#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p6s n ASN 2 N 0.00 -0.99 -4.32 7.83 5.15 -1.26 -4.92 115.26 116.76 1p6s n ASN 2 Ca 0.00 1.18 -0.45 0.00 -0.60 0.00 0.00 54.58 54.72 1p6s n ASN 2 Cb 0.00 -4.74 -0.01 0.00 -0.53 0.00 0.00 39.78 34.49 1p6s n ASN 2 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1p6s s GLU 3 N -0.77 3.97 -0.22 1.20 2.12 -1.26 -5.00 118.70 118.73 1p6s s GLU 3 Ca -0.24 -3.02 -0.00 0.00 0.36 0.00 0.00 54.97 52.06 1p6s s GLU 3 Cb 0.02 -4.47 0.02 0.00 0.26 0.00 0.00 34.13 29.96 1p6s s GLU 3 CO 0.70 -1.25 -0.11 0.08 -0.54 0.00 0.00 175.26 174.14 1p6s s VAL 4 N -0.90 2.58 0.54 3.70 1.01 -1.26 -5.04 120.40 121.04 1p6s s VAL 4 Ca 0.27 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 1p6s s VAL 4 Cb -0.10 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 34.06 1p6s s VAL 4 CO -0.08 0.31 0.78 -0.44 0.00 0.00 0.00 175.10 175.67 1p6s s SER 5 N 1.31 5.40 0.07 3.32 0.01 -1.26 -4.77 113.70 117.77 1p6s s SER 5 Ca 0.01 0.17 -0.23 0.00 1.31 0.00 0.00 55.95 57.22 1p6s s SER 5 Cb -0.16 -1.14 -0.06 0.00 0.21 0.00 0.00 66.02 64.87 1p6s s SER 5 CO -0.07 -1.07 0.68 -0.69 0.41 0.00 0.00 173.24 172.50 1p6s s VAL 6 N -2.78 4.69 -0.25 3.43 1.01 -1.26 -0.25 120.40 124.99 1p6s s VAL 6 Ca 0.55 1.46 0.05 0.00 0.00 0.00 0.00 61.98 64.03 1p6s s VAL 6 Cb -0.10 -4.02 -0.19 0.00 0.00 0.00 0.00 36.38 32.07 1p6s s VAL 6 CO 0.39 0.46 -0.16 -0.38 0.00 0.00 0.00 175.10 175.42 1p6s n ILE 7 N 2.23 1.48 -3.65 2.22 -0.00 0.18 -4.84 119.36 116.98 1p6s n ILE 7 Ca -0.06 -0.63 -0.14 0.00 -0.00 0.00 0.00 62.75 61.92 1p6s n ILE 7 Cb 0.50 -1.25 -0.07 0.00 -0.00 0.00 0.00 39.64 38.82 1p6s n ILE 7 CO 0.00 0.00 0.00 -0.54 -0.00 0.00 0.00 176.55 176.01 1p6s s LYS 8 N -2.52 0.78 0.03 0.38 -0.14 -1.05 -5.01 119.74 112.22 1p6s s LYS 8 Ca -0.30 0.93 0.07 0.00 -1.36 0.00 0.00 55.97 55.31 1p6s s LYS 8 Cb 0.08 0.38 -0.02 0.00 -1.68 0.00 0.00 37.83 36.59 1p6s s LYS 8 CO 0.65 -0.09 -0.20 -1.21 -0.76 0.00 0.00 175.35 173.74 1p6s s GLU 9 N 0.36 1.37 0.17 1.68 8.01 -1.26 0.26 118.70 129.29 1p6s s GLU 9 Ca -0.00 -0.88 -0.24 0.00 0.01 0.00 0.00 54.97 53.85 1p6s s GLU 9 Cb -0.05 -1.44 0.06 0.00 -4.31 0.00 0.00 34.13 28.39 1p6s s GLU 9 CO 0.01 0.37 0.93 0.20 0.01 0.00 0.00 175.26 176.78 1p6s s GLY 10 N -1.06 -0.20 -0.08 -1.39 0.00 -0.42 -5.00 107.32 99.16 1p6s s GLY 10 Ca 0.07 0.05 -0.14 0.00 0.00 0.00 0.00 44.72 44.70 1p6s s GLY 10 CO 0.01 0.02 0.36 -0.98 0.00 0.00 0.00 173.10 172.52 1p6s s TRP 11 N -3.34 3.59 0.12 1.90 0.52 -1.26 0.29 118.94 120.76 1p6s s TRP 11 Ca 0.12 0.80 0.06 0.00 0.02 0.00 0.00 56.10 57.11 1p6s s TRP 11 Cb -0.02 -2.32 -0.04 0.00 -1.15 0.00 0.00 33.47 29.94 1p6s s TRP 11 CO 0.03 0.44 -0.15 -0.51 0.02 0.00 0.00 176.95 176.78 1p6s s LEU 12 N -0.26 2.39 -0.25 2.99 1.43 0.04 -3.15 118.68 121.87 1p6s s LEU 12 Ca 0.21 -0.79 -0.10 0.00 -1.03 0.00 0.00 54.13 52.43 1p6s s LEU 12 Cb -0.15 -0.59 -0.05 0.00 0.03 0.00 0.00 46.19 45.43 1p6s s LEU 12 CO 0.09 -0.11 0.14 -1.00 0.23 0.00 0.00 176.35 175.69 1p6s s HIS 13 N -1.97 3.24 -0.04 0.29 3.76 0.21 0.35 115.29 121.12 1p6s s HIS 13 Ca 0.08 0.06 0.05 0.00 -0.15 0.00 0.00 55.06 55.11 1p6s s HIS 13 Cb -0.06 -2.27 -0.01 0.00 1.11 0.00 0.00 32.58 31.36 1p6s s HIS 13 CO 0.03 -0.06 -0.20 0.21 -0.85 0.00 0.00 174.74 173.87 1p6s s LYS 14 N 1.26 2.00 0.51 1.40 2.20 0.33 0.09 119.74 127.52 1p6s s LYS 14 Ca 0.07 -0.71 -0.22 0.00 -0.36 0.00 0.00 55.97 54.74 1p6s s LYS 14 Cb -0.14 -1.74 -0.06 0.00 -1.51 0.00 0.00 37.83 34.37 1p6s s LYS 14 CO 0.06 0.31 1.23 0.50 -0.36 0.00 0.00 175.35 177.09 1p6s s ARG 15 N -0.09 3.45 0.00 4.03 6.06 -1.26 -0.21 118.95 130.93 1p6s s ARG 15 Ca -0.02 1.93 0.00 0.00 -2.50 0.00 0.00 55.73 55.13 