#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gty s LEU 2 N 0.00 4.30 0.00 2.46 2.96 -1.26 -4.99 118.68 122.16 2gty s LEU 2 Ca 0.00 1.79 -0.03 0.00 -0.22 0.00 0.00 54.13 55.67 2gty s LEU 2 Cb 0.00 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.14 2gty s LEU 2 CO 0.00 -0.50 0.22 1.07 -1.32 0.00 0.00 176.35 175.82 2gty n THR 3 N 4.37 0.00 -3.71 3.68 5.66 -1.26 -5.19 114.28 117.83 2gty n THR 3 Ca 0.10 -0.48 -0.10 0.00 -3.05 0.00 0.00 64.05 60.52 2gty n THR 3 Cb 0.47 0.36 -0.05 0.00 -1.55 0.00 0.00 70.33 69.56 2gty n THR 3 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 2gty s HIS 4 N -5.50 -0.08 -0.07 1.09 -3.43 -1.26 -5.17 115.29 100.87 2gty s HIS 4 Ca 0.08 -0.27 -0.06 0.00 -0.80 0.00 0.00 55.06 54.01 2gty s HIS 4 Cb -0.01 0.17 0.02 0.00 -1.43 0.00 0.00 32.58 31.33 2gty s HIS 4 CO 0.06 -0.67 0.18 0.50 -2.00 0.00 0.00 174.74 172.81 2gty s ARG 5 N -3.83 0.20 -0.12 -0.38 3.52 -1.26 -5.15 118.95 111.92 2gty s ARG 5 Ca 0.04 0.28 -0.07 0.00 -0.13 0.00 0.00 55.73 55.86 2gty s ARG 5 Cb 0.03 0.06 -0.04 0.00 -1.56 0.00 0.00 34.95 33.44 2gty s ARG 5 CO -0.11 -0.05 0.14 0.15 -0.81 0.00 0.00 175.30 174.62 2gty s LYS 6 N 0.28 3.47 0.03 5.12 1.02 -1.26 -5.11 119.74 123.29 2gty s LYS 6 Ca -0.02 -0.14 0.05 0.00 0.02 0.00 0.00 55.97 55.88 2gty s LYS 6 Cb -0.03 -3.19 -0.02 0.00 -0.52 0.00 0.00 37.83 34.07 2gty s LYS 6 CO -0.01 0.75 -0.15 -0.06 -0.92 0.00 0.00 175.35 174.97 2gty s PHE 7 N -0.96 1.28 0.00 3.18 0.08 -1.26 -5.10 117.98 115.20 2gty s PHE 7 Ca 0.15 -0.34 0.00 0.00 0.12 0.00 0.00 56.93 56.85 2gty s PHE 7 Cb -0.12 -0.77 0.00 0.00 -0.57 0.00 0.00 43.02 41.56 2gty s PHE 7 CO 0.04 0.03 0.00 0.41 -0.10 0.00 0.00 175.22 175.60 2gty n GLY 8 N 1.98 -1.89 0.00 4.36 0.00 -1.26 -5.06 105.19 103.32 2gty n GLY 8 Ca -0.18 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 43.85 2gty n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gty n GLY 9 N 0.00 2.68 0.74 -0.02 0.00 -1.26 -5.06 105.19 102.27 2gty n GLY 9 Ca 0.00 -2.08 0.11 0.00 0.00 0.00 0.00 46.02 44.05 2gty n GLY 9 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gty n SER 10 N -1.07 2.55 -3.56 1.61 3.41 -1.26 -5.01 113.62 110.29 2gty n SER 10 Ca 0.00 -1.77 -0.21 0.00 -0.26 0.00 0.00 58.87 56.62 2gty n SER 10 Cb 0.00 0.22 0.14 0.00 -0.26 0.00 0.00 64.21 64.31 2gty n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gty n GLY 11 N 1.37 -0.98 0.85 5.00 0.00 -1.26 -5.01 105.19 105.16 2gty n GLY 11 Ca 0.12 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.37 2gty n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gty n GLY 12 N -1.50 -2.34 3.57 -0.02 0.00 -1.26 -4.93 105.19 98.72 2gty n GLY 12 Ca 0.13 -1.56 -0.33 0.00 0.00 0.00 0.00 46.02 44.26 2gty n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gty s SER 13 N -2.17 4.56 0.42 1.61 0.01 -1.26 -5.09 113.70 111.78 2gty s SER 13 Ca 0.00 -0.06 -0.25 0.00 1.31 0.00 0.00 55.95 56.94 2gty s SER 13 Cb 0.00 -1.11 -0.08 0.00 0.21 0.00 0.00 66.02 65.04 2gty s SER 13 CO 0.00 0.35 1.29 -2.16 0.41 0.00 0.00 173.24 173.13 2gty s PRO 14 N -0.90 3.89 0.18 12.44 0.04 -1.26 -5.04 135.00 144.35 2gty s PRO 14 Ca 0.13 2.12 0.03 0.00 0.04 0.00 0.00 61.00 63.32 2gty s PRO 14 Cb -0.11 -2.68 -0.05 0.00 0.04 0.00 0.00 34.50 31.70 2gty s PRO 14 CO 0.02 -0.54 -0.04 -0.59 0.04 0.00 0.00 177.00 175.89 2gty s PHE 15 N -1.30 1.35 0.04 0.56 -0.12 -1.26 -4.66 117.98 112.60 2gty s PHE 15 Ca 0.59 -0.88 0.09 0.00 -0.05 0.00 0.00 56.93 56.68 2gty s PHE 15 Cb -0.37 -0.74 -0.03 0.00 -0.63 0.00 0.00 43.02 41.25 2gty s PHE 15 CO 0.47 -0.03 -0.26 -1.54 -0.05 0.00 0.00 175.22 173.80 2gty s SER 16 N -3.21 3.14 0.49 1.98 1.04 -1.26 -5.02 113.70 110.86 2gty s SER 16 Ca 0.22 -0.58 0.22 0.00 0.48 0.00 0.00 55.95 56.30 2gty s SER 16 Cb 0.05 -0.29 1.25 0.00 0.10 0.00 0.00 66.02 67.13 2gty s SER 16 CO 0.04 0.26 2.02 1.23 0.98 0.00 0.00 173.24 177.77 2gty h GLY 17 N 4.85 0.00 -7.12 7.32 0.00 -2.01 -3.40 103.07 102.72 2gty h GLY 