.02 -1.77 2.23 3.38 -1.15 -0.58 115.31 118.46 2b6f h LEU 65 Ca 0.44 -0.62 0.11 0.00 0.09 0.00 0.00 57.88 57.90 2b6f h LEU 65 Cb 0.30 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 2b6f h LEU 65 CO -0.19 0.62 0.37 0.58 0.09 0.00 0.00 178.44 179.91 2b6f h VAL 66 N -0.67 0.85 0.01 1.22 2.07 -0.07 -0.40 116.25 119.26 2b6f h VAL 66 Ca -0.00 -0.09 -0.26 0.00 0.82 0.00 0.00 66.70 67.17 2b6f h VAL 66 Cb 0.63 0.57 0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2b6f h VAL 66 CO 0.00 0.05 -1.04 0.44 0.02 0.00 0.00 177.57 177.04 2b6f h ASP 67 N 0.25 0.79 0.13 0.57 5.19 0.14 -2.68 116.42 120.82 2b6f h ASP 67 Ca 0.25 -0.65 -0.01 0.00 -0.62 0.00 0.00 57.03 56.01 2b6f h ASP 67 Cb 0.67 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 39.94 2b6f h ASP 67 CO -0.05 1.45 -0.06 0.74 -3.12 0.00 0.00 179.24 178.19 2b6f h THR 68 N 0.33 0.99 -0.89 0.35 2.02 0.48 0.98 112.91 117.17 2b6f h THR 68 Ca -0.12 -0.53 0.08 0.00 0.77 0.00 0.00 66.41 66.61 2b6f h THR 68 Cb 1.69 1.32 -0.07 0.00 -1.74 0.00 0.00 68.15 69.35 2b6f h THR 68 CO 0.20 0.13 0.55 0.40 0.37 0.00 0.00 175.52 177.16 2b6f h ILE 69 N -0.43 1.01 0.00 3.11 2.04 -1.33 1.95 117.51 123.86 2b6f h ILE 69 Ca -0.02 -0.33 -0.13 0.00 1.00 0.00 0.00 64.86 65.38 2b6f h ILE 69 Cb 0.34 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.35 2b6f h ILE 69 CO 0.03 0.18 -0.62 0.03 0.00 0.00 0.00 178.15 177.77 2b6f h ARG 70 N 0.98 0.00 0.09 2.37 3.08 -1.23 -3.18 114.38 116.48 2b6f h ARG 70 Ca 0.40 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 60.11 2b6f h ARG 70 Cb 0.24 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 2b6f h ARG 70 CO -0.20 0.62 -1.89 0.93 -1.07 0.00 0.00 179.97 178.36 2b6f h GLU 71 N 0.00 0.20 -0.93 0.04 4.39 0.23 -3.46 114.58 115.04 2b6f h GLU 71 Ca -0.01 -0.34 0.05 0.00 0.34 0.00 0.00 59.36 59.40 2b6f h GLU 71 Cb 1.35 0.13 -0.21 0.00 -0.10 0.00 0.00 28.75 29.91 2b6f h GLU 71 CO 0.08 1.02 -0.35 0.34 -1.16 0.00 0.00 179.01 178.94 2b6f s ASP 72 N -6.79 -1.52 0.00 1.42 -1.08 0.65 -5.02 116.67 104.33 2b6f s ASP 72 Ca -0.17 0.16 0.23 0.00 -0.52 0.00 0.00 52.55 52.25 2b6f s ASP 72 Cb 0.07 1.97 1.17 0.00 -1.46 0.00 0.00 42.92 44.67 2b6f s ASP 72 CO 0.79 -0.28 1.74 -0.81 0.52 0.00 0.00 175.17 177.13 2b6f n PRO 73 N 5.37 0.37 0.04 4.34 -0.04 -1.20 -3.28 135.00 140.61 2b6f n PRO 73 Ca 0.06 0.06 -0.01 0.00 -0.04 0.00 0.00 63.50 63.57 2b6f n PRO 73 Cb 0.54 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.43 