1p6s s ARG 15 Cb -0.12 -2.29 0.00 0.00 0.06 0.00 0.00 34.95 32.61 1p6s s ARG 15 CO 0.02 -0.85 0.68 0.41 -2.50 0.00 0.00 175.30 173.06 1p6s n GLY 16 N 0.53 -2.53 1.44 8.12 0.00 -1.14 -4.86 105.19 106.76 1p6s n GLY 16 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1p6s n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1p6s n GLU 17 N -1.17 0.00 -0.03 1.61 4.07 -1.26 -4.99 120.64 118.87 1p6s n GLU 17 Ca 0.00 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 57.08 1p6s n GLU 17 Cb 0.00 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.32 1p6s n GLU 17 CO 0.00 0.00 0.00 2.48 -0.06 0.00 0.00 177.13 179.55 1p6s n TYR 18 N -3.30 0.00 -2.28 4.31 0.18 -1.26 -5.01 117.16 109.79 1p6s n TYR 18 Ca 0.00 0.00 -0.35 0.00 1.88 0.00 0.00 57.90 59.43 1p6s n TYR 18 Cb 0.00 -0.34 -0.00 0.00 -0.38 0.00 0.00 39.34 38.61 1p6s n TYR 18 CO 0.00 0.00 0.00 -1.50 -2.08 0.00 0.00 176.86 173.28 1p6s s ILE 19 N -2.25 3.24 -1.10 -3.48 2.07 -1.26 -4.92 121.20 113.50 1p6s s ILE 19 Ca -0.04 0.77 -0.05 0.00 -1.41 0.00 0.00 60.65 59.92 1p6s s ILE 19 Cb 0.03 -3.31 0.09 0.00 0.13 0.00 0.00 42.46 39.40 1p6s s ILE 19 CO 0.32 -0.17 2.54 1.17 -1.91 0.00 0.00 174.94 176.88 1p6s n LYS 20 N -1.28 3.98 -3.92 3.50 0.00 -1.26 -4.55 118.16 114.63 1p6s n LYS 20 Ca 0.11 -3.08 -0.10 0.00 0.00 0.00 0.00 58.31 55.24 1p6s n LYS 20 Cb 0.51 -2.51 -0.11 0.00 0.00 0.00 0.00 35.03 32.92 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 -1.20 0.08 -0.11 3.15 2.01 -1.26 -5.11 115.64 113.20 1p6s s THR 21 Ca 0.56 -0.67 -0.00 0.00 0.31 0.00 0.00 61.69 61.89 1p6s s THR 21 Cb 0.23 -0.29 -0.02 0.00 0.01 0.00 0.00 72.50 72.43 1p6s s THR 21 CO -0.12 -0.37 -0.09 0.26 -0.69 0.00 0.00 174.62 173.61 1p6s s TRP 22 N -1.17 2.88 -0.11 4.92 0.52 -1.26 -2.88 118.94 121.84 1p6s s TRP 22 Ca -0.13 -0.29 -0.03 0.00 0.02 0.00 0.00 56.10 55.67 1p6s s TRP 22 Cb -0.07 -1.80 -0.03 0.00 -1.15 0.00 0.00 33.47 30.41 1p6s s TRP 22 CO 0.00 0.05 0.00 1.03 0.02 0.00 0.00 176.95 178.05 1p6s s ARG 23 N -0.15 3.21 0.08 4.98 0.52 0.71 -4.72 118.95 123.57 1p6s s ARG 23 Ca 0.01 -0.42 -0.30 0.00 -0.52 0.00 0.00 55.73 54.49 1p6s s ARG 23 Cb -0.13 -2.86 -0.06 0.00 0.52 0.00 0.00 34.95 32.42 1p6s s ARG 23 CO 0.03 0.58 1.17 -1.25 0.02 0.00 0.00 175.30 175.84 1p6s s PRO 24 N -0.53 4.47 0.00 3.54 0.04 -1.26 -0.52 135.00 140.74 1p6s s PRO 24 Ca 0.09 1.74 0.01 0.00 0.04 0.00 0.00 61.00 62.88 1p6s s PRO 24 Cb -0.12 -3.34 -0.01 0.00 0.04 0.00 0.00 34.50 31.07 1p6s s PRO 24 CO 0.02 -0.19 -0.04 1.03 0.04 0.00 0.00 177.00 177.86 1p6s s ARG 25 N 0.80 0.33 -0.28 4.56 1.81 0.15 -4.92 118.95 121.41 1p6s s ARG 25 Ca 0.57 -0.23 -0.29 0.00 -1.72 0.00 0.00 55.73 54.06 1p6s s ARG 25 Cb -0.29 -0.27 0.00 0.00 -0.45 0.00 0.00 34.95 33.94 1p6s s ARG 25 CO 0.30 0.07 1.27 -0.47 -0.68 0.00 0.00 175.30 175.79 1p6s s TYR 26 N -0.30 2.76 0.01 -0.53 5.04 -0.38 -0.78 117.35 123.16 1p6s s TYR 26 Ca -0.01 0.93 -0.01 0.00 -2.44 0.00 0.00 57.07 55.54 1p6s s TYR 26 Cb -0.03 -3.81 -0.04 0.00 0.35 0.00 0.00 41.96 38.43 1p6s s TYR 26 CO -0.00 -1.61 0.12 -0.06 -1.34 0.00 0.00 175.55 172.65 1p6s s PHE 27 N 4.15 3.36 -0.15 4.97 0.40 0.14 0.77 117.98 131.63 1p6s s PHE 27 Ca 0.55 0.24 0.01 0.00 -0.60 0.00 0.00 56.93 57.13 1p6s s PHE 27 Cb -0.17 -1.75 0.02 0.00 0.51 0.00 0.00 43.02 41.63 1p6s s PHE 27 CO 0.21 0.58 -0.16 -0.51 0.70 0.00 0.00 175.22 176.03 1p6s s LEU 28 N -1.90 1.83 -0.16 -0.37 1.02 -0.47 -1.30 118.68 117.32 1p6s s LEU 28 Ca 0.25 -0.52 -0.11 0.00 0.02 0.00 0.00 54.13 53.77 1p6s s LEU 28 Cb -0.12 -1.26 -0.05 0.00 0.02 0.00 0.00 46.19 44.78 1p6s s LEU 28 CO 0.17 -0.02 0.20 -0.22 0.02 0.00 0.00 176.35 176.50 1p6s s LEU 29 N 1.29 4.26 0.52 1.79 0.20 0.14 -1.98 