17 Ca -0.46 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.23 2gty h GLY 17 CO 0.44 0.00 0.24 -2.27 0.00 0.00 0.00 176.54 174.95 2gty s LEU 18 N -7.71 4.39 0.00 3.11 2.96 -1.26 -4.87 118.68 115.30 2gty s LEU 18 Ca -0.03 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.62 2gty s LEU 18 Cb 0.14 -2.83 0.00 0.00 0.50 0.00 0.00 46.19 44.00 2gty s LEU 18 CO 0.63 -0.86 0.00 -1.54 -1.32 0.00 0.00 176.35 173.25 2gty n SER 19 N 6.51 4.98 -3.62 3.68 3.41 -1.26 -4.90 113.62 122.43 2gty n SER 19 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 2gty n SER 19 Cb 0.48 0.84 -0.07 0.00 -0.26 0.00 0.00 64.21 65.20 2gty n SER 19 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2gty s SER 20 N -2.31 -0.43 -0.04 4.04 0.01 -1.26 -1.17 113.70 112.54 2gty s SER 20 Ca 0.00 0.34 -0.02 0.00 1.31 0.00 0.00 55.95 57.57 2gty s SER 20 Cb 0.00 0.45 0.02 0.00 0.21 0.00 0.00 66.02 66.70 2gty s SER 20 CO 0.00 -0.59 0.08 -0.63 0.41 0.00 0.00 173.24 172.51 2gty s ILE 21 N -1.65 -0.02 0.19 1.44 -1.09 -0.18 -0.95 121.20 118.94 2gty s ILE 21 Ca -0.10 0.08 -0.00 0.00 -2.23 0.00 0.00 60.65 58.40 2gty s ILE 21 Cb -0.02 -0.14 -0.04 0.00 -1.58 0.00 0.00 42.46 40.68 2gty s ILE 21 CO 0.04 0.03 0.09 0.00 -1.23 0.00 0.00 174.94 173.87 2gty s ALA 22 N 0.49 1.20 0.08 9.38 0.00 -0.35 -0.53 121.76 132.04 2gty s ALA 22 Ca -0.04 -1.65 0.01 0.00 0.00 0.00 0.00 51.96 50.29 2gty s ALA 22 Cb -0.05 1.06 -0.04 0.00 0.00 0.00 0.00 23.12 24.09 2gty s ALA 22 CO -0.02 -0.50 -0.06 0.14 0.00 0.00 0.00 175.76 175.32 2gty s VAL 23 N -3.99 0.56 -0.14 0.00 -7.23 -1.26 -0.29 120.40 108.05 2gty s VAL 23 Ca 0.32 -1.71 -0.03 0.00 -1.81 0.00 0.00 61.98 58.76 2gty s VAL 23 Cb 0.07 -1.39 -0.03 0.00 0.56 0.00 0.00 36.38 35.60 2gty s VAL 23 CO 0.08 -0.78 -0.06 -0.13 -0.31 0.00 0.00 175.10 173.90 2gty s ARG 24 N -3.31 3.56 0.05 4.82 0.52 -0.33 -0.55 118.95 123.72 2gty s ARG 24 Ca 0.06 -0.55 -0.16 0.00 -0.52 0.00 0.00 55.73 54.56 2gty s ARG 24 Cb 0.02 -2.84 0.03 0.00 0.52 0.00 0.00 34.95 32.68 2gty s ARG 24 CO -0.04 0.27 0.36 -1.54 0.02 0.00 0.00 175.30 174.36 2gty s SER 25 N 0.26 -0.20 0.00 0.23 1.04 -0.45 -0.45 113.70 114.14 2gty s SER 25 Ca -0.04 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.25 2gty s SER 25 Cb -0.14 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.38 2gty s SER 25 CO 0.03 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.20 2gty n GLY 26 N 0.45 2.56 0.00 7.32 0.00 -1.26 -1.14 105.19 113.12 2gty n GLY 26 Ca -0.18 -0.27 0.14 0.00 0.00 0.00 0.00 46.02 45.70 2gty n GLY 26 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gty n SER 27 N 0.00 0.09 -2.98 1.61 3.41 -1.26 -3.27 113.62 111.22 2gty n SER 27 Ca 0.00 0.30 -0.13 0.00 -0.26 0.00 0.00 58.87 58.79 2gty n SER 27 Cb 0.00 -0.36 -0.01 0.00 -0.26 0.00 0.00 64.21 63.59 2gty n SER 27 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2gty s TYR 28 N -2.95 0.69 -0.13 7.33 -0.85 -1.26 -2.43 117.35 117.75 2gty s TYR 28 Ca 0.15 -1.13 -0.20 0.00 -0.52 0.00 0.00 57.07 55.38 2gty s TYR 28 Cb 0.19 0.34 -0.04 0.00 0.38 0.00 0.00 41.96 42.83 2gty s TYR 28 CO 0.55 -1.37 0.55 -0.51 -1.52 0.00 0.00 175.55 173.24 2gty s LEU 29 N -3.18 4.25 0.06 -3.49 1.02 0.27 -4.48 118.68 113.13 2gty s LEU 29 Ca 0.24 0.88 -0.01 0.00 0.02 0.00 0.00 54.13 55.26 2gty s LEU 29 Cb -0.03 -2.80 -0.27 0.00 0.02 0.00 0.00 46.19 43.12 2gty s LEU 29 CO 0.17 -0.08 1.08 0.44 0.02 0.00 0.00 176.35 177.98 2gty h ASP 30 N 6.92 0.32 -4.82 2.29 3.32 -1.06 -0.62 116.42 122.77 2gty h ASP 30 Ca -0.39 -0.37 0.02 0.00 0.02 0.00 0.00 57.03 56.31 2gty h ASP 30 Cb 1.17 -0.10 -0.15 0.00 0.22 0.00 0.00 39.33 40.47 2gty h ASP 30 CO 0.76 1.29 0.31 0.00 -1.72 0.00 0.00 179.24 179.88 2gty s ALA 31 N -2.65 -1.73 -0.02 3.45 0.00 -1.04 -0.93 121.76 118.83 2gty s ALA 31 Ca -0.04 0.91 0.07 0.00 0.00 0.00 0.00 51.96 52.90 2gty s ALA 31 Cb 0.08 0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.60 2gty s ALA 31 CO 0.86 -0.62 -0.24 -1.50 0.00 