#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p6s s ASN 2 N 0.00 6.83 -1.26 7.83 -0.87 -1.26 -4.99 114.94 121.22 1p6s s ASN 2 Ca 0.00 0.99 -0.13 0.00 -1.57 0.00 0.00 52.86 52.16 1p6s s ASN 2 Cb 0.00 -2.37 0.15 0.00 -0.02 0.00 0.00 41.25 39.02 1p6s s ASN 2 CO 0.00 -0.15 1.67 1.21 -2.57 0.00 0.00 177.10 177.25 1p6s n GLU 3 N 4.22 3.41 -5.00 -0.60 2.13 -1.26 -4.95 120.64 118.59 1p6s n GLU 3 Ca -0.02 -3.61 -0.27 0.00 0.66 0.00 0.00 57.16 53.92 1p6s n GLU 3 Cb 0.51 -3.06 -0.16 0.00 0.27 0.00 0.00 31.44 29.00 1p6s n GLU 3 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1p6s s VAL 4 N 1.52 1.62 0.55 6.31 1.01 -1.26 -5.06 120.40 125.09 1p6s s VAL 4 Ca 0.43 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.58 1p6s s VAL 4 Cb 0.03 -1.35 0.04 0.00 0.00 0.00 0.00 36.38 35.10 1p6s s VAL 4 CO 0.01 0.46 0.31 -0.44 0.00 0.00 0.00 175.10 175.43 1p6s s SER 5 N -0.41 4.50 0.18 3.32 0.01 -1.26 -4.88 113.70 115.15 1p6s s SER 5 Ca 0.06 -1.40 -0.29 0.00 1.31 0.00 0.00 55.95 55.64 1p6s s SER 5 Cb -0.09 0.58 -0.08 0.00 0.21 0.00 0.00 66.02 66.64 1p6s s SER 5 CO -0.00 -1.11 0.90 -0.69 0.41 0.00 0.00 173.24 172.75 1p6s s VAL 6 N -2.83 4.30 -0.26 3.43 1.01 -1.26 -1.39 120.40 123.40 1p6s s VAL 6 Ca 0.24 1.97 -0.16 0.00 0.00 0.00 0.00 61.98 64.03 1p6s s VAL 6 Cb -0.02 -4.27 -0.14 0.00 0.00 0.00 0.00 36.38 31.95 1p6s s VAL 6 CO 0.15 0.45 -0.18 -0.38 0.00 0.00 0.00 175.10 175.14 1p6s n ILE 7 N 1.95 1.53 -3.96 2.22 2.08 0.15 -4.83 119.36 118.50 1p6s n ILE 7 Ca -0.02 -0.29 -0.14 0.00 0.56 0.00 0.00 62.75 62.87 1p6s n ILE 7 Cb 0.48 -1.92 -0.14 0.00 -0.75 0.00 0.00 39.64 37.31 1p6s n ILE 7 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1p6s s LYS 8 N -2.47 0.15 -0.04 0.38 -0.14 -1.05 -5.01 119.74 111.57 1p6s s LYS 8 Ca -0.36 -0.04 0.03 0.00 -1.36 0.00 0.00 55.97 54.24 1p6s s LYS 8 Cb 0.12 -0.18 0.00 0.00 -1.68 0.00 0.00 37.83 36.10 1p6s s LYS 8 CO 0.53 0.02 -0.13 -1.21 -0.76 0.00 0.00 175.35 173.79 1p6s s GLU 9 N 0.10 1.47 0.14 1.68 2.02 -1.26 -0.11 118.70 122.74 1p6s s GLU 9 Ca -0.01 -0.46 -0.25 0.00 0.02 0.00 0.00 54.97 54.27 1p6s s GLU 9 Cb -0.02 -1.29 0.07 0.00 0.10 0.00 0.00 34.13 32.99 1p6s s GLU 9 CO -0.00 0.16 0.99 0.20 0.02 0.00 0.00 175.26 176.63 1p6s s GLY 10 N 0.21 -0.21 -0.18 -1.39 0.00 -0.28 -5.02 107.32 100.45 1p6s s GLY 10 Ca -0.06 0.13 -0.08 0.00 0.00 0.00 0.00 44.72 44.71 1p6s s GLY 10 CO 0.02 0.19 0.10 -0.98 0.00 0.00 0.00 173.10 172.42 1p6s s TRP 11 N -3.12 3.36 0.25 1.90 0.52 -1.26 0.34 118.94 120.92 1p6s s TRP 11 Ca 0.13 0.24 0.09 0.00 0.02 0.00 0.00 56.10 56.58 1p6s s TRP 11 Cb -0.01 -2.08 -0.05 0.00 -1.15 0.00 0.00 33.47 30.18 1p6s s TRP 11 CO 0.02 0.30 -0.14 -0.51 0.02 0.00 0.00 176.95 176.65 1p6s s LEU 12 N 0.11 2.56 -0.18 2.99 1.43 0.96 -3.34 118.68 123.21 1p6s s LEU 12 Ca 0.07 -1.07 -0.05 0.00 -1.03 0.00 0.00 54.13 52.06 1p6s s LEU 12 Cb -0.12 -0.79 -0.03 0.00 0.03 0.00 0.00 46.19 45.29 1p6s s LEU 12 CO -0.00 -0.16 -0.01 -1.00 0.23 0.00 0.00 176.35 175.41 1p6s s HIS 13 N -2.85 3.04 -0.01 0.29 3.76 0.16 0.49 115.29 120.17 1p6s s HIS 13 Ca 0.26 -0.37 0.07 0.00 -0.15 0.00 0.00 55.06 54.87 1p6s s HIS 13 Cb -0.01 -2.03 -0.02 0.00 1.11 0.00 0.00 32.58 31.63 1p6s s HIS 13 CO 0.10 -0.14 -0.22 0.21 -0.85 0.00 0.00 174.74 173.84 1p6s s LYS 14 N 0.72 1.80 -0.20 1.40 2.47 -0.41 0.14 119.74 125.66 1p6s s LYS 14 Ca -0.01 -0.81 -0.29 0.00 -1.56 0.00 0.00 55.97 53.30 1p6s s LYS 14 Cb -0.14 -1.75 -0.01 0.00 -1.46 0.00 0.00 37.83 34.47 1p6s s LYS 14 CO 0.02 0.48 1.33 0.50 0.16 0.00 0.00 175.35 177.84 1p6s s ARG 15 N -0.57 4.12 -0.39 4.03 3.52 -1.26 -1.42 118.95 126.97 1p6s s ARG 15 Ca 0.09 1.59 0.11 0.00 -0.13 0.00 0.00 55.73 57.38 1p6s s ARG 15 Cb -0.09 -3.83 0.38 0.00 -1.56 