118.68 124.90 1p6s s LEU 29 Ca 0.02 0.40 0.05 0.00 0.69 0.00 0.00 54.13 55.28 1p6s s LEU 29 Cb -0.13 -2.21 0.02 0.00 -0.43 0.00 0.00 46.19 43.44 1p6s s LEU 29 CO -0.09 0.19 0.28 -0.54 -0.29 0.00 0.00 176.35 175.91 1p6s s LYS 30 N 0.11 2.24 0.00 1.98 1.02 -0.79 0.47 119.74 124.78 1p6s s LYS 30 Ca 0.13 -2.09 0.22 0.00 0.02 0.00 0.00 55.97 54.25 1p6s s LYS 30 Cb -0.12 -1.95 1.23 0.00 -0.52 0.00 0.00 37.83 36.47 1p6s s LYS 30 CO 0.02 -0.50 1.70 0.45 -0.92 0.00 0.00 175.35 176.09 1p6s n SER 31 N -1.59 0.00 -0.02 2.83 2.88 0.65 -2.85 113.62 115.52 1p6s n SER 31 Ca -0.06 -0.41 0.14 0.00 -1.33 0.00 0.00 58.87 57.21 1p6s n SER 31 Cb 0.65 -0.12 0.63 0.00 -0.75 0.00 0.00 64.21 64.62 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 -1.12 0.12 -0.11 -3.46 2.03 -1.26 -4.88 116.55 107.87 1p6s n ASP 32 Ca 0.14 0.05 0.00 0.00 0.52 0.00 0.00 54.79 55.50 1p6s n ASP 32 Cb 0.12 -0.29 0.00 0.00 -0.72 0.00 0.00 41.12 40.23 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 1.40 0.92 3.29 0.27 0.00 -1.13 -4.63 105.19 105.31 1p6s n GLY 33 Ca 0.10 -0.56 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 1p6s n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p6s s SER 34 N -2.68 -0.31 -0.03 1.61 0.01 -1.26 0.03 113.70 111.08 1p6s s SER 34 Ca 0.00 0.34 0.02 0.00 1.31 0.00 0.00 55.95 57.63 1p6s s SER 34 Cb 0.00 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.70 1p6s s SER 34 CO 0.00 -0.40 -0.09 0.72 0.41 0.00 0.00 173.24 173.88 1p6s s PHE 35 N -0.95 1.02 -0.11 2.43 -0.71 0.92 -1.88 117.98 118.70 1p6s s PHE 35 Ca -0.10 -0.27 -0.04 0.00 -1.04 0.00 0.00 56.93 55.48 1p6s s PHE 35 Cb -0.04 -0.73 -0.04 0.00 -1.21 0.00 0.00 43.02 41.00 1p6s s PHE 35 CO 0.04 -0.12 0.05 0.42 -1.34 0.00 0.00 175.22 174.27 1p6s s ILE 36 N 0.27 4.69 -0.02 -4.49 1.09 -0.84 -1.15 121.20 120.74 1p6s s ILE 36 Ca -0.05 -0.10 -0.19 0.00 -1.10 0.00 0.00 60.65 59.22 1p6s s ILE 36 Cb -0.10 -3.01 -0.05 0.00 -1.06 0.00 0.00 42.46 38.24 1p6s s ILE 36 CO 0.01 0.59 0.53 -0.83 -0.10 0.00 0.00 174.94 175.14 1p6s s GLY 37 N -0.76 2.55 0.17 6.18 0.00 0.20 -1.37 107.32 114.28 1p6s s GLY 37 Ca 0.12 -0.06 0.10 0.00 0.00 0.00 0.00 44.72 44.88 1p6s s GLY 37 CO 0.03 0.62 -0.16 -0.19 0.00 0.00 0.00 173.10 173.39 1p6s s TYR 38 N -0.27 2.51 0.12 1.90 1.51 0.23 -0.69 117.35 122.67 1p6s s TYR 38 Ca 0.28 -0.27 -0.09 0.00 -1.01 0.00 0.00 57.07 55.98 1p6s s TYR 38 Cb -0.17 -1.26 -0.10 0.00 -0.11 0.00 0.00 41.96 40.32 1p6s s TYR 38 CO 0.15 0.47 1.34 -0.22 -1.11 0.00 0.00 175.55 176.18 1p6s h LYS 39 N 3.22 0.68 -5.27 -0.62 3.64 -1.85 -0.99 116.57 115.38 1p6s h LYS 39 Ca -0.47 -0.57 -0.38 0.00 -1.27 0.00 0.00 60.65 57.96 1p6s h LYS 39 Cb 1.20 0.12 -0.17 0.00 -0.41 0.00 0.00 32.23 32.97 1p6s h LYS 39 CO 0.50 1.18 -0.74 -1.21 -2.27 0.00 0.00 179.45 176.91 1p6s s GLU 40 N -3.69 1.05 -0.09 1.90 2.02 -1.26 -4.61 118.70 114.02 1p6s s GLU 40 Ca -0.09 -1.33 -0.20 0.00 0.02 0.00 0.00 54.97 53.37 1p6s s GLU 40 Cb 0.09 -0.79 -0.16 0.00 0.10 0.00 0.00 34.13 33.36 1p6s s GLU 40 CO 0.89 0.13 0.68 -0.09 0.02 0.00 0.00 175.26 176.89 1p6s h ARG 41 N 3.18 -0.09 -7.27 1.61 2.43 -1.94 -3.45 114.38 108.86 1p6s h ARG 41 Ca -0.38 0.01 -0.50 0.00 -0.81 0.00 0.00 59.98 58.29 1p6s h ARG 41 Cb 1.20 0.02 0.08 0.00 -0.42 0.00 0.00 29.97 30.85 1p6s h ARG 41 CO 0.56 0.45 0.37 -1.25 -1.51 0.00 0.00 179.97 178.60 1p6s s PRO 42 N -2.67 3.13 0.34 0.20 0.04 -1.26 -4.98 135.00 129.80 1p6s s PRO 42 Ca -0.12 1.06 0.23 0.00 0.04 0.00 0.00 61.00 62.20 1p6s s PRO 42 Cb -0.01 -2.01 0.19 0.00 0.04 0.00 0.00 34.50 32.71 1p6s s PRO 42 CO 0.46 -0.95 1.36 1.05 0.04 0.00 0.00 177.00 178.96 1p6s h GLU 43 N -0.18 0.00 -2.98 4.56 -0.00 -1.91 -3.48 114.58 110.59 