0.00 0.00 175.76 174.27 2gty s ILE 32 N -2.78 1.88 -0.30 0.00 2.07 -0.34 -1.19 121.20 120.54 2gty s ILE 32 Ca -0.01 -1.01 -0.03 0.00 -1.41 0.00 0.00 60.65 58.19 2gty s ILE 32 Cb -0.01 -1.56 0.04 0.00 0.13 0.00 0.00 42.46 41.06 2gty s ILE 32 CO -0.06 0.53 0.02 -0.63 -1.91 0.00 0.00 174.94 172.89 2gty s ILE 33 N -0.50 3.27 -0.24 2.00 -1.09 0.60 -0.71 121.20 124.53 2gty s ILE 33 Ca 0.07 -1.17 -0.03 0.00 -2.23 0.00 0.00 60.65 57.30 2gty s ILE 33 Cb -0.10 -2.80 0.01 0.00 -1.58 0.00 0.00 42.46 37.99 2gty s ILE 33 CO -0.00 -0.04 -0.05 -0.63 -1.23 0.00 0.00 174.94 172.99 2gty s ILE 34 N 1.33 3.12 -1.49 2.92 -1.09 -0.31 -1.21 121.20 124.47 2gty s ILE 34 Ca -0.02 -0.80 -0.12 0.00 -2.23 0.00 0.00 60.65 57.47 2gty s ILE 34 Cb -0.19 -2.52 0.08 0.00 -1.58 0.00 0.00 42.46 38.25 2gty s ILE 34 CO -0.00 0.28 0.87 0.47 -1.23 0.00 0.00 174.94 175.33 2gty n ASP 35 N 4.73 -4.81 0.00 3.58 9.92 -0.12 -1.19 116.55 128.66 2gty n ASP 35 Ca -0.17 -0.66 0.00 0.00 -0.53 0.00 0.00 54.79 53.43 2gty n ASP 35 Cb 0.49 -3.86 0.00 0.00 -0.64 0.00 0.00 41.12 37.10 2gty n ASP 35 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2gty n GLY 36 N -1.59 1.59 3.63 0.44 0.00 -1.26 -4.98 105.19 103.02 2gty n GLY 36 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2gty n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gty s VAL 37 N -3.13 5.24 -0.15 1.61 1.01 -0.33 -5.05 120.40 119.59 2gty s VAL 37 Ca 0.00 0.46 -0.28 0.00 0.00 0.00 0.00 61.98 62.17 2gty s VAL 37 Cb 0.00 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 2gty s VAL 37 CO 0.00 0.23 0.94 -2.28 0.00 0.00 0.00 175.10 173.99 2gty s HIS 38 N 1.63 3.45 -0.29 5.22 2.46 -1.26 -1.16 115.29 125.34 2gty s HIS 38 Ca 0.13 1.44 0.02 0.00 0.47 0.00 0.00 55.06 57.12 2gty s HIS 38 Cb -0.15 -3.13 0.08 0.00 -0.13 0.00 0.00 32.58 29.25 2gty s HIS 38 CO 0.08 -0.27 -0.00 -1.01 -2.47 0.00 0.00 174.74 171.07 2gty s HIS 39 N 2.26 2.92 -2.36 3.88 3.76 0.11 -5.00 115.29 120.86 2gty s HIS 39 Ca 0.44 -2.30 0.00 0.00 -0.15 0.00 0.00 55.06 53.05 2gty s HIS 39 Cb -0.17 -2.15 0.00 0.00 1.11 0.00 0.00 32.58 31.37 2gty s HIS 39 CO 0.14 -0.87 0.00 0.41 -0.85 0.00 0.00 174.74 173.56 2gty n GLY 40 N 4.51 0.67 0.21 -2.22 0.00 -1.26 -1.20 105.19 105.90 2gty n GLY 40 Ca -0.05 -2.11 -0.01 0.00 0.00 0.00 0.00 46.02 43.85 2gty n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gty n GLY 41 N 0.00 0.53 0.78 -0.02 0.00 -0.11 -4.85 105.19 101.52 2gty n GLY 41 Ca 0.00 -1.92 0.09 0.00 0.00 0.00 0.00 46.02 44.18 2gty n GLY 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gty n SER 42 N -3.00 2.74 -4.06 1.61 3.41 -1.26 -4.56 113.62 108.50 2gty n SER 42 Ca 0.01 -1.80 -0.30 0.00 -0.26 0.00 0.00 58.87 56.52 2gty n SER 42 Cb 0.03 -0.11 0.20 0.00 -0.26 0.00 0.00 64.21 64.08 2gty n SER 42 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2gty s GLY 43 N -1.29 1.68 0.04 5.00 0.00 -1.26 -4.94 107.32 106.53 2gty s GLY 43 Ca 0.25 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.94 2gty s GLY 43 CO 0.22 -0.23 0.00 0.61 0.00 0.00 0.00 173.10 173.70 2gty n GLY 44 N -2.41 -1.84 3.66 0.20 0.00 -1.26 -4.54 105.19 99.00 2gty n GLY 44 Ca 0.14 -1.32 -0.34 0.00 0.00 0.00 0.00 46.02 44.50 2gty n GLY 44 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2gty s ASN 45 N -3.94 5.04 -0.15 1.61 0.01 -0.29 -4.77 114.94 112.46 2gty s ASN 45 Ca 0.00 0.03 -0.26 0.00 -0.71 0.00 0.00 52.86 51.92 2gty s ASN 45 Cb 0.00 -1.34 -0.01 0.00 0.41 0.00 0.00 41.25 40.31 2gty s ASN 45 CO 0.00 0.33 0.87 -0.22 -1.51 0.00 0.00 177.10 176.57 2gty s LEU 46 N -1.18 4.19 0.79 0.60 2.96 -1.26 -1.34 118.68 123.45 2gty s LEU 46 Ca 0.16 1.26 -0.11 0.00 -0.22 0.00 0.00 54.13 55.22 2gty s LEU 46 Cb -0.11 -3.31 0.07 0.00 0.50 0.00 0.00 46.19 43.33 2gty s LEU 46 CO 0.06 -0.41 1.09 -0.94 -1.32 0.00 0.00 176.35 174.83 2gty s SER 47 N 1.13 4.47 0.97 3.68 1.04 0.29 -5.01 113.70 120.28 2gty s SER 47 Ca 0.41 1.45 -0.11 0.00 0.48 0.00 0.00 55.95 58.18 2gty s SER 