0.00 0.00 34.95 29.85 1p6s s ARG 15 CO -0.01 -0.87 1.08 0.41 -0.81 0.00 0.00 175.30 175.11 1p6s n GLY 16 N 3.90 1.60 3.17 8.12 0.00 -0.76 -4.96 105.19 116.26 1p6s n GLY 16 Ca 0.15 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 1p6s n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p6s s GLU 17 N -0.98 0.73 0.62 1.61 2.02 -1.26 -4.92 118.70 116.52 1p6s s GLU 17 Ca 0.27 -0.85 0.36 0.00 0.02 0.00 0.00 54.97 54.76 1p6s s GLU 17 Cb 0.37 0.29 2.03 0.00 0.10 0.00 0.00 34.13 36.93 1p6s s GLU 17 CO -0.05 -0.21 2.28 0.10 0.02 0.00 0.00 175.26 177.40 1p6s h TYR 18 N 3.16 0.00 -0.56 1.61 -0.00 -2.00 -1.91 116.97 117.27 1p6s h TYR 18 Ca -0.33 0.00 -0.18 0.00 0.00 0.00 0.00 58.73 58.21 1p6s h TYR 18 Cb 1.19 0.00 -0.11 0.00 0.00 0.00 0.00 36.73 37.81 1p6s h TYR 18 CO 0.48 0.01 0.16 1.51 -0.00 0.00 0.00 178.16 180.32 1p6s n ILE 19 N -3.50 2.72 -3.43 -0.90 3.06 -1.26 -4.95 119.36 111.11 1p6s n ILE 19 Ca -0.03 -1.98 -0.17 0.00 -2.50 0.00 0.00 62.75 58.07 1p6s n ILE 19 Cb 0.10 -0.34 0.08 0.00 0.54 0.00 0.00 39.64 40.02 1p6s n ILE 19 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 1p6s n LYS 20 N -0.56 -5.73 -3.88 9.51 3.00 -0.72 -5.00 118.16 114.79 1p6s n LYS 20 Ca 0.36 0.83 -0.32 0.00 -0.00 0.00 0.00 58.31 59.18 1p6s n LYS 20 Cb 1.22 -5.79 -0.04 0.00 0.00 0.00 0.00 35.03 30.42 1p6s n LYS 20 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1p6s s THR 21 N -3.39 5.37 -0.34 3.15 2.01 -1.26 -4.95 115.64 116.23 1p6s s THR 21 Ca 0.08 -0.24 -0.12 0.00 0.31 0.00 0.00 61.69 61.72 1p6s s THR 21 Cb -0.01 -3.60 -0.00 0.00 0.01 0.00 0.00 72.50 68.90 1p6s s THR 21 CO 0.74 0.20 0.21 0.26 -0.69 0.00 0.00 174.62 175.35 1p6s s TRP 22 N -1.45 3.22 0.03 4.92 0.52 -1.26 -1.83 118.94 123.08 1p6s s TRP 22 Ca 0.33 -0.49 -0.01 0.00 0.02 0.00 0.00 56.10 55.96 1p6s s TRP 22 Cb -0.13 -2.45 -0.04 0.00 -1.15 0.00 0.00 33.47 29.71 1p6s s TRP 22 CO 0.24 -0.46 0.17 1.03 0.02 0.00 0.00 176.95 177.95 1p6s s ARG 23 N 1.66 3.32 0.18 4.98 1.81 -0.51 -4.77 118.95 125.63 1p6s s ARG 23 Ca 0.05 -0.44 -0.30 0.00 -1.72 0.00 0.00 55.73 53.32 1p6s s ARG 23 Cb -0.18 -3.00 -0.08 0.00 -0.45 0.00 0.00 34.95 31.24 1p6s s ARG 23 CO 0.08 0.63 1.19 -1.25 -0.68 0.00 0.00 175.30 175.27 1p6s s PRO 24 N -2.20 4.50 -0.00 3.54 0.04 -1.26 -1.28 135.00 138.33 1p6s s PRO 24 Ca 0.30 1.86 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1p6s s PRO 24 Cb -0.13 -3.24 -0.00 0.00 0.04 0.00 0.00 34.50 31.17 1p6s s PRO 24 CO 0.22 -0.07 -0.02 1.03 0.04 0.00 0.00 177.00 178.21 1p6s s ARG 25 N -0.26 0.13 -0.48 4.56 3.00 0.18 -4.60 118.95 121.48 1p6s s ARG 25 Ca 0.52 -0.06 -0.29 0.00 0.00 0.00 0.00 55.73 55.91 1p6s s ARG 25 Cb -0.32 -0.12 0.03 0.00 0.00 0.00 0.00 34.95 34.54 1p6s s ARG 25 CO 0.36 0.03 1.14 -0.47 0.00 0.00 0.00 175.30 176.36 1p6s s TYR 26 N -0.04 2.81 -0.16 -0.53 5.04 -0.89 -0.03 117.35 123.55 1p6s s TYR 26 Ca 0.00 0.69 -0.08 0.00 -2.44 0.00 0.00 57.07 55.25 1p6s s TYR 26 Cb -0.01 -4.44 -0.04 0.00 0.35 0.00 0.00 41.96 37.82 1p6s s TYR 26 CO -0.00 -1.29 0.12 -0.06 -1.34 0.00 0.00 175.55 172.98 1p6s s PHE 27 N 4.47 3.46 -0.04 4.97 0.40 0.15 -0.77 117.98 130.62 1p6s s PHE 27 Ca 0.48 0.38 0.04 0.00 -0.60 0.00 0.00 56.93 57.23 1p6s s PHE 27 Cb -0.07 -2.03 -0.00 0.00 0.51 0.00 0.00 43.02 41.42 1p6s s PHE 27 CO 0.32 0.48 -0.17 -0.51 0.70 0.00 0.00 175.22 176.04 1p6s s LEU 28 N -0.33 1.91 -0.11 -0.37 1.02 0.89 -1.12 118.68 120.57 1p6s s LEU 28 Ca 0.11 -0.35 0.00 0.00 0.02 0.00 0.00 54.13 53.91 1p6s s LEU 28 Cb -0.12 -0.97 -0.02 0.00 0.02 0.00 0.00 46.19 45.10 1p6s s LEU 28 CO 0.01 0.15 -0.11 -0.22 0.02 0.00 0.00 176.35 176.20 1p6s s LEU 29 N 0.06 2.85 0.53 1.79 0.20 0.84 0.40 118.68 125.35 1p6s s LEU 29 Ca -0.04 -0.23 0.08 0.00 0.69 