1p6s h GLU 43 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.91 1p6s h GLU 43 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.96 1p6s h GLU 43 CO 0.57 0.01 -0.67 0.00 -0.00 0.00 0.00 179.01 178.92 1p6s n ALA 44 N -2.14 -2.33 0.20 1.06 0.00 -1.26 -4.33 120.51 111.71 1p6s n ALA 44 Ca 0.02 0.33 0.07 0.00 0.00 0.00 0.00 53.44 53.87 1p6s n ALA 44 Cb 0.54 -1.17 0.36 0.00 0.00 0.00 0.00 19.45 19.18 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 2.33 0.00 -0.84 0.00 0.13 -2.04 -3.28 132.00 128.30 1p6s h PRO 45 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 1p6s h PRO 45 Cb 0.00 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 30.71 1p6s h PRO 45 CO 0.00 0.32 -0.91 -0.25 -0.23 0.00 0.00 178.00 176.93 1p6s n ASP 46 N -3.45 3.71 -2.84 1.44 8.00 -1.26 -4.93 116.55 117.22 1p6s n ASP 46 Ca 0.00 -3.21 0.02 0.00 0.71 0.00 0.00 54.79 52.31 1p6s n ASP 46 Cb 0.50 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 1p6s n ASP 46 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1p6s s GLN 47 N -3.59 0.26 0.16 -1.24 0.74 -1.24 -5.14 119.66 109.61 1p6s s GLN 47 Ca 0.42 -0.08 -0.30 0.00 0.05 0.00 0.00 55.36 55.45 1p6s s GLN 47 Cb 0.39 0.03 -0.08 0.00 1.10 0.00 0.00 33.01 34.46 1p6s s GLN 47 CO -0.02 -0.39 1.18 -0.08 -0.55 0.00 0.00 175.29 175.43 1p6s s THR 48 N 1.97 3.71 -0.19 -0.34 -1.32 -1.26 -4.41 115.64 113.81 1p6s s THR 48 Ca 0.15 1.41 0.01 0.00 -1.21 0.00 0.00 61.69 62.04 1p6s s THR 48 Cb 0.02 -3.90 0.03 0.00 -1.51 0.00 0.00 72.50 67.15 1p6s s THR 48 CO -0.14 0.21 -0.13 -1.48 -2.21 0.00 0.00 174.62 170.87 1p6s s LEU 49 N -0.03 2.16 1.00 9.08 2.34 -1.26 -5.12 118.68 126.84 1p6s s LEU 49 Ca 0.53 -0.77 -0.15 0.00 0.06 0.00 0.00 54.13 53.80 1p6s s LEU 49 Cb -0.31 -1.28 0.20 0.00 -0.56 0.00 0.00 46.19 44.23 1p6s s LEU 49 CO 0.35 -0.10 1.21 -2.16 -1.06 0.00 0.00 176.35 174.59 1p6s s PRO 50 N 1.38 0.42 -0.02 1.48 0.04 -1.26 -4.97 135.00 132.07 1p6s s PRO 50 Ca 0.01 -0.10 -0.30 0.00 0.04 0.00 0.00 61.00 60.65 1p6s s PRO 50 Cb -0.15 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.55 1p6s s PRO 50 CO -0.10 -2.61 1.44 -1.25 0.04 0.00 0.00 177.00 174.53 1p6s s PRO 51 N -5.59 4.26 0.06 0.56 0.04 -1.26 -4.59 135.00 128.49 1p6s s PRO 51 Ca 0.70 2.00 -0.00 0.00 0.04 0.00 0.00 61.00 63.73 1p6s s PRO 51 Cb -0.09 -3.65 -0.26 0.00 0.04 0.00 0.00 34.50 30.54 1p6s s PRO 51 CO 0.53 -0.64 1.09 1.25 0.04 0.00 0.00 177.00 179.28 1p6s h LEU 52 N 8.74 0.29 -8.00 -3.56 5.85 -1.26 -3.47 115.31 113.90 1p6s h LEU 52 Ca -0.37 -0.34 -0.26 0.00 0.84 0.00 0.00 57.88 57.75 1p6s h LEU 52 Cb 1.17 -0.09 -0.24 0.00 0.37 0.00 0.00 40.66 41.87 1p6s h LEU 52 CO 0.92 1.27 -0.73 0.21 -0.34 0.00 0.00 178.44 179.77 1p6s s ASN 53 N -6.95 0.55 -0.19 1.25 2.47 0.13 -4.94 114.94 107.28 1p6s s ASN 53 Ca -0.04 -0.34 0.01 0.00 0.42 0.00 0.00 52.86 52.91 1p6s s ASN 53 Cb 0.08 0.01 0.03 0.00 -1.45 0.00 0.00 41.25 39.92 1p6s s ASN 53 CO 0.86 -0.12 -0.14 0.21 -3.72 0.00 0.00 177.10 174.19 1p6s s ASN 54 N -0.94 3.22 -0.07 -4.21 2.47 -1.26 0.59 114.94 114.74 1p6s s ASN 54 Ca -0.06 -0.76 0.05 0.00 0.42 0.00 0.00 52.86 52.50 1p6s s ASN 54 Cb -0.06 -1.31 -0.00 0.00 -1.45 0.00 0.00 41.25 38.42 1p6s s ASN 54 CO -0.00 -0.09 -0.22 -0.36 -3.72 0.00 0.00 177.10 172.71 1p6s s PHE 55 N 1.37 2.24 -0.07 0.43 0.08 -0.30 -4.98 117.98 116.74 1p6s s PHE 55 Ca 0.01 -0.78 0.02 0.00 0.12 0.00 0.00 56.93 56.31 1p6s s PHE 55 Cb -0.15 -1.50 0.01 0.00 -0.57 0.00 0.00 43.02 40.82 1p6s s PHE 55 CO -0.10 -0.29 -0.11 -1.54 -0.10 0.00 0.00 175.22 173.08 1p6s s SER 56 N 0.14 1.73 -0.08 1.36 1.04 -1.26 -0.06 113.70 116.58 1p6s s SER 56 Ca -0.10 -0.29 0.12 0.00 0.48 0.00 0.00 55.95 56.16 1p6s s SER 56 Cb -0.15 -0.80 0.19 0.00 0.10 0.00 0.00 66.02 65.36 1p6s s SER 56 CO 0.05 0.02 1.10 0.55 0.98 0.00 0.00 173.24 175.94 1p6s n VAL 57 N 3.89 1.57 0.04 5.02 3.14 0.10 -4.50 118.33 127.61 1p6s n VAL 57 Ca -0.23 -1.82 -0.13 0.00 -2.96 0.00 0.00 64.34 59.21 1p6s n VAL 57 Cb 0.52 0.02 -0.09 0.00 -1.06 0.00 0.00 33.84 33.23 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 0.00 -0.15 -0.50 1.55 0.00 -1.61 -3.26 119.26 115.28 1p6s h ALA 58 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1p6s h ALA 58 Cb 0.82 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1p6s h ALA 58 CO 0.00 -0.34 0.00 0.39 0.00 0.00 0.00 179.25 179.30 1p6s n GLU 59 N -4.94 2.56 -3.06 0.00 1.02 -1.26 -4.85 120.64 110.11 1p6s n GLU 59 Ca -0.09 -2.39 -0.12 0.00 -0.02 0.00 0.00 57.16 54.54 1p6s n GLU 59 Cb 0.25 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 30.13 1p6s n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1p6s s GLN 61 N -2.72 0.49 0.14 0.00 1.03 -1.26 -4.79 119.66 112.55 1p6s s GLN 61 Ca 0.03 -0.86 0.05 0.00 0.04 0.00 0.00 55.36 54.62 1p6s s GLN 61 Cb 0.00 0.00 -0.04 0.00 0.03 0.00 0.00 33.01 33.01 1p6s s GLN 61 CO 0.02 -0.04 0.05 -0.51 -2.54 0.00 0.00 175.29 172.27 1p6s s LEU 62 N -2.00 3.56 -0.06 2.60 2.01 -1.26 -3.81 118.68 119.71 1p6s s LEU 62 Ca -0.06 -0.21 0.02 0.00 0.01 0.00 0.00 54.13 53.89 1p6s s LEU 62 Cb -0.04 -2.22 0.02 0.00 0.01 0.00 0.00 46.19 43.95 1p6s s LEU 62 CO -0.03 0.12 -0.10 -0.32 1.01 0.00 0.00 176.35 177.03 1p6s s MET 63 N -2.74 1.45 0.21 1.70 -2.45 0.14 -4.93 119.30 112.68 1p6s s MET 63 Ca 0.28 -0.32 -0.26 0.00 -1.25 0.00 0.00 55.69 54.14 1p6s s MET 63 Cb -0.11 -1.25 -0.09 0.00 1.25 0.00 0.00 34.83 34.63 1p6s s MET 63 CO 0.20 -0.01 0.84 -1.59 1.05 0.00 0.00 175.02 175.51 1p6s s LYS 64 N 0.77 4.62 0.36 4.11 -2.85 -1.26 0.60 119.74 126.09 1p6s s LYS 64 Ca -0.13 1.24 -0.08 0.00 -1.00 0.00 0.00 55.97 56.00 1p6s s LYS 64 Cb -0.15 -3.18 0.03 0.00 -2.06 0.00 0.00 37.83 32.47 1p6s s LYS 64 CO 0.02 0.51 0.62 -2.37 0.10 0.00 0.00 175.35 174.23 1p6s n THR 65 N 1.36 0.00 -1.59 3.79 5.66 0.31 -4.90 114.28 118.91 1p6s n THR 65 Ca -0.03 -1.31 0.05 0.00 -3.05 0.00 0.00 64.05 59.71 1p6s n THR 65 Cb 0.49 1.00 0.08 0.00 -1.55 0.00 0.00 70.33 70.35 1p6s n THR 65 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1p6s n GLU 66 N -0.53 0.73 -4.38 1.09 -0.00 -1.26 -1.33 120.64 114.95 1p6s n GLU 66 Ca -0.04 -2.01 -0.19 0.00 -0.00 0.00 0.00 57.16 54.91 1p6s n GLU 66 Cb 0.57 -1.01 -0.14 0.00 -0.00 0.00 0.00 31.44 30.85 1p6s n GLU 66 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1p6s s ARG 67 N -1.60 0.87 0.46 3.44 0.52 -1.26 -3.44 118.95 117.94 1p6s s ARG 67 Ca 0.21 -0.56 0.26 0.00 -0.52 0.00 0.00 55.73 55.11 1p6s s ARG 67 Cb 0.19 -0.84 0.88 0.00 0.52 0.00 0.00 34.95 35.71 1p6s s ARG 67 CO -0.01 0.22 1.80 -1.00 0.02 0.00 0.00 175.30 176.33 1p6s h PRO 68 N 5.38 0.00 -6.18 3.54 0.13 -2.01 -3.48 132.00 129.39 1p6s h PRO 68 Ca -0.35 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.22 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 0.46 0.14 -0.64 1.03 -0.23 0.00 0.00 178.00 178.77 1p6s s ARG 69 N -3.52 2.25 0.81 0.86 0.52 -1.23 -5.12 118.95 113.53 1p6s s ARG 69 Ca 0.02 -1.47 -0.11 0.00 -0.52 0.00 0.00 55.73 53.66 1p6s s ARG 69 Cb 0.09 -2.13 0.08 0.00 0.52 0.00 0.00 34.95 33.51 1p6s s ARG 69 CO 0.62 0.32 1.10 -1.25 0.02 0.00 0.00 175.30 176.12 1p6s s PRO 70 N -3.68 1.92 -0.97 3.54 0.04 -1.22 -4.14 135.00 130.48 1p6s s PRO 70 Ca 0.32 1.19 -0.07 0.00 0.04 0.00 0.00 61.00 62.48 1p6s s PRO 70 Cb -0.06 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 1p6s s PRO 70 CO 0.20 -1.89 0.81 0.09 0.04 0.00 0.00 177.00 176.25 1p6s n ASN 71 N -3.69 -6.60 -4.35 6.66 4.13 -1.24 -4.76 115.26 105.41 1p6s n ASN 71 Ca 0.09 -0.61 -0.22 0.00 1.68 0.00 0.00 54.58 55.52 1p6s n ASN 71 Cb 0.53 -4.65 -0.11 0.00 -1.54 0.00 0.00 39.78 34.01 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 -3.27 1.87 -0.08 3.41 2.01 -0.44 -1.92 115.64 117.21 1p6s s THR 72 Ca 0.31 -1.98 0.02 0.00 0.31 0.00 0.00 61.69 60.34 1p6s s THR 72 Cb -0.06 -1.91 0.01 0.00 0.01 0.00 0.00 72.50 70.56 1p6s s THR 72 CO 0.78 -0.34 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.88 1p6s s PHE 73 N -2.16 1.62 -0.16 4.92 0.08 0.14 -0.53 117.98 121.89 1p6s s PHE 73 Ca 0.18 -0.67 -0.01 0.00 0.12 0.00 0.00 56.93 56.54 1p6s s PHE 73 Cb -0.05 -1.20 -0.01 0.00 -0.57 0.00 0.00 43.02 41.19 1p6s s PHE 73 CO 0.07 -0.36 -0.11 0.08 -0.10 0.00 0.00 175.22 174.81 1p6s s VAL 74 N 0.86 3.14 -0.28 -0.44 1.01 0.20 -0.13 120.40 124.76 1p6s s VAL 74 Ca -0.10 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 1p6s s VAL 74 Cb -0.15 -2.35 0.04 0.00 0.00 0.00 0.00 36.38 33.91 1p6s s VAL 74 CO 0.01 0.50 -0.02 -0.51 0.00 0.00 0.00 175.10 175.08 1p6s s ILE 75 N 0.66 2.98 0.06 2.22 2.07 0.71 0.23 121.20 130.13 1p6s s ILE 75 Ca -0.06 -1.19 0.01 0.00 -1.41 0.00 0.00 60.65 58.00 1p6s s ILE 75 Cb -0.15 -2.62 -0.25 0.00 0.13 0.00 0.00 42.46 39.57 1p6s s ILE 75 CO 0.02 0.04 1.05 0.03 -1.91 0.00 0.00 174.94 174.18 1p6s h ARG 76 N 8.01 0.16 0.00 3.50 2.47 -1.85 -3.45 114.38 123.23 1p6s h ARG 76 Ca -0.27 -0.27 0.00 0.00 -1.26 0.00 0.00 59.98 58.19 1p6s h ARG 76 Cb 1.08 0.10 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 1p6s h ARG 76 CO 0.55 1.05 0.00 0.00 0.56 0.00 0.00 179.97 182.14 1p6s n LEU 78 N 0.00 0.00 0.00 0.00 4.32 -1.26 -4.66 117.00 115.40 1p6s n LEU 78 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1p6s n LEU 78 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1p6s n LEU 78 CO 0.00 -0.21 0.00 0.00 -1.22 0.00 0.00 177.39 175.96 1p6s n GLN 79 N -1.64 0.00 -2.58 3.23 10.64 -1.25 -5.11 117.38 120.67 1p6s n GLN 79 Ca 0.00 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 54.74 1p6s n GLN 79 Cb 0.00 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 29.36 1p6s n GLN 79 CO 0.00 0.00 0.00 -0.46 -1.83 0.00 0.00 177.06 174.77 1p6s s TRP 80 N 0.69 3.24 0.00 2.61 -0.00 -1.26 -4.95 118.94 119.26 1p6s s TRP 80 Ca 0.00 1.35 0.00 0.00 -0.00 0.00 0.00 56.10 57.45 1p6s s TRP 80 Cb 0.00 -3.33 0.00 0.00 -0.00 0.00 0.00 33.47 30.14 1p6s s TRP 80 CO 0.00 -0.85 0.00 2.41 -0.00 0.00 0.00 176.95 178.51 1p6s n THR 81 N 5.02 0.00 -0.48 5.86 -1.04 -1.26 -5.15 114.28 117.23 1p6s n THR 81 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1p6s n THR 81 Cb 0.46 -0.08 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 1p6s n THR 81 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1p6s n THR 82 N -0.06 0.00 -1.64 12.58 -2.24 -1.26 -4.85 114.28 116.80 1p6s n THR 82 Ca 0.00 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 1p6s n THR 82 Cb 0.00 -1.35 -0.01 0.00 -2.10 0.00 0.00 70.33 66.87 1p6s n THR 82 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1p6s n VAL 83 N -1.76 4.33 -2.62 2.28 0.31 -1.26 -4.94 118.33 114.67 1p6s n VAL 83 Ca 0.00 -3.22 -0.22 0.00 -0.01 0.00 0.00 64.34 60.89 1p6s n VAL 83 Cb 0.00 -2.48 0.08 0.00 -0.91 0.00 0.00 33.84 30.53 1p6s n VAL 83 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 1p6s s ILE 84 N 1.53 2.34 -1.42 2.52 2.07 -1.26 -4.97 121.20 122.00 1p6s s ILE 84 Ca 0.59 -0.64 -0.14 0.00 -1.41 0.00 0.00 60.65 59.04 1p6s s ILE 84 Cb 0.16 -2.70 0.05 0.00 0.13 0.00 0.00 42.46 40.11 1p6s s ILE 84 CO -0.07 0.00 2.12 -1.84 -1.91 0.00 0.00 174.94 173.24 1p6s n GLU 85 N -2.61 2.96 0.11 3.50 0.28 -1.26 -4.64 120.64 