2b6f n PRO 73 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2b6f h ASP 74 N 0.00 0.00 -0.34 3.54 3.58 -1.91 -3.32 116.42 117.96 2b6f h ASP 74 Ca 0.00 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.33 2b6f h ASP 74 Cb 0.18 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.16 2b6f h ASP 74 CO 0.00 0.61 0.15 -0.24 -2.88 0.00 0.00 179.24 176.88 2b6f n SER 75 N -2.94 3.19 -4.11 2.28 2.88 -1.20 -4.76 113.62 108.96 2b6f n SER 75 Ca -0.09 -2.55 -0.33 0.00 -1.33 0.00 0.00 58.87 54.57 2b6f n SER 75 Cb 0.85 -0.62 -0.15 0.00 -0.75 0.00 0.00 64.21 63.55 2b6f n SER 75 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2b6f s VAL 76 N -1.57 2.42 0.70 2.46 1.01 -1.25 -5.07 120.40 119.10 2b6f s VAL 76 Ca 0.24 -1.50 -0.11 0.00 0.00 0.00 0.00 61.98 60.60 2b6f s VAL 76 Cb 0.19 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 34.19 2b6f s VAL 76 CO 0.06 -0.01 1.07 -2.16 0.00 0.00 0.00 175.10 174.05 2b6f s PRO 77 N 1.16 2.93 0.88 2.72 0.04 -1.26 -5.07 135.00 136.39 2b6f s PRO 77 Ca -0.07 0.70 -0.13 0.00 0.04 0.00 0.00 61.00 61.54 2b6f s PRO 77 Cb -0.19 -2.01 0.13 0.00 0.04 0.00 0.00 34.50 32.46 2b6f s PRO 77 CO -0.04 -1.04 1.22 -1.25 0.04 0.00 0.00 177.00 175.92 2b6f s PRO 78 N -5.19 1.39 0.34 0.56 0.04 -1.26 -5.03 135.00 125.86 2b6f s PRO 78 Ca 0.58 -0.03 0.08 0.00 0.04 0.00 0.00 61.00 61.67 2b6f s PRO 78 Cb -0.12 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2b6f s PRO 78 CO 0.54 -1.97 0.15 0.96 0.04 0.00 0.00 177.00 176.72 2b6f s ILE 79 N -3.62 3.00 0.04 0.56 -4.36 -1.23 -4.84 121.20 110.75 2b6f s ILE 79 Ca 0.66 -1.68 -0.22 0.00 -0.26 0.00 0.00 60.65 59.15 2b6f s ILE 79 Cb -0.09 -2.99 -0.06 0.00 1.25 0.00 0.00 42.46 40.57 2b6f s ILE 79 CO 0.51 -0.17 0.66 1.51 0.24 0.00 0.00 174.94 177.69 2b6f s ASP 80 N -3.86 7.10 0.00 4.36 -4.77 -1.26 0.22 116.67 118.47 2b6f s ASP 80 Ca 0.38 1.31 0.01 0.00 -3.30 0.00 0.00 52.55 50.95 2b6f s ASP 80 Cb -0.02 -2.41 -0.01 0.00 -1.09 0.00 0.00 42.92 39.39 2b6f s ASP 80 CO 0.23 0.12 -0.03 -0.69 0.70 0.00 0.00 175.17 175.50 2b6f s VAL 81 N -0.42 0.20 -0.08 2.11 1.01 -0.78 -4.56 120.40 117.88 2b6f s VAL 81 Ca 0.33 -0.26 -0.19 0.00 0.00 0.00 0.00 61.98 61.85 2b6f s VAL 81 Cb -0.20 -0.