47 Cb -0.17 -2.20 0.18 0.00 0.10 0.00 0.00 66.02 63.93 2gty s SER 47 CO 0.14 -2.00 1.11 -2.84 0.98 0.00 0.00 173.24 170.62 2gty s PRO 48 N -5.07 0.58 -0.09 4.02 0.02 -1.26 -4.62 135.00 128.58 2gty s PRO 48 Ca 0.61 1.30 -0.16 0.00 0.02 0.00 0.00 61.00 62.76 2gty s PRO 48 Cb -0.15 -1.69 -0.05 0.00 0.02 0.00 0.00 34.50 32.63 2gty s PRO 48 CO 0.55 -2.85 0.43 0.99 -0.33 0.00 0.00 177.00 175.78 2gty s THR 49 N -2.63 5.16 -0.30 0.99 2.01 -1.26 -4.58 115.64 115.02 2gty s THR 49 Ca 0.67 0.85 -0.15 0.00 0.31 0.00 0.00 61.69 63.37 2gty s THR 49 Cb -0.23 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.50 2gty s THR 49 CO 0.60 0.41 0.35 0.12 -0.69 0.00 0.00 174.62 175.41 2gty s PHE 50 N 0.09 3.23 -0.20 4.92 5.36 0.31 -4.94 117.98 126.75 2gty s PHE 50 Ca 0.24 0.20 -0.05 0.00 -0.96 0.00 0.00 56.93 56.35 2gty s PHE 50 Cb -0.15 -2.60 -0.03 0.00 -0.34 0.00 0.00 43.02 39.90 2gty s PHE 50 CO 0.10 -0.31 0.01 0.99 -1.46 0.00 0.00 175.22 174.55 2gty s THR 51 N 2.03 4.06 0.20 0.12 2.01 -1.26 -1.01 115.64 121.78 2gty s THR 51 Ca 0.13 -0.28 -0.30 0.00 0.31 0.00 0.00 61.69 61.55 2gty s THR 51 Cb -0.16 -2.83 -0.08 0.00 0.01 0.00 0.00 72.50 69.43 2gty s THR 51 CO 0.11 0.43 1.20 -0.36 -0.69 0.00 0.00 174.62 175.31 2gty s PHE 52 N 0.93 3.41 0.82 4.92 0.08 -0.32 -5.01 117.98 122.81 2gty s PHE 52 Ca 0.02 1.43 -0.09 0.00 0.12 0.00 0.00 56.93 58.41 2gty s PHE 52 Cb -0.14 -3.44 0.13 0.00 -0.57 0.00 0.00 43.02 39.00 2gty s PHE 52 CO 0.02 -1.22 1.14 0.20 -0.10 0.00 0.00 175.22 175.26 2gty s GLY 53 N 0.02 1.73 0.17 4.36 0.00 -1.26 -4.94 107.32 107.40 2gty s GLY 53 Ca 0.52 -1.19 -0.34 0.00 0.00 0.00 0.00 44.72 43.72 2gty s GLY 53 CO 0.38 -0.60 1.49 1.44 0.00 0.00 0.00 173.10 175.82 2gty n SER 54 N -3.27 2.78 0.00 1.64 7.64 -1.26 -1.46 113.62 119.70 2gty n SER 54 Ca 0.12 1.10 0.00 0.00 1.01 0.00 0.00 58.87 61.11 2gty n SER 54 Cb 0.60 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 2gty n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gty n GLY 55 N 2.95 0.51 3.73 0.23 0.00 -1.26 -5.01 105.19 106.34 2gty n GLY 55 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2gty n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2gty s GLU 56 N -0.35 3.15 0.17 1.61 2.12 -0.54 -4.96 118.70 119.90 2gty s GLU 56 Ca 0.00 -0.34 -0.11 0.00 0.36 0.00 0.00 54.97 54.88 2gty s GLU 56 Cb 0.00 -2.91 0.00 0.00 0.26 0.00 0.00 34.13 31.48 2gty s GLU 56 CO 0.00 0.70 0.35 1.52 -0.54 0.00 0.00 175.26 177.28 2gty s TYR 57 N -0.85 0.24 -0.11 5.30 -0.85 -1.26 -4.70 117.35 115.11 2gty s TYR 57 Ca 0.13 -0.60 -0.30 0.00 -0.52 0.00 0.00 57.07 55.78 2gty s TYR 57 Cb -0.12 0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.27 2gty s TYR 57 CO 0.03 -0.77 1.19 0.42 -1.52 0.00 0.00 175.55 174.90 2gty s ILE 58 N -3.94 4.35 -0.27 -3.49 1.01 -1.26 -1.43 121.20 116.17 2gty s ILE 58 Ca 0.14 1.65 0.12 0.00 0.00 0.00 0.00 60.65 62.56 2gty s ILE 58 Cb 0.02 -4.06 -0.16 0.00 0.01 0.00 0.00 42.46 38.27 2gty s ILE 58 CO -0.01 -0.06 0.37 -1.54 0.00 0.00 0.00 174.94 173.69 2gty n SER 59 N 5.78 1.45 -3.73 3.58 3.41 -0.18 -1.76 113.62 122.17 2gty n SER 59 Ca 0.12 -0.37 -0.13 0.00 -0.26 0.00 0.00 58.87 58.23 2gty n SER 59 Cb 0.46 1.29 -0.10 0.00 -0.26 0.00 0.00 64.21 65.60 2gty n SER 59 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2gty s ASN 60 N -2.78 -0.45 -0.11 4.04 3.84 -1.02 -1.73 114.94 116.73 2gty s ASN 60 Ca -0.00 0.85 -0.11 0.00 0.21 0.00 0.00 52.86 53.81 2gty s ASN 60 Cb 0.08 0.85 0.03 0.00 -0.55 0.00 0.00 41.25 41.66 2gty s ASN 60 CO 0.49 -0.15 0.31 -0.32 -2.79 0.00 0.00 177.10 174.63 2gty s MET 61 N 0.37 0.37 -0.12 0.43 1.75 -0.16 -0.77 119.30 121.18 2gty s MET 61 Ca -0.01 0.39 0.02 0.00 -1.25 0.00 0.00 55.69 54.83 2gty s MET 61 Cb -0.04 0.18 0.02 0.00 2.84 0.00 0.00 34.83 37.83 2gty s MET 61 CO -0.01 -0.05 -0.16 0.99 -0.65 0.00 0.00 175.02 175.14 2gty s THR 62 N 0.08 1.56 -0.11 10.11 2.01 -0.09 -0.15 115.64 129.06 2gty s THR 62 Ca -0.01 -0.67 0.03 0.00 