118.98 1p6s n GLU 85 Ca 0.12 -2.78 0.12 0.00 -0.16 0.00 0.00 57.16 54.46 1p6s n GLU 85 Cb 0.60 -3.30 0.19 0.00 1.43 0.00 0.00 31.44 30.36 1p6s n GLU 85 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 177.13 177.04 1p6s h ARG 86 N 6.28 0.00 -5.28 3.44 0.11 -1.93 -3.45 114.38 113.54 1p6s h ARG 86 Ca 0.54 0.00 -0.65 0.00 0.10 0.00 0.00 59.98 59.97 1p6s h ARG 86 Cb 0.68 0.00 -0.24 0.00 1.11 0.00 0.00 29.97 31.52 1p6s h ARG 86 CO 1.79 0.00 -0.72 0.99 0.10 0.00 0.00 179.97 182.14 1p6s s THR 87 N -3.20 3.46 0.01 0.08 2.01 -1.26 -0.21 115.64 116.53 1p6s s THR 87 Ca 0.06 -0.51 0.05 0.00 0.31 0.00 0.00 61.69 61.60 1p6s s THR 87 Cb 0.11 -2.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.11 1p6s s THR 87 CO 0.70 0.50 -0.15 0.72 -0.69 0.00 0.00 174.62 175.70 1p6s s PHE 88 N 0.45 1.32 0.22 4.92 -0.12 0.81 -4.63 117.98 120.95 1p6s s PHE 88 Ca -0.06 -0.28 0.06 0.00 -0.05 0.00 0.00 56.93 56.59 1p6s s PHE 88 Cb -0.15 -0.83 -0.03 0.00 -0.63 0.00 0.00 43.02 41.38 1p6s s PHE 88 CO 0.04 0.00 0.24 -1.01 -0.05 0.00 0.00 175.22 174.44 1p6s s HIS 89 N -0.50 3.26 0.17 3.49 3.76 0.11 0.25 115.29 125.83 1p6s s HIS 89 Ca 0.05 -0.04 0.06 0.00 -0.15 0.00 0.00 55.06 54.97 1p6s s HIS 89 Cb -0.06 -1.50 -0.04 0.00 1.11 0.00 0.00 32.58 32.09 1p6s s HIS 89 CO 0.00 0.50 0.11 0.14 -0.85 0.00 0.00 174.74 174.64 1p6s s VAL 90 N -1.97 4.32 -0.14 -0.90 -7.23 -0.81 0.68 120.40 114.35 1p6s s VAL 90 Ca 0.33 -1.17 0.29 0.00 -1.81 0.00 0.00 61.98 59.62 1p6s s VAL 90 Cb -0.09 -3.21 0.37 0.00 0.56 0.00 0.00 36.38 34.01 1p6s s VAL 90 CO 0.26 -0.12 1.81 -0.78 -0.31 0.00 0.00 175.10 175.97 1p6s h ASP 91 N 2.44 0.00 -5.06 4.85 1.82 -1.88 -3.43 116.42 115.16 1p6s h ASP 91 Ca -0.47 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.03 1p6s h ASP 91 Cb 1.20 0.00 -0.19 0.00 0.68 0.00 0.00 39.33 41.03 1p6s h ASP 91 CO 0.62 0.00 -0.57 -0.55 -1.61 0.00 0.00 179.24 177.14 1p6s s SER 92 N -5.93 0.19 0.21 2.28 0.15 -1.26 -5.04 113.70 104.29 1p6s s SER 92 Ca 0.04 -0.50 -0.06 0.00 0.70 0.00 0.00 55.95 56.12 1p6s s SER 92 Cb 0.07 0.20 0.15 0.00 -1.71 0.00 0.00 66.02 64.73 1p6s s SER 92 CO 0.60 -0.45 1.67 1.55 1.20 0.00 0.00 173.24 177.81 1p6s h PRO 93 N 3.93 0.95 -0.57 5.44 0.13 -1.95 -2.43 132.00 137.50 1p6s h PRO 93 Ca -0.32 -0.31 -0.04 0.00 -0.87 0.00 0.00 66.00 64.46 1p6s h PRO 93 Cb 1.19 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 1p6s h PRO 93 CO 0.48 0.97 0.18 -0.44 -0.23 0.00 0.00 178.00 178.96 1p6s h ASP 94 N 0.87 0.78 -0.25 1.44 5.19 -2.00 -2.51 116.42 119.94 1p6s h ASP 94 Ca 0.15 -0.12 -0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1p6s h ASP 94 Cb 0.58 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 1p6s h ASP 94 CO 0.03 0.74 0.14 -0.33 -3.12 0.00 0.00 179.24 176.70 1p6s h GLU 95 N 0.83 0.34 -0.90 3.56 3.07 -1.86 -1.22 114.58 118.40 1p6s h GLU 95 Ca 0.19 -0.03 0.11 0.00 -0.50 0.00 0.00 59.36 59.13 1p6s h GLU 95 Cb 0.23 -0.07 -0.07 0.00 -0.84 0.00 0.00 28.75 28.00 1p6s h GLU 95 CO -0.01 0.28 0.58 -0.09 -1.40 0.00 0.00 179.01 178.38 1p6s h ARG 96 N 0.30 0.82 -0.32 2.33 1.12 -1.04 0.54 114.38 118.12 1p6s h ARG 96 Ca 0.09 -0.05 -0.15 0.00 -1.11 0.00 0.00 59.98 58.76 1p6s h ARG 96 Cb 0.04 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 29.80 1p6s h ARG 96 CO -0.02 0.54 -0.39 0.93 -3.11 0.00 0.00 179.97 177.92 1p6s h GLU 97 N 0.84 0.77 -0.38 0.20 3.07 -1.00 -2.55 114.58 115.53 1p6s h GLU 97 Ca 0.43 -0.40 -0.12 0.00 -0.50 0.00 0.00 59.36 58.78 1p6s h GLU 97 Cb 0.50 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 1p6s h GLU 97 CO -0.20 1.03 -0.22 1.49 -1.40 0.00 0.00 179.01 179.71 1p6s h GLU 98 N 0.63 0.82 -0.65 2.33 4.81 0.06 -2.53 114.58 120.06 1p6s h