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 2b6f s VAL 81 CO 0.20 -0.05 0.54 -0.76 0.00 0.00 0.00 175.10 175.03 2b6f s LEU 82 N -0.33 4.33 -0.32 3.92 1.43 -0.26 -1.73 118.68 125.72 2b6f s LEU 82 Ca -0.02 0.97 -0.08 0.00 -1.03 0.00 0.00 54.13 53.98 2b6f s LEU 82 Cb -0.03 -2.81 0.02 0.00 0.03 0.00 0.00 46.19 43.40 2b6f s LEU 82 CO -0.00 0.02 0.12 0.86 0.23 0.00 0.00 176.35 177.58 2b6f s TRP 83 N 0.37 3.20 0.02 0.29 -0.00 -0.88 -1.94 118.94 119.99 2b6f s TRP 83 Ca 0.29 -1.06 0.04 0.00 -0.00 0.00 0.00 56.10 55.38 2b6f s TRP 83 Cb -0.16 -2.30 -0.02 0.00 -0.00 0.00 0.00 33.47 30.99 2b6f s TRP 83 CO 0.13 -0.62 -0.13 0.42 -0.00 0.00 0.00 176.95 176.75 2b6f s ILE 84 N 1.49 1.04 0.20 5.86 1.01 -1.08 -2.05 121.20 127.67 2b6f s ILE 84 Ca 0.02 -0.85 0.07 0.00 0.00 0.00 0.00 60.65 59.89 2b6f s ILE 84 Cb -0.18 -0.93 -0.04 0.00 0.01 0.00 0.00 42.46 41.32 2b6f s ILE 84 CO 0.04 0.08 0.05 -0.54 0.00 0.00 0.00 174.94 174.56 2b6f s LYS 85 N -0.88 2.54 0.33 2.79 1.02 -1.26 -1.04 119.74 123.24 2b6f s LYS 85 Ca 0.02 -1.12 0.01 0.00 0.02 0.00 0.00 55.97 54.90 2b6f s LYS 85 Cb -0.07 -2.40 0.06 0.00 -0.52 0.00 0.00 37.83 34.91 2b6f s LYS 85 CO 0.01 0.44 0.45 0.41 -0.92 0.00 0.00 175.35 175.73 2b6f n GLY 86 N -0.44 0.98 0.00 -3.33 0.00 -0.48 -4.93 105.19 97.00 2b6f n GLY 86 Ca -0.09 -2.03 0.05 0.00 0.00 0.00 0.00 46.02 43.96 2b6f n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b6f n ALA 87 N -2.90 1.61 -1.59 4.61 0.00 -0.58 -2.52 120.51 119.15 2b6f n ALA 87 Ca -0.07 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.38 2b6f n ALA 87 Cb 0.28 -1.18 0.12 0.00 0.00 0.00 0.00 19.45 18.68 2b6f n ALA 87 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2b6f n GLN 88 N -1.36 1.01 0.00 0.00 6.02 0.21 -4.96 117.38 118.29 2b6f n GLN 88 Ca 0.04 -2.49 0.00 0.00 -0.01 0.00 0.00 57.00 54.54 2b6f n GLN 88 Cb 0.10 -1.18 0.00 0.00 1.02 0.00 0.00 30.24 30.18 2b6f n GLN 88 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2b6f n GLY 89 N -0.84 2.81 3.42 1.08 0.00 -1.05 -4.94 105.19 105.66 2b6f n GLY 89 Ca 0.13 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.64 2b6f n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b6f n GLY 90 N -2.00 0.32 3.73 -0.02 0.00 -1.21 -4.50 105.19 101.50 2b6f n GLY 90 Ca 0.00 0.97 -0.41 0.00 0.00 0.00 0.00 46.02 46.58 2b6f n GLY 90 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b6f s ASP 91 N 7.37 7.38 -0.10 1.61 1.01 -1.26 -1.38 116.67 131.30 2b6f s ASP 91 Ca 1.12 1.95 0.00 0.00 0.71 0.00 0.00 52.55 56.34 2b6f s ASP 91 Cb -0.96 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 40.39 2b6f s ASP 91 CO 0.51 -0.14 -0.08 -0.31 0.21 0.00 0.00 175.17 175.36 2b6f s TYR 92 