0.00 0.00 54.13 54.63 1p6s s LEU 29 Cb -0.12 -1.63 0.05 0.00 -0.43 0.00 0.00 46.19 44.07 1p6s s LEU 29 CO 0.02 0.23 0.63 -0.54 -0.29 0.00 0.00 176.35 176.41 1p6s s LYS 30 N -0.05 2.39 0.00 1.98 -0.14 -0.60 0.33 119.74 123.64 1p6s s LYS 30 Ca -0.02 -1.67 0.29 0.00 -1.36 0.00 0.00 55.97 53.22 1p6s s LYS 30 Cb -0.14 -2.50 1.34 0.00 -1.68 0.00 0.00 37.83 34.85 1p6s s LYS 30 CO 0.04 -0.66 1.91 0.45 -0.76 0.00 0.00 175.35 176.33 1p6s n SER 31 N -2.01 0.81 -1.06 2.83 2.88 -0.48 -3.66 113.62 112.93 1p6s n SER 31 Ca 0.09 -1.14 0.11 0.00 -1.33 0.00 0.00 58.87 56.61 1p6s n SER 31 Cb 0.62 -0.01 0.25 0.00 -0.75 0.00 0.00 64.21 64.32 1p6s n SER 31 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1p6s n ASP 32 N -0.44 3.17 -0.09 -3.46 2.03 -1.26 -4.88 116.55 111.61 1p6s n ASP 32 Ca 0.19 -1.95 0.00 0.00 0.52 0.00 0.00 54.79 53.55 1p6s n ASP 32 Cb 0.26 -0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 1p6s n ASP 32 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1p6s n GLY 33 N 1.45 0.75 3.26 0.27 0.00 -1.24 -4.85 105.19 104.84 1p6s n GLY 33 Ca 0.19 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 1p6s n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p6s s SER 34 N -2.81 2.93 -0.13 1.61 1.04 -1.26 -0.74 113.70 114.35 1p6s s SER 34 Ca 0.00 -0.48 -0.01 0.00 0.48 0.00 0.00 55.95 55.95 1p6s s SER 34 Cb 0.00 -0.63 -0.02 0.00 0.10 0.00 0.00 66.02 65.47 1p6s s SER 34 CO 0.00 0.26 -0.10 0.12 0.98 0.00 0.00 173.24 174.50 1p6s s PHE 35 N -0.30 2.88 -0.19 5.02 2.19 0.12 -1.56 117.98 126.14 1p6s s PHE 35 Ca 0.01 -0.45 -0.07 0.00 0.33 0.00 0.00 56.93 56.76 1p6s s PHE 35 Cb -0.12 -1.85 -0.04 0.00 -1.31 0.00 0.00 43.02 39.70 1p6s s PHE 35 CO 0.02 -0.08 0.05 0.42 1.83 0.00 0.00 175.22 177.45 1p6s s ILE 36 N 0.19 4.53 -0.10 3.12 1.09 0.16 0.13 121.20 130.31 1p6s s ILE 36 Ca -0.06 -0.12 0.01 0.00 -1.10 0.00 0.00 60.65 59.38 1p6s s ILE 36 Cb -0.15 -3.05 -0.02 0.00 -1.06 0.00 0.00 42.46 38.18 1p6s s ILE 36 CO 0.04 0.44 -0.12 -0.83 -0.10 0.00 0.00 174.94 174.37 1p6s s GLY 37 N 0.65 1.57 -0.09 6.18 0.00 0.64 -0.08 107.32 116.20 1p6s s GLY 37 Ca 0.02 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.85 1p6s s GLY 37 CO 0.02 -0.38 -0.13 -0.19 0.00 0.00 0.00 173.10 172.41 1p6s s TYR 38 N -0.06 2.77 0.18 1.90 2.02 0.05 -2.18 117.35 122.02 1p6s s TYR 38 Ca -0.02 -0.42 0.08 0.00 -0.37 0.00 0.00 57.07 56.35 1p6s s TYR 38 Cb -0.14 -1.75 -0.00 0.00 -0.40 0.00 0.00 41.96 39.67 1p6s s TYR 38 CO 0.04 -0.03 1.40 1.57 -1.57 0.00 0.00 175.55 176.96 1p6s h LYS 39 N 6.08 0.00 -1.01 -0.62 2.10 -1.88 -2.35 116.57 118.89 1p6s h LYS 39 Ca -0.35 0.00 0.21 0.00 -2.00 0.00 0.00 60.65 58.51 1p6s h LYS 39 Cb 1.19 0.00 -0.34 0.00 -0.90 0.00 0.00 32.23 32.18 1p6s h LYS 39 CO 0.53 0.86 0.86 -2.00 -2.00 0.00 0.00 179.45 177.70 1p6s s GLU 40 N -3.04 0.01 0.00 0.07 -6.30 -1.26 -4.66 118.70 103.52 1p6s s GLU 40 Ca 0.00 0.01 0.00 0.00 -2.50 0.00 0.00 54.97 52.48 1p6s s GLU 40 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 34.13 34.24 1p6s s GLU 40 CO 0.80 -0.00 0.00 2.89 0.02 0.00 0.00 175.26 178.97 1p6s n ARG 41 N 2.29 0.00 -2.88 4.30 1.85 -1.26 -5.04 116.66 115.92 1p6s n ARG 41 Ca -0.14 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.30 1p6s n ARG 41 Cb 0.56 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.94 1p6s n ARG 41 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1p6s s PRO 42 N -2.00 4.33 0.45 2.89 0.04 -1.26 -4.94 135.00 134.51 1p6s s PRO 42 Ca 0.00 1.05 0.22 0.00 0.04 0.00 0.00 61.00 62.32 1p6s s PRO 42 Cb 0.00 -3.56 1.09 0.00 0.04 0.00 0.00 34.50 32.07 1p6s s PRO 42 CO 0.00 -0.29 1.93 1.05 0.04 0.00 0.00 177.00 179.73 1p6s h GLU 43 N 7.25 0.00 -1.98 4.56 9.09 -1.99 -3.47 114.58 128.04 