0.31 0.00 0.00 61.69 61.35 2gty s THR 62 Cb -0.02 -1.43 0.00 0.00 0.01 0.00 0.00 72.50 71.06 2gty s THR 62 CO 0.01 0.45 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.53 2gty s ILE 63 N 1.05 2.05 -0.18 1.82 1.01 0.05 -1.34 121.20 125.66 2gty s ILE 63 Ca -0.05 -1.00 -0.09 0.00 0.00 0.00 0.00 60.65 59.51 2gty s ILE 63 Cb -0.15 -1.78 -0.05 0.00 0.01 0.00 0.00 42.46 40.49 2gty s ILE 63 CO -0.03 0.55 0.13 -0.13 0.00 0.00 0.00 174.94 175.46 2gty s ARG 64 N 0.51 3.99 0.09 2.79 0.52 -0.32 -0.91 118.95 125.62 2gty s ARG 64 Ca -0.15 -0.21 -0.13 0.00 -0.52 0.00 0.00 55.73 54.72 2gty s ARG 64 Cb -0.17 -3.35 0.02 0.00 0.52 0.00 0.00 34.95 31.97 2gty s ARG 64 CO 0.05 0.41 0.31 -1.54 0.02 0.00 0.00 175.30 174.56 2gty s SER 65 N 0.03 -0.10 0.00 0.23 1.04 -0.36 0.02 113.70 114.56 2gty s SER 65 Ca 0.09 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.14 2gty s SER 65 Cb -0.11 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2gty s SER 65 CO -0.00 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.07 2gty n GLY 66 N 0.02 2.64 0.21 7.32 0.00 -1.26 -0.79 105.19 113.33 2gty n GLY 66 Ca -0.16 -0.19 0.08 0.00 0.00 0.00 0.00 46.02 45.75 2gty n GLY 66 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gty h ASP 67 N 0.00 0.00 -3.23 1.61 3.32 -2.00 -3.46 116.42 112.66 2gty h ASP 67 Ca 0.00 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.58 2gty h ASP 67 Cb 0.00 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.41 2gty h ASP 67 CO 0.00 0.28 -0.61 -0.31 -1.72 0.00 0.00 179.24 176.88 2gty s TYR 68 N -3.61 1.97 -0.07 4.55 2.02 -1.26 -4.79 117.35 116.16 2gty s TYR 68 Ca 0.01 -0.95 -0.30 0.00 -0.37 0.00 0.00 57.07 55.46 2gty s TYR 68 Cb 0.10 -1.28 -0.03 0.00 -0.40 0.00 0.00 41.96 40.35 2gty s TYR 68 CO 0.66 0.02 1.22 0.42 -1.57 0.00 0.00 175.55 176.30 2gty s ILE 69 N -3.28 4.23 -0.20 2.71 -1.09 -0.20 -4.38 121.20 118.98 2gty s ILE 69 Ca 0.36 1.55 0.16 0.00 -2.23 0.00 0.00 60.65 60.49 2gty s ILE 69 Cb 0.09 -4.00 -0.24 0.00 -1.58 0.00 0.00 42.46 36.73 2gty s ILE 69 CO 0.15 -0.03 0.04 0.47 -1.23 0.00 0.00 174.94 174.35 2gty n ASP 70 N 5.50 0.29 -3.62 3.58 8.00 0.10 -0.57 116.55 129.83 2gty n ASP 70 Ca 0.12 -0.01 -0.14 0.00 0.71 0.00 0.00 54.79 55.47 2gty n ASP 70 Cb 0.46 0.78 -0.07 0.00 -0.02 0.00 0.00 41.12 42.27 2gty n ASP 70 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2gty s ASN 71 N -5.65 -0.70 -0.03 -2.24 3.84 -0.97 -0.65 114.94 108.54 2gty s ASN 71 Ca -0.13 1.32 0.04 0.00 0.21 0.00 0.00 52.86 54.30 2gty s ASN 71 Cb 0.06 1.32 -0.00 0.00 -0.55 0.00 0.00 41.25 42.08 2gty s ASN 71 CO 0.80 -0.26 -0.15 -0.63 -2.79 0.00 0.00 177.10 174.07 2gty s ILE 72 N 0.24 1.26 0.01 -5.21 1.01 -0.58 -1.18 121.20 116.76 2gty s ILE 72 Ca -0.00 -0.63 -0.03 0.00 0.00 0.00 0.00 60.65 59.99 2gty s ILE 72 Cb -0.05 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.33 2gty s ILE 72 CO 0.01 0.37 0.03 -0.55 0.00 0.00 0.00 174.94 174.80 2gty s SER 73 N -0.00 0.14 0.12 3.58 0.15 -0.45 -1.44 113.70 115.81 2gty s SER 73 Ca -0.02 -0.35 -0.12 0.00 0.70 0.00 0.00 55.95 56.16 2gty s SER 73 Cb -0.10 0.14 0.01 0.00 -1.71 0.00 0.00 66.02 64.36 2gty s SER 73 CO 0.01 -0.30 0.31 0.72 1.20 0.00 0.00 173.24 175.18 2gty s PHE 74 N -1.31 0.05 0.08 3.44 -0.12 -0.37 -0.91 117.98 118.85 2gty s PHE 74 Ca -0.14 -0.43 0.08 0.00 -0.05 0.00 0.00 56.93 56.39 2gty s PHE 74 Cb -0.08 0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.36 2gty s PHE 74 CO -0.00 -0.66 -0.21 -2.00 -0.05 0.00 0.00 175.22 172.30 2gty s GLU 75 N -3.86 1.23 0.45 1.99 2.12 0.05 -0.63 118.70 120.05 2gty s GLU 75 Ca 0.07 -1.08 0.06 0.00 0.36 0.00 0.00 54.97 54.38 2gty s GLU 75 Cb 0.03 -1.44 0.01 0.00 0.26 0.00 0.00 34.13 32.99 2gty s GLU 75 CO -0.09 0.35 0.62 0.95 -0.54 0.00 0.00 175.26 176.55 2gty s THR 76 N -1.01 3.10 -0.60 -1.70 -4.23 -0.08 -1.01 115.64 110.11 2gty s THR 76 Ca 0.07 -0.88 0.17 0.00 -1.18 0.00 0.00 61.69 59.87 2gty s THR 76 Cb -0.10 -3.08 0.17 0.00 1.34 