N -0.14 1.39 -0.30 4.23 2.02 -0.21 -4.98 117.35 119.35 2b6f s TYR 92 Ca 0.48 -0.63 -0.13 0.00 -0.37 0.00 0.00 57.07 56.42 2b6f s TYR 92 Cb -0.27 -1.14 -0.03 0.00 -0.40 0.00 0.00 41.96 40.12 2b6f s TYR 92 CO 0.32 -0.43 0.25 -0.06 -1.57 0.00 0.00 175.55 174.07 2b6f s PHE 93 N 1.45 3.22 -0.13 2.71 0.08 -1.26 -2.65 117.98 121.40 2b6f s PHE 93 Ca -0.00 0.05 -0.04 0.00 0.12 0.00 0.00 56.93 57.06 2b6f s PHE 93 Cb -0.13 -2.48 -0.03 0.00 -0.57 0.00 0.00 43.02 39.81 2b6f s PHE 93 CO -0.05 -0.27 0.01 0.71 -0.10 0.00 0.00 175.22 175.52 2b6f s TYR 94 N 1.83 3.15 -0.05 0.36 1.51 -0.82 -1.99 117.35 121.34 2b6f s TYR 94 Ca 0.09 0.02 0.05 0.00 -1.01 0.00 0.00 57.07 56.21 2b6f s TYR 94 Cb -0.16 -1.92 -0.00 0.00 -0.11 0.00 0.00 41.96 39.76 2b6f s TYR 94 CO 0.11 0.24 -0.19 0.45 -1.11 0.00 0.00 175.55 175.05 2b6f s SER 95 N -0.19 2.39 -0.38 2.29 0.15 -1.17 -1.10 113.70 115.69 2b6f s SER 95 Ca 0.05 -0.40 0.01 0.00 0.70 0.00 0.00 55.95 56.31 2b6f s SER 95 Cb -0.12 -0.71 0.13 0.00 -1.71 0.00 0.00 66.02 63.61 2b6f s SER 95 CO 0.02 0.17 0.21 -0.36 1.20 0.00 0.00 173.24 174.48 2b6f s PHE 96 N 0.04 1.30 -2.99 3.44 0.08 -1.26 -4.79 117.98 113.80 2b6f s PHE 96 Ca -0.05 -1.94 0.00 0.00 0.12 0.00 0.00 56.93 55.06 2b6f s PHE 96 Cb -0.13 -1.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.95 2b6f s PHE 96 CO 0.03 -0.81 0.00 0.41 -0.10 0.00 0.00 175.22 174.75 2b6f n GLY 97 N 3.94 0.72 1.90 4.36 0.00 -1.26 -4.97 105.19 109.87 2b6f n GLY 97 Ca 0.09 -2.06 -0.03 0.00 0.00 0.00 0.00 46.02 44.01 2b6f n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b6f n GLY 98 N 0.00 0.32 0.28 -0.02 0.00 -1.26 -4.73 105.19 99.78 2b6f n GLY 98 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2b6f n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b6f h HIS 100 N -0.16 0.07 0.00 0.00 3.86 -1.99 0.32 115.15 117.25 2b6f h HIS 100 Ca 0.19 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.31 2b6f h HIS 100 Cb 0.47 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 2b6f h HIS 100 CO -0.47 0.03 -0.44 -0.09 0.86 0.00 0.00 177.93 177.82 2b6f h ARG 101 N 0.07 0.00 -0.13 2.45 9.65 -0.12 -2.90 114.38 123.40 2b6f h ARG 101 Ca 0.25 0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 59.05 2b6f h ARG 101 Cb 0.92 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.50 2b6f h ARG 101 CO -0.02 0.44 -0.25 -0.92 2.80 0.00 0.00 179.97 182.02 2b6f h TYR 102 N 0.00 0.50 -0.89 2.20 5.03 0.44 -2.68 116.97 121.57 