1p6s h GLU 43 Ca -0.31 0.00 0.20 0.00 0.05 0.00 0.00 59.36 59.31 1p6s h GLU 43 Cb 1.14 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 28.14 1p6s h GLU 43 CO 0.83 0.23 -0.67 0.00 0.05 0.00 0.00 179.01 179.45 1p6s n ALA 44 N -2.31 -2.16 -0.09 1.06 0.00 -1.26 -4.56 120.51 111.19 1p6s n ALA 44 Ca -0.01 0.50 -0.13 0.00 0.00 0.00 0.00 53.44 53.79 1p6s n ALA 44 Cb 0.35 -0.88 -0.04 0.00 0.00 0.00 0.00 19.45 18.88 1p6s n ALA 44 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1p6s h PRO 45 N -0.80 0.73 0.00 0.00 0.13 -2.03 -3.43 132.00 126.60 1p6s h PRO 45 Ca -0.10 -0.40 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1p6s h PRO 45 Cb 0.78 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1p6s h PRO 45 CO 0.04 1.02 0.00 -3.47 -0.23 0.00 0.00 178.00 175.36 1p6s n ASP 46 N -4.23 0.00 -2.69 1.44 2.03 -1.26 -5.08 116.55 106.77 1p6s n ASP 46 Ca -0.04 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.22 1p6s n ASP 46 Cb 0.49 0.00 0.10 0.00 -0.72 0.00 0.00 41.12 40.99 1p6s n ASP 46 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1p6s n GLN 47 N 0.00 0.41 -2.10 -0.67 0.00 -1.26 -5.02 117.38 108.73 1p6s n GLN 47 Ca 0.00 -1.08 -0.38 0.00 -0.00 0.00 0.00 57.00 55.53 1p6s n GLN 47 Cb 0.00 -0.47 0.03 0.00 0.00 0.00 0.00 30.24 29.80 1p6s n GLN 47 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 1p6s n THR 48 N 0.67 3.77 -4.92 1.69 5.66 -1.26 -4.96 114.28 114.93 1p6s n THR 48 Ca -0.01 -4.62 -0.33 0.00 -3.05 0.00 0.00 64.05 56.04 1p6s n THR 48 Cb 0.73 -1.29 -0.14 0.00 -1.55 0.00 0.00 70.33 68.08 1p6s n THR 48 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1p6s s LEU 49 N -4.04 2.58 0.54 1.09 2.01 -1.26 -5.08 118.68 114.51 1p6s s LEU 49 Ca 0.50 -0.33 -0.18 0.00 0.01 0.00 0.00 54.13 54.13 1p6s s LEU 49 Cb 0.40 -1.54 -0.06 0.00 0.01 0.00 0.00 46.19 44.99 1p6s s LEU 49 CO -0.35 0.23 1.03 -2.16 1.01 0.00 0.00 176.35 176.11 1p6s s PRO 50 N -0.06 3.64 0.65 1.29 0.04 -1.26 -5.03 135.00 134.27 1p6s s PRO 50 Ca -0.03 1.20 -0.15 0.00 0.04 0.00 0.00 61.00 62.05 1p6s s PRO 50 Cb -0.14 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 1p6s s PRO 50 CO 0.04 -0.54 1.10 -1.25 0.04 0.00 0.00 177.00 176.39 1p6s s PRO 51 N -3.76 2.88 0.16 0.56 0.04 -1.26 -4.99 135.00 128.63 1p6s s PRO 51 Ca 0.64 1.36 0.00 0.00 0.04 0.00 0.00 61.00 63.03 1p6s s PRO 51 Cb -0.14 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1p6s s PRO 51 CO 0.29 -1.18 0.00 -0.11 0.04 0.00 0.00 177.00 176.04 1p6s n LEU 52 N -2.36 0.16 -4.04 -3.56 0.00 -1.26 -5.08 117.00 100.84 1p6s n LEU 52 Ca 0.10 0.26 -0.25 0.00 0.00 0.00 0.00 56.01 56.12 1p6s n LEU 52 Cb 0.52 0.12 -0.16 0.00 0.00 0.00 0.00 43.42 43.90 1p6s n LEU 52 CO 0.48 -0.64 -0.47 0.20 0.00 0.00 0.00 177.39 176.95 1p6s s ASN 53 N -5.22 1.85 -0.07 1.96 -0.87 -0.93 -5.03 114.94 106.64 1p6s s ASN 53 Ca 0.00 -0.31 0.03 0.00 -1.57 0.00 0.00 52.86 51.01 1p6s s ASN 53 Cb 0.00 -0.82 -0.02 0.00 -0.02 0.00 0.00 41.25 40.39 1p6s s ASN 53 CO 0.00 0.05 -0.15 0.21 -2.57 0.00 0.00 177.10 174.64 1p6s s ASN 54 N 0.58 3.95 0.01 -1.22 2.47 -1.26 -0.26 114.94 119.21 1p6s s ASN 54 Ca -0.14 -0.25 0.07 0.00 0.42 0.00 0.00 52.86 52.97 1p6s s ASN 54 Cb -0.15 -0.98 -0.02 0.00 -1.45 0.00 0.00 41.25 38.64 1p6s s ASN 54 CO 0.04 0.30 -0.21 0.12 -3.72 0.00 0.00 177.10 173.63 1p6s s PHE 55 N -0.48 1.88 -0.18 0.43 5.36 0.34 -4.94 117.98 120.39 1p6s s PHE 55 Ca 0.06 -0.37 -0.05 0.00 -0.96 0.00 0.00 56.93 55.61 1p6s s PHE 55 Cb -0.12 -1.17 -0.03 0.00 -0.34 0.00 0.00 43.02 41.36 1p6s s PHE 55 CO 0.02 0.03 0.01 -1.54 -1.46 0.00 0.00 175.22 172.28 1p6s s SER 56 N -0.84 5.14 -0.40 6.13 1.04 -1.26 0.14 113.70 123.65 1p6s s SER 56 Ca 0.08 -0.06 0.08 0.00 0.48 0.00 0.00 55.95 56.53 1p6s s