0.00 0.00 72.50 70.83 2gty s THR 76 CO 0.03 -0.04 1.52 -0.46 -0.54 0.00 0.00 174.62 175.13 2gty n ASN 77 N -1.97 0.38 -1.14 3.99 6.94 -0.51 -1.48 115.26 121.47 2gty n ASN 77 Ca 0.07 0.63 0.10 0.00 -0.02 0.00 0.00 54.58 55.36 2gty n ASN 77 Cb 0.59 -0.70 0.27 0.00 -2.36 0.00 0.00 39.78 37.58 2gty n ASN 77 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2gty n MET 78 N -1.96 2.71 -0.85 -3.83 2.81 -1.26 -4.96 117.12 109.78 2gty n MET 78 Ca 0.01 -2.46 0.00 0.00 -1.81 0.00 0.00 57.70 53.44 2gty n MET 78 Cb 0.12 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 2gty n MET 78 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gty n GLY 79 N 1.33 0.50 3.84 3.03 0.00 -0.55 -5.05 105.19 108.30 2gty n GLY 79 Ca 0.21 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 2gty n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gty s ARG 80 N -1.27 4.04 -0.04 1.61 0.52 -1.26 -4.85 118.95 117.71 2gty s ARG 80 Ca 0.00 0.57 0.07 0.00 -0.52 0.00 0.00 55.73 55.85 2gty s ARG 80 Cb 0.00 -2.92 -0.02 0.00 0.52 0.00 0.00 34.95 32.53 2gty s ARG 80 CO 0.00 0.46 -0.23 1.03 0.02 0.00 0.00 175.30 176.58 2gty s ARG 81 N -1.96 2.31 -0.13 3.54 0.52 -1.26 -0.90 118.95 121.06 2gty s ARG 81 Ca 0.39 -0.88 0.02 0.00 -0.52 0.00 0.00 55.73 54.74 2gty s ARG 81 Cb -0.15 -2.14 -0.00 0.00 0.52 0.00 0.00 34.95 33.17 2gty s ARG 81 CO 0.19 0.53 -0.19 0.12 0.02 0.00 0.00 175.30 175.97 2gty s PHE 82 N -0.52 2.69 0.00 -0.53 2.19 0.20 -4.99 117.98 117.03 2gty s PHE 82 Ca 0.07 -1.01 0.00 0.00 0.33 0.00 0.00 56.93 56.32 2gty s PHE 82 Cb -0.11 -1.81 0.00 0.00 -1.31 0.00 0.00 43.02 39.79 2gty s PHE 82 CO 0.00 -0.42 0.00 0.41 1.83 0.00 0.00 175.22 177.04 2gty n GLY 83 N 3.76 -1.38 3.77 13.12 0.00 -1.26 -1.23 105.19 121.96 2gty n GLY 83 Ca -0.19 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 2gty n GLY 83 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gty s PRO 84 N 0.00 4.15 -0.09 1.61 0.02 -1.26 -4.88 135.00 134.56 2gty s PRO 84 Ca 0.00 2.52 0.03 0.00 0.02 0.00 0.00 61.00 63.57 2gty s PRO 84 Cb 0.00 -2.99 0.01 0.00 0.02 0.00 0.00 34.50 31.53 2gty s PRO 84 CO 0.00 -0.50 -0.19 0.71 -0.33 0.00 0.00 177.00 176.70 2gty s TYR 85 N -0.93 2.08 -1.99 6.54 2.02 -0.52 -4.99 117.35 119.56 2gty s TYR 85 Ca 0.54 -0.83 0.00 0.00 -0.37 0.00 0.00 57.07 56.41 2gty s TYR 85 Cb -0.46 -1.43 0.00 0.00 -0.40 0.00 0.00 41.96 39.67 2gty s TYR 85 CO 0.59 -0.36 0.00 0.41 -1.57 0.00 0.00 175.55 174.62 2gty n GLY 86 N 3.66 0.64 2.26 0.71 0.00 -1.26 -1.52 105.19 109.68 2gty n GLY 86 Ca -0.21 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 43.64 2gty n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gty n GLY 87 N 0.00 1.98 0.45 -0.02 0.00 0.18 -4.73 105.19 103.05 2gty n GLY 87 Ca 0.00 -2.19 0.05 0.00 0.00 0.00 0.00 46.02 43.88 2gty n GLY 87 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gty n SER 88 N -2.59 2.05 -1.72 1.61 3.41 -1.26 -4.56 113.62 110.57 2gty n SER 88 Ca 0.09 -1.54 0.00 0.00 -0.26 0.00 0.00 58.87 57.16 2gty n SER 88 Cb 0.35 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2gty n SER 88 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gty n GLY 89 N 0.55 0.76 6.31 5.00 0.00 -1.26 -5.01 105.19 111.55 2gty n GLY 89 Ca 0.07 -1.92 0.01 0.00 0.00 0.00 0.00 46.02 44.18 2gty n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gty n GLY 90 N 5.00 -1.51 3.69 -0.02 0.00 -1.26 -4.59 105.19 106.49 2gty n GLY 90 Ca 0.00 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.47 2gty n GLY 90 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gty s SER 91 N -4.10 5.38 0.00 1.61 0.01 0.03 -4.81 113.70 111.82 2gty s SER 91 Ca 0.00 0.16 -0.16 0.00 1.31 0.00 0.00 55.95 57.25 2gty s SER 91 Cb 0.00 -1.62 -0.06 0.00 0.21 0.00 0.00 66.02 64.56 2gty s SER 91 CO 0.00 0.35 0.46 0.00 0.41 0.00 0.00 173.24 174.45 2gty s ALA 92 N -0.69 3.64 -0.01 1.44 0.00 -1.26 -1.23 121.76 123.66 2gty s ALA 92 Ca 0.11 -0.15 0.02 0.00 0.00 0.00 0.00 51.96 51.94 