2b6f h TYR 102 Ca -0.00 -0.18 0.05 0.00 2.58 0.00 0.00 58.73 61.17 2b6f h TYR 102 Cb 0.82 -0.09 -0.06 0.00 1.55 0.00 0.00 36.73 38.95 2b6f h TYR 102 CO 0.00 0.87 0.57 0.00 -1.32 0.00 0.00 178.16 178.28 2b6f h ALA 103 N 0.54 1.19 -0.09 1.82 0.00 -1.41 0.43 119.26 121.75 2b6f h ALA 103 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2b6f h ALA 103 Cb 0.84 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2b6f h ALA 103 CO 0.06 0.38 0.04 0.00 0.00 0.00 0.00 179.25 179.72 2b6f h ALA 104 N 1.39 0.11 -0.52 0.00 0.00 -1.48 0.31 119.26 119.06 2b6f h ALA 104 Ca 0.37 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 2b6f h ALA 104 Cb 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2b6f h ALA 104 CO -0.14 -0.31 0.01 1.88 0.00 0.00 0.00 179.25 180.69 2b6f h TYR 105 N -0.01 1.00 -0.30 0.00 -1.99 -1.10 -2.19 116.97 112.38 2b6f h TYR 105 Ca 0.03 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 60.58 2b6f h TYR 105 Cb 0.16 -0.26 -0.01 0.00 2.00 0.00 0.00 36.73 38.61 2b6f h TYR 105 CO -0.02 0.92 0.15 0.37 -0.00 0.00 0.00 178.16 179.58 2b6f h GLN 106 N 0.79 0.43 -0.93 4.88 -0.00 0.05 -2.60 115.11 117.73 2b6f h GLN 106 Ca 0.15 -0.06 0.05 0.00 -0.00 0.00 0.00 58.65 58.79 2b6f h GLN 106 Cb 0.52 -0.08 -0.06 0.00 0.00 0.00 0.00 27.48 27.86 2b6f h GLN 106 CO 0.03 0.39 0.60 0.37 0.00 0.00 0.00 178.83 180.21 2b6f h GLN 107 N 0.36 1.09 0.00 1.69 4.15 -0.22 0.20 115.11 122.38 2b6f h GLN 107 Ca 0.10 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.46 2b6f h GLN 107 Cb 0.10 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.54 2b6f h GLN 107 CO -0.01 0.72 0.00 1.28 -1.93 0.00 0.00 178.83 178.89 2b6f n LEU 108 N -4.53 0.00 -4.09 -2.39 4.77 -0.84 -4.84 117.00 105.08 2b6f n LEU 108 Ca 0.13 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.81 2b6f n LEU 108 Cb 0.13 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 2b6f n LEU 108 CO 0.33 0.00 -0.16 1.67 -1.33 0.00 0.00 177.39 177.90 2b6f n GLN 109 N -0.66 -3.12 -1.94 3.23 7.27 0.72 -4.92 117.38 117.96 2b6f n GLN 109 Ca 0.06 0.37 -0.30 0.00 0.07 0.00 0.00 57.00 57.19 2b6f n GLN 109 Cb 0.03 -4.72 0.01 0.00 2.41 0.00 0.00 30.24 27.97 2b6f n GLN 109 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2b6f s ARG 110 N -6.78 3.48 -0.02 3.69 1.81 -1.10 -5.00 118.95 115.04 2b6f s ARG 110 Ca 0.33 0.65 -0.16 0.00 -1.72 0.00 0.00 55.73 54.82 2b6f s ARG 110 Cb -0.18 -2.10 -0.33 0.00 -0.45 0.00 0.00 34.95 31.89 2b6f