SER 56 Cb -0.09 -1.86 0.25 0.00 0.10 0.00 0.00 66.02 64.42 1p6s s SER 56 CO 0.01 0.15 0.56 0.55 0.98 0.00 0.00 173.24 175.49 1p6s n VAL 57 N 3.68 -0.62 0.00 5.02 3.14 0.09 -4.93 118.33 124.71 1p6s n VAL 57 Ca -0.17 -3.73 -0.15 0.00 -2.96 0.00 0.00 64.34 57.33 1p6s n VAL 57 Cb 0.52 -1.57 -0.14 0.00 -1.06 0.00 0.00 33.84 31.59 1p6s n VAL 57 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1p6s h ALA 58 N 4.00 0.57 -0.92 1.55 0.00 -1.89 -3.41 119.26 119.17 1p6s h ALA 58 Ca 0.05 -1.39 -0.35 0.00 0.00 0.00 0.00 54.91 53.21 1p6s h ALA 58 Cb 0.90 0.54 -0.40 0.00 0.00 0.00 0.00 17.79 18.83 1p6s h ALA 58 CO 0.45 1.42 -1.15 -0.85 0.00 0.00 0.00 179.25 179.12 1p6s n GLU 59 N -3.27 1.44 -1.26 0.00 -0.00 -1.26 -4.95 120.64 111.34 1p6s n GLU 59 Ca -0.22 -3.39 -0.05 0.00 -0.00 0.00 0.00 57.16 53.49 1p6s n GLU 59 Cb 1.05 -1.39 0.02 0.00 -0.00 0.00 0.00 31.44 31.12 1p6s n GLU 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1p6s s GLN 61 N -2.78 1.44 -0.05 0.00 -2.07 -1.26 -4.99 119.66 109.95 1p6s s GLN 61 Ca 0.14 -0.38 0.04 0.00 -1.82 0.00 0.00 55.36 53.34 1p6s s GLN 61 Cb -0.01 -1.24 -0.00 0.00 -1.09 0.00 0.00 33.01 30.66 1p6s s GLN 61 CO 0.09 0.07 -0.18 -1.17 -1.32 0.00 0.00 175.29 172.78 1p6s s LEU 62 N 0.48 1.92 -0.04 2.60 0.20 -1.26 -2.94 118.68 119.66 1p6s s LEU 62 Ca -0.10 -0.38 0.03 0.00 0.69 0.00 0.00 54.13 54.38 1p6s s LEU 62 Cb -0.13 -1.03 0.00 0.00 -0.43 0.00 0.00 46.19 44.59 1p6s s LEU 62 CO 0.02 0.16 -0.13 -0.32 -0.29 0.00 0.00 176.35 175.79 1p6s s MET 63 N 0.07 1.38 0.33 1.98 -2.45 0.14 -4.94 119.30 115.83 1p6s s MET 63 Ca -0.05 -0.46 -0.20 0.00 -1.25 0.00 0.00 55.69 53.72 1p6s s MET 63 Cb -0.12 -1.24 -0.10 0.00 1.25 0.00 0.00 34.83 34.62 1p6s s MET 63 CO 0.03 0.18 0.85 -1.59 1.05 0.00 0.00 175.02 175.53 1p6s s LYS 64 N 0.12 4.26 0.28 4.11 -2.85 -1.26 0.33 119.74 124.73 1p6s s LYS 64 Ca -0.04 1.00 -0.12 0.00 -1.00 0.00 0.00 55.97 55.81 1p6s s LYS 64 Cb -0.10 -2.54 0.01 0.00 -2.06 0.00 0.00 37.83 33.14 1p6s s LYS 64 CO 0.01 0.18 0.54 -0.08 0.10 0.00 0.00 175.35 176.10 1p6s s THR 65 N -1.86 0.00 -0.20 3.79 -1.32 -0.12 -4.89 115.64 111.04 1p6s s THR 65 Ca 0.53 -1.35 0.08 0.00 -1.21 0.00 0.00 61.69 59.75 1p6s s THR 65 Cb -0.13 -2.34 0.17 0.00 -1.51 0.00 0.00 72.50 68.69 1p6s s THR 65 CO 0.18 0.00 1.12 -0.62 -2.21 0.00 0.00 174.62 173.09 1p6s n GLU 66 N -0.44 2.53 -4.40 7.08 -0.58 -1.26 -1.56 120.64 122.01 1p6s n GLU 66 Ca -0.02 -1.99 -0.20 0.00 -0.42 0.00 0.00 57.16 54.53 1p6s n GLU 66 Cb 0.61 -1.25 -0.14 0.00 -0.57 0.00 0.00 31.44 30.10 1p6s n GLU 66 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1p6s s ARG 67 N -1.65 0.94 0.37 3.49 0.52 -1.26 -3.03 118.95 118.33 1p6s s ARG 67 Ca 0.16 -0.66 0.15 0.00 -0.52 0.00 0.00 55.73 54.86 1p6s s ARG 67 Cb 0.12 -0.93 0.72 0.00 0.52 0.00 0.00 34.95 35.38 1p6s s ARG 67 CO 0.04 0.24 1.79 -1.00 0.02 0.00 0.00 175.30 176.38 1p6s h PRO 68 N 5.18 0.00 -6.19 3.54 0.13 -2.01 -3.48 132.00 129.17 1p6s h PRO 68 Ca -0.36 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.20 1p6s h PRO 68 Cb 1.18 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.21 1p6s h PRO 68 CO 0.45 0.39 -0.65 1.03 -0.23 0.00 0.00 178.00 179.00 1p6s s ARG 69 N -3.93 2.24 0.75 0.86 0.52 -1.22 -5.12 118.95 113.06 1p6s s ARG 69 Ca -0.02 -1.46 -0.12 0.00 -0.52 0.00 0.00 55.73 53.61 1p6s s ARG 69 Cb 0.13 -2.13 0.05 0.00 0.52 0.00 0.00 34.95 33.53 1p6s s ARG 69 CO 0.71 0.35 1.11 -1.25 0.02 0.00 0.00 175.30 176.24 1p6s s PRO 70 N -3.67 2.25 -1.06 3.54 0.04 -1.17 -4.05 135.00 130.88 1p6s s PRO 70 Ca 0.32 1.33 -0.09 0.00 0.04 0.00 0.00 61.00 62.60 1p6s s PRO 70 Cb -0.06 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.54 1p6s s PRO 70 CO 0.20 -1.67 0.90 0.09 0.04 