2gty s ALA 92 Cb -0.12 -2.49 -0.00 0.00 0.00 0.00 0.00 23.12 20.52 2gty s ALA 92 CO 0.02 0.39 -0.05 -0.80 0.00 0.00 0.00 175.76 175.32 2gty s ASN 93 N -0.84 0.65 -0.05 0.00 -0.87 -0.09 -4.99 114.94 108.74 2gty s ASN 93 Ca 0.25 -0.10 0.06 0.00 -1.57 0.00 0.00 52.86 51.51 2gty s ASN 93 Cb -0.17 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.25 40.94 2gty s ASN 93 CO 0.14 0.05 -0.25 -0.89 -2.57 0.00 0.00 177.10 173.59 2gty s THR 94 N 0.02 2.00 -0.22 1.60 2.01 -1.26 -0.77 115.64 119.02 2gty s THR 94 Ca 0.00 -1.05 -0.10 0.00 0.31 0.00 0.00 61.69 60.86 2gty s THR 94 Cb -0.04 -1.68 -0.05 0.00 0.01 0.00 0.00 72.50 70.74 2gty s THR 94 CO -0.00 0.56 0.13 -0.76 -0.69 0.00 0.00 174.62 173.86 2gty s LEU 95 N -0.24 4.09 0.07 4.42 1.43 0.79 -4.96 118.68 124.27 2gty s LEU 95 Ca -0.01 0.14 0.06 0.00 -1.03 0.00 0.00 54.13 53.30 2gty s LEU 95 Cb -0.13 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 2gty s LEU 95 CO 0.03 0.13 -0.17 -0.94 0.23 0.00 0.00 176.35 175.62 2gty s SER 96 N 0.69 2.02 -1.23 2.29 1.04 -1.26 -0.99 113.70 116.26 2gty s SER 96 Ca 0.07 -0.59 -0.06 0.00 0.48 0.00 0.00 55.95 55.85 2gty s SER 96 Cb -0.12 -0.11 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 2gty s SER 96 CO 0.01 0.02 0.74 -3.20 0.98 0.00 0.00 173.24 171.79 2gty n ASN 97 N 1.44 -2.95 -4.74 7.02 5.15 -0.98 -4.73 115.26 115.46 2gty n ASN 97 Ca -0.19 -0.87 -0.31 0.00 -0.60 0.00 0.00 54.58 52.61 2gty n ASN 97 Cb 0.54 -3.99 -0.08 0.00 -0.53 0.00 0.00 39.78 35.72 2gty n ASN 97 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2gty s VAL 98 N -3.59 1.39 -0.19 3.44 -7.23 -0.71 -0.72 120.40 112.79 2gty s VAL 98 Ca 0.19 -1.97 -0.03 0.00 -1.81 0.00 0.00 61.98 58.36 2gty s VAL 98 Cb -0.05 -2.36 0.06 0.00 0.56 0.00 0.00 36.38 34.59 2gty s VAL 98 CO 0.82 0.00 0.03 -0.75 -0.31 0.00 0.00 175.10 174.89 2gty s LYS 99 N -3.86 0.70 0.05 4.82 2.20 -0.26 -4.06 119.74 119.34 2gty s LYS 99 Ca 0.14 -0.43 -0.31 0.00 -0.36 0.00 0.00 55.97 55.01 2gty s LYS 99 Cb 0.03 -2.09 -0.06 0.00 -1.51 0.00 0.00 37.83 34.20 2gty s LYS 99 CO 0.07 -0.63 1.26 0.08 -0.36 0.00 0.00 175.35 175.78 2gty s VAL 100 N 1.84 3.89 -0.23 4.02 1.01 -0.72 -0.72 120.40 129.49 2gty s VAL 100 Ca -0.01 1.34 -0.09 0.00 0.00 0.00 0.00 61.98 63.22 2gty s VAL 100 Cb -0.17 -3.86 -0.17 0.00 0.00 0.00 0.00 36.38 32.18 2gty s VAL 100 CO -0.08 0.08 -0.09 -0.38 0.00 0.00 0.00 175.10 174.63 2gty n ILE 101 N 4.10 1.56 -3.68 2.22 2.08 0.87 -4.65 119.36 121.87 2gty n ILE 101 Ca 0.10 -0.44 -0.13 0.00 0.56 0.00 0.00 62.75 62.85 2gty n ILE 101 Cb 0.45 -1.73 -0.07 0.00 -0.75 0.00 0.00 39.64 37.55 2gty n ILE 101 CO 0.00 0.00 0.00 -1.58 0.56 0.00 0.00 176.55 175.53 2gty s GLN 102 N -2.50 0.89 -0.20 0.38 2.00 -0.96 -4.57 119.66 114.70 2gty s GLN 102 Ca -0.33 -0.33 0.01 0.00 -2.00 0.00 0.00 55.36 52.71 2gty s GLN 102 Cb 0.10 0.40 0.05 0.00 0.80 0.00 0.00 33.01 34.35 2gty s GLN 102 CO 0.59 -0.30 -0.09 0.42 -0.50 0.00 0.00 175.29 175.42 2gty s ILE 103 N -2.30 1.58 0.55 -2.34 1.01 -1.26 -1.01 121.20 117.43 2gty s ILE 103 Ca -0.06 -1.02 0.05 0.00 0.00 0.00 0.00 60.65 59.61 2gty s ILE 103 Cb -0.01 -1.70 0.04 0.00 0.01 0.00 0.00 42.46 40.79 2gty s ILE 103 CO -0.01 0.11 0.37 0.20 0.00 0.00 0.00 174.94 175.61 2gty s ASN 104 N 1.41 4.58 0.00 3.58 0.01 -0.23 -4.98 114.94 119.32 2gty s ASN 104 Ca -0.02 -1.30 0.00 0.00 -0.71 0.00 0.00 52.86 50.83 2gty s ASN 104 Cb -0.17 0.48 0.00 0.00 0.41 0.00 0.00 41.25 41.97 2gty s ASN 104 CO -0.08 -1.11 0.00 0.61 -1.51 0.00 0.00 177.10 175.01 2gty n GLY 105 N -1.74 -0.74 2.89 0.66 0.00 -1.26 -0.31 105.19 104.69 2gty n GLY 105 Ca -0.03 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 2gty n GLY 105 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2gty s SER 106 N -4.00 0.16 -0.05 1.61 0.15 -0.32 -4.91 113.70 106.34 2gty s SER 106 Ca 0.00 -0.03 -0.15 0.00 0.70 0.00 0.00 55.95 56.46 2gty s SER 106 Cb 0.00 -0.01 0.03 0.00 -1.71 0.00 0.00 66.02 64.33 2gty s SER 106 CO 