s ARG 110 CO 0.91 -0.61 0.86 0.93 -0.68 0.00 0.00 175.30 176.72 2b6f h GLU 111 N -0.32 0.43 -4.94 3.54 3.07 -1.91 -3.47 114.58 110.97 2b6f h GLU 111 Ca -0.44 -0.73 -0.48 0.00 -0.50 0.00 0.00 59.36 57.20 2b6f h GLU 111 Cb 1.20 0.27 -0.13 0.00 -0.84 0.00 0.00 28.75 29.25 2b6f h GLU 111 CO 0.62 1.35 -0.52 0.95 -1.40 0.00 0.00 179.01 180.01 2b6f s THR 112 N -2.54 0.32 0.00 1.13 -4.23 -1.26 -3.03 115.64 106.03 2b6f s THR 112 Ca -0.13 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.39 2b6f s THR 112 Cb 0.04 -2.44 -0.00 0.00 1.34 0.00 0.00 72.50 71.43 2b6f s THR 112 CO 0.88 0.00 -0.01 -0.51 -0.54 0.00 0.00 174.62 174.44 2b6f s ILE 113 N -3.42 0.07 0.14 2.99 2.07 -1.11 -4.84 121.20 117.11 2b6f s ILE 113 Ca 0.33 -0.14 -0.31 0.00 -1.41 0.00 0.00 60.65 59.12 2b6f s ILE 113 Cb 0.03 -0.09 -0.09 0.00 0.13 0.00 0.00 42.46 42.45 2b6f s ILE 113 CO 0.19 -0.04 1.45 -2.84 -1.91 0.00 0.00 174.94 171.80 2b6f s PRO 114 N -0.19 4.28 -0.14 3.50 0.02 -1.26 -2.31 135.00 138.91 2b6f s PRO 114 Ca -0.01 2.18 -0.09 0.00 0.02 0.00 0.00 61.00 63.10 2b6f s PRO 114 Cb -0.01 -3.21 0.05 0.00 0.02 0.00 0.00 34.50 31.34 2b6f s PRO 114 CO -0.00 -0.49 0.34 0.00 -0.33 0.00 0.00 177.00 176.52 2b6f s ALA 115 N 1.07 -0.85 -0.28 -1.55 0.00 -0.81 -3.55 121.76 115.79 2b6f s ALA 115 Ca 0.66 1.18 -0.29 0.00 0.00 0.00 0.00 51.96 53.51 2b6f s ALA 115 Cb -0.39 -0.71 0.01 0.00 0.00 0.00 0.00 23.12 22.03 2b6f s ALA 115 CO 0.31 -0.21 1.09 0.21 0.00 0.00 0.00 175.76 177.16 2b6f s LYS 116 N 0.90 4.12 0.16 0.00 2.36 0.13 -2.54 119.74 124.88 2b6f s LYS 116 Ca -0.06 1.20 -0.30 0.00 -2.55 0.00 0.00 55.97 54.26 2b6f s LYS 116 Cb -0.07 -3.72 -0.07 0.00 -1.05 0.00 0.00 37.83 32.92 2b6f s LYS 116 CO -0.07 -0.82 1.02 -0.51 1.55 0.00 0.00 175.35 176.52 2b6f s LEU 117 N 3.55 4.52 -0.21 5.43 1.43 -1.16 -1.87 118.68 130.37 2b6f s LEU 117 Ca 0.46 1.96 -0.02 0.00 -1.03 0.00 0.00 54.13 55.50 2b6f s LEU 117 Cb -0.14 -3.60 0.07 0.00 0.03 0.00 0.00 46.19 42.55 2b6f s LEU 117 CO 0.13 -0.10 0.03 -0.69 0.23 0.00 0.00 176.35 175.95 2b6f s VAL 118 N -0.32 0.67 0.14 -1.59 1.01 -0.70 -4.35 120.40 115.26 2b6f s VAL 118 Ca 0.47 -0.74 -0.34 0.00 0.00 0.00 0.00 61.98 61.37 2b6f s VAL 118 Cb -0.27 -1.20 -0.17 0.00 0.00 0.00 0.00 36.38 34.75 2b6f s VAL 118 CO 0.33 -0.26 1.09 0.00 0.00 0.00 0.00 175.10 176.26 2b6f n GLN 119 N 4.98 0.85 -4.24 2.72 3.00 -1.26 -2.07 117.38 121.36 2b6f n GLN 119 Ca -0.08 0.30 -0.19 0.00 -0.01 0.00 0.00 57.00 57.02 