0.00 0.00 177.00 176.55 1p6s n ASN 71 N -3.23 -6.43 -4.36 6.66 4.13 -1.23 -4.92 115.26 105.87 1p6s n ASN 71 Ca 0.10 -0.76 -0.19 0.00 1.68 0.00 0.00 54.58 55.41 1p6s n ASN 71 Cb 0.52 -4.88 -0.10 0.00 -1.54 0.00 0.00 39.78 33.78 1p6s n ASN 71 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1p6s s THR 72 N -3.40 1.84 0.07 3.41 2.01 -0.60 -3.74 115.64 115.22 1p6s s THR 72 Ca 0.46 -2.23 0.08 0.00 0.31 0.00 0.00 61.69 60.31 1p6s s THR 72 Cb -0.08 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.33 1p6s s THR 72 CO 0.76 -0.56 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.56 1p6s s PHE 73 N -2.87 1.90 -0.07 4.92 0.08 0.46 -0.95 117.98 121.44 1p6s s PHE 73 Ca 0.23 -0.39 0.03 0.00 0.12 0.00 0.00 56.93 56.92 1p6s s PHE 73 Cb -0.02 -1.10 0.01 0.00 -0.57 0.00 0.00 43.02 41.35 1p6s s PHE 73 CO 0.08 0.15 -0.16 0.08 -0.10 0.00 0.00 175.22 175.27 1p6s s VAL 74 N -0.92 1.39 -0.00 -0.44 1.01 0.15 0.14 120.40 121.73 1p6s s VAL 74 Ca 0.08 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1p6s s VAL 74 Cb -0.09 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 1p6s s VAL 74 CO 0.03 0.41 -0.08 -0.51 0.00 0.00 0.00 175.10 174.95 1p6s s ILE 75 N 0.53 0.63 0.00 2.22 2.07 -0.58 0.26 121.20 126.33 1p6s s ILE 75 Ca -0.15 -0.40 0.00 0.00 -1.41 0.00 0.00 60.65 58.69 1p6s s ILE 75 Cb -0.16 -0.54 0.00 0.00 0.13 0.00 0.00 42.46 41.89 1p6s s ILE 75 CO 0.05 0.14 0.00 0.54 -1.91 0.00 0.00 174.94 173.76 1p6s n ARG 76 N 2.77 0.00 -3.71 3.50 1.74 -1.15 -4.58 116.66 115.23 1p6s n ARG 76 Ca -0.14 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.71 1p6s n ARG 76 Cb 0.57 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 32.04 1p6s n ARG 76 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1p6s s LEU 78 N -6.61 2.03 -0.19 0.00 2.96 -1.26 -5.06 118.68 110.55 1p6s s LEU 78 Ca 0.10 -1.53 0.16 0.00 -0.22 0.00 0.00 54.13 52.64 1p6s s LEU 78 Cb -0.03 -0.21 0.45 0.00 0.50 0.00 0.00 46.19 46.90 1p6s s LEU 78 CO 0.83 -0.78 1.34 0.00 -1.32 0.00 0.00 176.35 176.41 1p6s n GLN 79 N -0.78 2.15 -3.71 1.98 6.02 -1.26 -4.95 117.38 116.82 1p6s n GLN 79 Ca -0.04 -2.86 -0.21 0.00 -0.01 0.00 0.00 57.00 53.88 1p6s n GLN 79 Cb 0.66 -1.73 -0.18 0.00 1.02 0.00 0.00 30.24 30.01 1p6s n GLN 79 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1p6s s TRP 80 N -2.95 0.24 -0.96 1.08 0.52 -1.26 -5.09 118.94 110.52 1p6s s TRP 80 Ca 0.39 0.13 -0.14 0.00 0.02 0.00 0.00 56.10 56.50 1p6s s TRP 80 Cb 0.34 -0.56 0.21 0.00 -1.15 0.00 0.00 33.47 32.30 1p6s s TRP 80 CO 0.04 -0.23 1.01 0.99 0.02 0.00 0.00 176.95 178.78 1p6s s THR 81 N 2.06 5.43 0.07 2.01 2.01 -1.26 -4.68 115.64 121.28 1p6s s THR 81 Ca 0.04 -2.50 0.00 0.00 0.31 0.00 0.00 61.69 59.54 1p6s s THR 81 Cb -0.12 -4.62 0.00 0.00 0.01 0.00 0.00 72.50 67.77 1p6s s THR 81 CO -0.04 -1.24 0.00 0.41 -0.69 0.00 0.00 174.62 173.06 1p6s n THR 82 N 4.12 0.23 -4.21 -0.82 -1.04 -1.26 -5.12 114.28 106.17 1p6s n THR 82 Ca 0.21 0.08 -0.12 0.00 -2.04 0.00 0.00 64.05 62.18 1p6s n THR 82 Cb 0.45 -1.05 -0.10 0.00 -1.82 0.00 0.00 70.33 67.82 1p6s n THR 82 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1p6s s VAL 83 N -2.00 0.65 -0.44 12.58 0.11 -1.26 -5.08 120.40 124.96 1p6s s VAL 83 Ca 0.00 -1.96 0.07 0.00 -2.93 0.00 0.00 61.98 57.16 1p6s s VAL 83 Cb 0.00 -1.96 0.41 0.00 -1.53 0.00 0.00 36.38 33.31 1p6s s VAL 83 CO 0.00 -0.62 1.06 2.30 -3.33 0.00 0.00 175.10 174.51 1p6s n ILE 84 N -0.16 2.20 -1.02 7.04 -5.35 -1.26 -4.86 119.36 115.96 1p6s n ILE 84 Ca -0.08 -4.75 -0.24 0.00 -0.27 0.00 0.00 62.75 57.41 1p6s n ILE 84 Cb 0.62 -0.99 0.07 0.00 -1.74 0.00 0.00 39.64 37.61 1p6s n ILE 84 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1p6s n GLU 85 N -0.37 2.18 -2.23 6.28 1.02 -1.26 -4.60 120.64 121.66 1p6s n GLU 85 Ca 0.33 -2.38 -0.37 0.00 -0.02 0.00 0.00 57.16 54.73 1p6s n GLU 85 Cb 0.65 -1.93 0.02 0.00 -0.02 0.00 0.00 31.44 30.16 1p6s n GLU 85 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1p6s n ARG 86 N -0.36 3.45 -4.29 3.49 5.12 -1.26 -4.99 116.66 117.81 1p6s n ARG 86 Ca 0.46 -4.01 -0.33 0.00 -1.93 0.00 0.00 57.85 52.03 1p6s n ARG 86 Cb 0.76 -2.30 -0.09 0.00 -1.16 0.00 0.00 32.46 29.66 1p6s n ARG 86 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1p6s s THR 87 N -4.98 4.27 0.01 0.55 2.01 -1.26 -1.53 115.64 114.72 1p6s s THR 87 Ca 0.48 -0.46 0.04 0.00 0.31 0.00 0.00 61.69 62.06 1p6s s THR 87 Cb 0.37 -2.88 -0.01 0.00 0.01 0.00 0.00 72.50 69.99 1p6s s THR 87 CO -0.30 0.45 -0.13 0.72 -0.69 0.00 0.00 174.62 174.67 1p6s s PHE 88 N -1.03 1.12 0.16 4.92 -0.12 0.12 -4.38 117.98 118.77 1p6s s PHE 88 Ca 0.18 -0.26 0.04 0.00 -0.05 0.00 0.00 56.93 56.84 1p6s s PHE 88 Cb -0.11 -0.70 -0.04 0.00 -0.63 0.00 0.00 43.02 41.54 1p6s s PHE 88 CO 0.08 -0.00 0.20 -1.01 -0.05 0.00 0.00 175.22 174.44 1p6s s HIS 89 N -0.49 3.28 0.26 3.49 3.76 0.12 -0.40 115.29 125.31 1p6s s HIS 89 Ca 0.03 0.03 0.06 0.00 -0.15 0.00 0.00 55.06 55.03 1p6s s HIS 89 Cb -0.06 -1.57 -0.03 0.00 1.11 0.00 0.00 32.58 32.03 1p6s s HIS 89 CO 0.00 0.52 0.28 0.14 -0.85 0.00 0.00 174.74 174.83 1p6s s VAL 90 N -1.77 4.66 0.30 -0.90 -7.23 -1.25 0.37 120.40 114.59 1p6s s VAL 90 Ca 0.32 -1.22 0.04 0.00 -1.81 0.00 0.00 61.98 59.31 1p6s s VAL 90 Cb -0.10 -3.56 0.08 0.00 0.56 0.00 0.00 36.38 33.36 1p6s s VAL 90 CO 0.25 -0.32 1.76 -0.78 -0.31 0.00 0.00 175.10 175.70 1p6s h ASP 91 N 1.32 0.44 -5.29 4.85 3.58 -1.91 -3.44 116.42 115.97 1p6s h ASP 91 Ca -0.49 -0.14 -0.13 0.00 0.42 0.00 0.00 57.03 56.69 1p6s h ASP 91 Cb 1.24 -0.12 -0.14 0.00 1.72 0.00 0.00 39.33 42.03 1p6s h ASP 91 CO 0.60 0.67 -0.50 -0.55 -2.88 0.00 0.00 179.24 176.58 1p6s s SER 92 N -6.81 0.22 0.13 2.28 0.15 -1.26 -5.03 113.70 103.37 1p6s s SER 92 Ca -0.07 -0.95 -0.14 0.00 0.70 0.00 0.00 55.95 55.50 1p6s s SER 92 Cb 0.14 0.33 -0.02 0.00 -1.71 0.00 0.00 66.02 64.76 1p6s s SER 92 CO 0.78 -0.75 1.55 1.55 1.20 0.00 0.00 173.24 177.57 1p6s h PRO 93 N 2.80 0.77 -0.35 5.44 0.13 -1.93 -2.24 132.00 136.62 1p6s h PRO 93 Ca -0.34 -0.27 -0.03 0.00 -0.87 0.00 0.00 66.00 64.50 1p6s h PRO 93 Cb 1.20 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 1p6s h PRO 93 CO 0.56 0.88 0.11 -0.44 -0.23 0.00 0.00 178.00 178.88 1p6s h ASP 94 N 0.60 0.45 -0.32 1.44 5.19 -2.00 -2.31 116.42 119.48 1p6s h ASP 94 Ca 0.11 -0.05 -0.03 0.00 -0.62 0.00 0.00 57.03 56.44 1p6s h ASP 94 Cb 0.56 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 1p6s h ASP 94 CO 0.03 0.44 0.07 -0.08 -3.12 0.00 0.00 179.24 176.58 1p6s h GLU 95 N 0.50 0.51 -0.42 3.56 4.81 -1.87 -2.01 114.58 119.65 1p6s h GLU 95 Ca 0.12 -0.13 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 1p6s h GLU 95 Cb 0.15 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.42 1p6s h GLU 95 CO -0.01 0.58 0.15 -0.09 -0.73 0.00 0.00 179.01 178.92 1p6s h ARG 96 N 0.35 0.31 -0.78 1.92 1.12 -0.87 0.81 114.38 117.24 1p6s h ARG 96 Ca 0.10 -0.02 0.01 0.00 -1.11 0.00 0.00 59.98 58.96 1p6s h ARG 96 Cb 0.31 -0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 30.16 1p6s h ARG 96 CO 0.00 0.21 0.52 1.49 -3.11 0.00 0.00 179.97 179.08 1p6s h GLU 97 N 0.32 1.03 -0.45 0.20 4.81 -1.32 -1.92 114.58 117.25 1p6s h GLU 97 Ca 0.20 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.25 1p6s h GLU 97 Cb 0.18 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1p6s h GLU 97 CO -0.20 0.69 -0.17 1.49 -0.73 0.00 0.00 179.01 180.09 1p6s h GLU 98 N 1.06 0.91 -0.39 1.92 4.57 -0.46 -2.83 114.58 119.37 1p6s h GLU 98 Ca 0.29 -0.38 