0.00 0.01 0.35 0.00 1.20 0.00 0.00 173.24 174.80 2gty s ALA 107 N -0.06 -0.89 0.00 5.45 0.00 -1.26 -1.60 121.76 123.39 2gty s ALA 107 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.56 2gty s ALA 107 Cb -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.99 2gty s ALA 107 CO -0.00 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.92 2gty n GLY 108 N 1.70 2.26 0.25 0.00 0.00 -1.26 -4.81 105.19 103.33 2gty n GLY 108 Ca -0.19 -0.16 0.15 0.00 0.00 0.00 0.00 46.02 45.82 2gty n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gty h ASP 109 N 0.00 0.00 -3.88 1.61 3.32 -1.90 -3.09 116.42 112.48 2gty h ASP 109 Ca 0.00 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.63 2gty h ASP 109 Cb 0.00 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.41 2gty h ASP 109 CO 0.00 0.00 -0.60 -0.31 -1.72 0.00 0.00 179.24 176.61 2gty s TYR 110 N -3.47 1.74 -0.59 4.55 2.02 -1.26 -1.71 117.35 118.64 2gty s TYR 110 Ca 0.04 -1.11 -0.22 0.00 -0.37 0.00 0.00 57.07 55.40 2gty s TYR 110 Cb 0.07 -1.08 0.06 0.00 -0.40 0.00 0.00 41.96 40.62 2gty s TYR 110 CO 0.59 -0.21 0.90 -1.17 -1.57 0.00 0.00 175.55 174.09 2gty s LEU 111 N -3.42 4.41 -0.04 -1.29 2.96 -0.24 -4.41 118.68 116.64 2gty s LEU 111 Ca 0.36 -0.76 -0.20 0.00 -0.22 0.00 0.00 54.13 53.30 2gty s LEU 111 Cb 0.07 -2.57 -0.32 0.00 0.50 0.00 0.00 46.19 43.88 2gty s LEU 111 CO 0.15 -1.27 0.87 0.44 -1.32 0.00 0.00 176.35 175.22 2gty h ASP 112 N 9.38 0.52 -5.08 3.68 3.32 -1.60 -0.51 116.42 126.13 2gty h ASP 112 Ca -0.28 -0.94 -0.05 0.00 0.02 0.00 0.00 57.03 55.78 2gty h ASP 112 Cb 1.08 -0.17 -0.13 0.00 0.22 0.00 0.00 39.33 40.33 2gty h ASP 112 CO 1.11 1.47 -0.07 -0.94 -1.72 0.00 0.00 179.24 179.09 2gty s SER 113 N -7.08 -0.24 0.07 6.45 1.04 -0.82 -3.51 113.70 109.61 2gty s SER 113 Ca -0.14 -0.32 0.06 0.00 0.48 0.00 0.00 55.95 56.04 2gty s SER 113 Cb 0.02 0.47 -0.03 0.00 0.10 0.00 0.00 66.02 66.58 2gty s SER 113 CO 0.84 -0.85 -0.17 -0.76 0.98 0.00 0.00 173.24 173.28 2gty s LEU 114 N -2.80 2.24 -0.24 2.42 1.43 -1.26 -1.18 118.68 119.29 2gty s LEU 114 Ca 0.03 -0.58 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2gty s LEU 114 Cb 0.02 -0.72 0.06 0.00 0.03 0.00 0.00 46.19 45.58 2gty s LEU 114 CO -0.12 0.03 -0.05 -0.62 0.23 0.00 0.00 176.35 175.82 2gty s ASP 115 N -1.56 3.90 -0.22 2.29 -1.08 0.58 -4.90 116.67 115.68 2gty s ASP 115 Ca 0.03 -1.22 -0.09 0.00 -0.52 0.00 0.00 52.55 50.75 2gty s ASP 115 Cb -0.09 -1.19 -0.04 0.00 -1.46 0.00 0.00 42.92 40.13 2gty s ASP 115 CO 0.03 -0.24 0.11 -0.63 0.52 0.00 0.00 175.17 174.96 2gty s ILE 116 N 1.38 5.08 -0.16 4.11 -1.09 -1.26 -1.06 121.20 128.20 2gty s ILE 116 Ca -0.05 0.08 -0.06 0.00 -2.23 0.00 0.00 60.65 58.39 2gty s ILE 116 Cb -0.19 -3.34 -0.04 0.00 -1.58 0.00 0.00 42.46 37.32 2gty s ILE 116 CO -0.07 0.40 0.03 -0.31 -1.23 0.00 0.00 174.94 173.76 2gty s TYR 117 N 0.79 3.20 0.09 3.97 2.02 -0.18 -5.00 117.35 122.25 2gty s TYR 117 Ca 0.06 0.04 -0.24 0.00 -0.37 0.00 0.00 57.07 56.55 2gty s TYR 117 Cb -0.13 -1.99 0.07 0.00 -0.40 0.00 0.00 41.96 39.50 2gty s TYR 117 CO 0.02 0.20 0.60 1.52 -1.57 0.00 0.00 175.55 176.32 2gty s TYR 118 N 0.07 -0.53 -0.06 2.71 1.13 -1.26 -0.09 117.35 119.31 2gty s TYR 118 Ca 0.04 0.51 -0.23 0.00 -1.41 0.00 0.00 57.07 55.98 2gty s TYR 118 Cb -0.13 0.48 -0.04 0.00 -1.10 0.00 0.00 41.96 41.17 2gty s TYR 118 CO 0.01 -0.76 0.67 -1.21 -2.51 0.00 0.00 175.55 171.76 2gty s GLU 119 N -2.98 4.42 -0.28 -3.49 0.41 0.11 -4.92 118.70 111.97 2gty s GLU 119 Ca -0.03 0.84 -0.10 0.00 -0.41 0.00 0.00 54.97 55.27 2gty s GLU 119 Cb -0.01 -3.43 -0.04 0.00 -1.78 0.00 0.00 34.13 28.87 2gty s GLU 119 CO -0.06 0.11 0.16 -1.14 -0.49 0.00 0.00 175.26 173.84 2gty s GLN 120 N 0.67 3.78 0.00 1.61 2.00 -1.26 -1.10 119.66 125.36 2gty s GLN 120 Ca 0.36 -0.43 0.21 0.00 -2.00 0.00 0.00 55.36 53.51 2gty s GLN 120 Cb -0.18 -3.59 0.17 0.00 0.80 0.00 0.00 33.01 30.22 2gty s GLN 120 CO 0.17 -0.23 1.18 0.66 -0.50 0.00 0.00 175.29 176.57