2b6f n GLN 119 Cb 0.46 -1.76 -0.07 0.00 0.00 0.00 0.00 30.24 28.87 2b6f n GLN 119 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2b6f s SER 120 N -0.08 1.58 0.16 1.08 0.01 -0.87 -4.79 113.70 110.79 2b6f s SER 120 Ca 0.76 -1.72 0.04 0.00 1.31 0.00 0.00 55.95 56.34 2b6f s SER 120 Cb -0.94 0.59 -0.05 0.00 0.21 0.00 0.00 66.02 65.84 2b6f s SER 120 CO 0.53 -1.12 -0.08 0.42 0.41 0.00 0.00 173.24 173.39 2b6f s THR 121 N -3.32 1.11 0.59 1.44 -4.23 -1.26 -4.69 115.64 105.29 2b6f s THR 121 Ca 0.39 -2.05 0.29 0.00 -1.18 0.00 0.00 61.69 59.14 2b6f s THR 121 Cb 0.02 -1.92 0.37 0.00 1.34 0.00 0.00 72.50 72.31 2b6f s THR 121 CO 0.27 -0.69 2.00 0.25 -0.54 0.00 0.00 174.62 175.91 2b6f h LEU 122 N 2.74 0.00 -0.15 4.79 5.85 -1.97 -0.95 115.31 125.63 2b6f h LEU 122 Ca -0.37 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 2b6f h LEU 122 Cb 1.19 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 2b6f h LEU 122 CO 0.64 0.00 0.06 0.28 -0.34 0.00 0.00 178.44 179.08 2b6f h SER 123 N 0.00 0.20 -0.88 1.25 0.02 -2.00 -1.84 113.55 110.30 2b6f h SER 123 Ca 0.14 -0.15 0.10 0.00 -0.84 0.00 0.00 61.79 61.04 2b6f h SER 123 Cb 0.82 -0.05 -0.08 0.00 0.14 0.00 0.00 62.40 63.23 2b6f h SER 123 CO -0.00 0.29 0.52 -0.78 -1.14 0.00 0.00 176.83 175.73 2b6f h ASP 124 N 0.09 0.76 -0.73 3.07 1.82 -1.57 0.34 116.42 120.20 2b6f h ASP 124 Ca 0.05 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.71 2b6f h ASP 124 Cb 0.16 -0.10 -0.04 0.00 0.68 0.00 0.00 39.33 40.03 2b6f h ASP 124 CO -0.00 0.43 0.38 0.25 -1.61 0.00 0.00 179.24 178.68 2b6f h LEU 125 N 0.87 0.94 -1.30 2.28 5.85 -1.39 -1.56 115.31 121.00 2b6f h LEU 125 Ca 0.42 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 59.11 2b6f h LEU 125 Cb 0.38 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 2b6f h LEU 125 CO -0.25 0.78 0.51 -0.09 -0.34 0.00 0.00 178.44 179.05 2b6f h ARG 126 N 1.04 0.84 -0.61 1.25 2.43 -0.11 0.67 114.38 119.89 2b6f h ARG 126 Ca 0.26 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.44 2b6f h ARG 126 Cb 0.07 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 2b6f h ARG 126 CO -0.04 0.56 0.41 0.28 -1.51 0.00 0.00 179.97 179.67 2b6f h VAL 127 N 0.87 1.00 0.02 0.20 2.07 -0.88 1.01 116.25 120.53 2b6f h VAL 127 Ca 0.33 -0.20 -0.27 0.00 0.82 0.00 0.00 66.70 67.38 2b6f h VAL 127 Cb 0.19 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2b6f h VAL 127 CO -0.11 0.11 -1.45 -1.22 0.02 0.00 0.00 177.57 174.91 