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1p6s h GLU 98 Cb -0.12 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.41 1p6s h GLU 98 CO -0.06 1.03 0.25 -1.49 -1.18 0.00 0.00 179.01 177.56 1p6s h TRP 99 N 0.75 0.50 -0.68 0.92 -0.00 -0.24 -1.67 115.95 115.53 1p6s h TRP 99 Ca 0.11 0.01 0.05 0.00 -0.00 0.00 0.00 58.89 59.05 1p6s h TRP 99 Cb 0.73 -0.17 -0.05 0.00 -0.00 0.00 0.00 29.16 29.67 1p6s h TRP 99 CO 0.05 0.34 0.40 1.98 -0.00 0.00 0.00 178.44 181.21 1p6s h MET 100 N 0.52 0.74 -0.71 0.49 4.05 -1.31 -0.60 114.93 118.11 1p6s h MET 100 Ca 0.14 -0.04 -0.04 0.00 -0.28 0.00 0.00 59.70 59.47 1p6s h MET 100 Cb -0.03 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 30.57 1p6s h MET 100 CO -0.03 0.49 0.28 -0.09 0.23 0.00 0.00 176.91 177.79 1p6s h ARG 101 N 0.76 1.07 -0.44 0.39 2.43 -1.22 -2.34 114.38 115.04 1p6s h ARG 101 Ca 0.29 -0.20 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1p6s h ARG 101 Cb 0.11 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 1p6s h ARG 101 CO -0.15 0.89 0.13 0.00 -1.51 0.00 0.00 179.97 179.33 1p6s h ALA 102 N 1.13 0.58 -0.78 2.80 0.00 -0.57 -1.33 119.26 121.09 1p6s h ALA 102 Ca 0.24 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1p6s h ALA 102 Cb 0.22 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1p6s h ALA 102 CO -0.02 0.24 0.50 0.82 0.00 0.00 0.00 179.25 180.79 1p6s h ILE 103 N 0.57 1.13 -0.49 0.00 2.04 -0.92 -1.78 117.51 118.07 1p6s h ILE 103 Ca 0.14 -0.34 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 1p6s h ILE 103 Cb 0.28 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 1p6s h ILE 103 CO -0.00 0.18 -0.07 -0.61 0.00 0.00 0.00 178.15 177.65 1p6s h GLN 104 N 0.99 0.91 -0.71 2.37 -0.00 -1.20 -2.10 115.11 115.37 1p6s h GLN 104 Ca 0.31 -0.32 0.03 0.00 -0.00 0.00 0.00 58.65 58.66 1p6s h GLN 104 Cb -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 27.48 27.36 1p6s h GLN 104 CO -0.10 0.97 0.44 0.52 0.00 0.00 0.00 178.83 180.66 1p6s h MET 105 N 0.76 0.83 -0.33 1.69 2.86 -0.72 -1.45 114.93 118.58 1p6s h MET 105 Ca 0.13 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.62 1p6s h MET 105 Cb 0.61 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 1p6s h MET 105 CO 0.04 0.55 -0.21 0.28 1.06 0.00 0.00 176.91 178.63 1p6s h VAL 106 N 0.86 1.27 -0.61 -2.22 2.07 -1.21 -2.92 116.25 113.48 1p6s h VAL 106 Ca 0.29 -1.27 -0.07 0.00 0.82 0.00 0.00 66.70 66.47 1p6s h VAL 106 Cb 0.03 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1p6s h VAL 106 CO -0.11 0.42 0.10 0.00 0.02 0.00 0.00 177.57 178.00 1p6s h ALA 107 N 1.21 1.03 -0.12 1.67 0.00 -0.64 0.16 119.26 122.56 1p6s h ALA 107 Ca 0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1p6s h ALA 107 Cb 0.67 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1p6s h ALA 107 CO 0.05 0.62 -0.05 -0.91 0.00 0.00 0.00 179.25 178.96 1p6s h ASN 108 N 0.93 0.16 0.74 0.00 2.35 -1.10 -1.05 115.58 117.61 1p6s h ASN 108 Ca 0.19 -0.02 -0.18 0.00 -0.55 0.00 0.00 56.30 55.74 1p6s h ASN 108 Cb 0.40 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 1p6s h ASN 108 CO 0.01 0.24 -1.37 0.28 -1.65 0.00 0.00 177.43 174.94 1p6s h SER 109 N 0.17 0.00 -0.08 5.81 0.02 -1.36 -3.36 113.55 114.75 1p6s h SER 109 Ca 0.04 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.90 1p6s h SER 109 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1p6s h SER 109 CO 0.01 0.62 -0.31 -0.07 -1.14 0.00 0.00 176.83 175.94 1p6s h LEU 110 N 0.00 0.41 -0.53 5.07 4.07 -0.17 -3.52 115.31 120.64 1p6s h LEU 110 Ca -0.16 -0.63 0.00 0.00 0.08 0.00 0.00 57.88 57.17 1p6s h LEU 110 Cb 1.61 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 43.23 1p6s h LEU 110 CO 0.05 0.97 0.00 0.29 -1.08 0.00 0.00 178.44 178.67