2b6f n TYR 128 N -4.48 1.00 -2.03 1.57 4.01 0.29 -4.52 117.16 113.01 2b6f n TYR 128 Ca 0.09 0.39 -0.28 0.00 -0.16 0.00 0.00 57.90 57.94 2b6f n TYR 128 Cb 0.24 -1.11 0.03 0.00 -0.31 0.00 0.00 39.34 38.19 2b6f n TYR 128 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2b6f n LEU 129 N -4.26 5.54 -1.79 7.72 4.77 0.21 -4.86 117.00 124.32 2b6f n LEU 129 Ca -0.33 -4.81 0.00 0.00 -0.03 0.00 0.00 56.01 50.83 2b6f n LEU 129 Cb 0.75 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 2b6f n LEU 129 CO 0.22 2.01 0.23 0.61 -1.33 0.00 0.00 177.39 179.13 2b6f n GLY 130 N -0.67 0.93 2.15 -0.72 0.00 0.35 -2.93 105.19 104.31 2b6f n GLY 130 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.48 2b6f n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b6f n ALA 131 N 1.77 1.07 -1.17 4.61 0.00 -1.26 -4.92 120.51 120.62 2b6f n ALA 131 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2b6f n ALA 131 Cb 0.12 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.66 2b6f n ALA 131 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2b6f n SER 132 N -3.45 6.49 -4.65 0.00 2.88 -1.21 -4.95 113.62 108.73 2b6f n SER 132 Ca 0.00 -3.57 -0.43 0.00 -1.33 0.00 0.00 58.87 53.54 2b6f n SER 132 Cb 0.00 -0.95 -0.02 0.00 -0.75 0.00 0.00 64.21 62.49 2b6f n SER 132 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2b6f s THR 133 N -3.92 4.24 0.42 2.46 2.01 -1.15 -5.03 115.64 114.68 2b6f s THR 133 Ca 0.56 1.46 -0.07 0.00 0.31 0.00 0.00 61.69 63.95 2b6f s THR 133 Cb 0.44 -4.08 0.10 0.00 0.01 0.00 0.00 72.50 68.97 2b6f s THR 133 CO 0.02 -0.28 0.58 -0.81 -0.69 0.00 0.00 174.62 173.44 2b6f n PRO 134 N 6.89 -0.48 -4.13 4.92 -0.04 -1.26 -5.06 135.00 135.84 2b6f n PRO 134 Ca 0.14 -0.96 -0.34 0.00 -0.04 0.00 0.00 63.50 62.30 2b6f n PRO 134 Cb 0.46 -0.58 -0.11 0.00 -0.04 0.00 0.00 33.50 33.23 2b6f n PRO 134 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2b6f s ASP 135 N -3.13 5.32 0.02 3.54 -1.08 -1.26 -5.09 116.67 114.99 2b6f s ASP 135 Ca 0.33 -0.00 -0.19 0.00 -0.52 0.00 0.00 52.55 52.17 2b6f s ASP 135 Cb -0.01 -1.90 -0.06 0.00 -1.46 0.00 0.00 42.92 39.49 2b6f s ASP 135 CO 0.23 0.16 0.55 -0.76 0.52 0.00 0.00 175.17 175.88 2b6f s LEU 136 N 0.42 4.46 0.00 -1.34 1.43 -1.26 -5.06 118.68 117.32 2b6f s LEU 136 Ca 0.01 1.15 0.00 0.00 -1.03 0.00 0.00 54.13 54.26 2b6f s LEU 136 Cb -0.13 -2.85 0.00 0.00 0.03 0.00 0.00 46.19 43.24 2b6f s LEU 136 CO 0.01 0.19 0.26 0.00 0.23 0.00 0.00 176.35 177.05