GLU 98 Ca 0.05 -0.37 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1p6s h GLU 98 Cb 0.95 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.28 1p6s h GLU 98 CO 0.09 1.00 0.39 -1.49 -0.73 0.00 0.00 179.01 178.27 1p6s h TRP 99 N 0.62 0.85 -0.11 0.92 -0.00 -0.93 1.00 115.95 118.29 1p6s h TRP 99 Ca 0.08 -0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.97 1p6s h TRP 99 Cb 0.78 -0.28 -0.01 0.00 -0.00 0.00 0.00 29.16 29.65 1p6s h TRP 99 CO 0.06 0.57 0.06 1.98 -0.00 0.00 0.00 178.44 181.11 1p6s h MET 100 N 0.88 0.13 -0.56 0.49 4.05 -1.37 0.17 114.93 118.71 1p6s h MET 100 Ca 0.23 -0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.58 1p6s h MET 100 Cb -0.03 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.72 1p6s h MET 100 CO -0.04 0.08 0.10 -0.09 0.23 0.00 0.00 176.91 177.19 1p6s h ARG 101 N 0.13 0.89 -0.44 0.39 9.65 -1.17 -2.34 114.38 121.48 1p6s h ARG 101 Ca 0.04 -0.21 -0.08 0.00 -1.10 0.00 0.00 59.98 58.63 1p6s h ARG 101 Cb -0.00 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.44 1p6s h ARG 101 CO -0.02 0.83 -0.04 0.00 2.80 0.00 0.00 179.97 183.53 1p6s h ALA 102 N 1.25 0.60 -0.34 2.80 0.00 -0.34 0.21 119.26 123.44 1p6s h ALA 102 Ca 0.18 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1p6s h ALA 102 Cb 0.37 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1p6s h ALA 102 CO 0.01 0.44 0.19 0.82 0.00 0.00 0.00 179.25 180.70 1p6s h ILE 103 N 0.65 1.02 -0.26 0.00 2.04 -0.42 -0.54 117.51 120.01 1p6s h ILE 103 Ca 0.12 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 1p6s h ILE 103 Cb 0.56 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1p6s h ILE 103 CO 0.03 0.07 -0.06 1.56 0.00 0.00 0.00 178.15 179.75 1p6s h GLN 104 N 0.39 0.50 -0.34 2.37 1.08 -1.31 0.46 115.11 118.25 1p6s h GLN 104 Ca 0.14 -0.19 0.03 0.00 -1.45 0.00 0.00 58.65 57.18 1p6s h GLN 104 Cb 0.02 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.39 1p6s h GLN 104 CO -0.08 0.71 0.16 1.98 -0.95 0.00 0.00 178.83 180.65 1p6s h MET 105 N 0.24 0.32 -0.16 1.46 4.05 -0.69 0.15 114.93 120.30 1p6s h MET 105 Ca 0.07 -0.02 -0.08 0.00 -0.28 0.00 0.00 59.70 59.38 1p6s h MET 105 Cb 0.53 -0.07 -0.00 0.00 -0.80 0.00 0.00 31.60 31.26 1p6s h MET 105 CO 0.03 0.21 -0.23 0.28 0.23 0.00 0.00 176.91 177.42 1p6s h VAL 106 N 0.33 1.35 -0.48 -5.77 2.07 -1.09 -3.08 116.25 109.58 1p6s h VAL 106 Ca 0.14 -1.45 0.06 0.00 0.82 0.00 0.00 66.70 66.27 1p6s h VAL 106 Cb 0.07 1.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 1p6s h VAL 106 CO -0.11 0.43 0.32 0.00 0.02 0.00 0.00 177.57 178.23 1p6s h ALA 107 N 0.58 1.90 0.00 1.67 0.00 -0.65 -0.04 119.26 122.73 1p6s h ALA 107 Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1p6s h ALA 107 Cb 0.80 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1p6s h ALA 107 CO 0.05 0.01 -0.05 -0.91 0.00 0.00 0.00 179.25 178.36 1p6s h ASN 108 N 0.43 0.00 0.13 0.00 2.35 -0.62 0.57 115.58 118.44 1p6s h ASN 108 Ca 0.21 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.59 1p6s h ASN 108 Cb 0.28 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 1p6s h ASN 108 CO -0.05 0.05 -1.99 -0.24 -1.65 0.00 0.00 177.43 173.54 1p6s n SER 109 N -3.33 2.11 -0.63 5.81 2.88 -0.06 -4.42 113.62 115.97 1p6s n SER 109 Ca -0.02 0.21 0.06 0.00 -1.33 0.00 0.00 58.87 57.80 1p6s n SER 109 Cb 0.19 -0.85 0.20 0.00 -0.75 0.00 0.00 64.21 63.00 1p6s n SER 109 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1p6s n LEU 110 N -3.47 3.24 0.00 2.46 -0.00 -1.01 -5.15 117.00 113.07 1p6s n LEU 110 Ca -0.32 -3.34 0.00 0.00 -0.00 0.00 0.00 56.01 52.35 1p6s n LEU 110 Cb 1.05 -0.52 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1p6s n LEU 110 CO 0.43 0.92 0.00 0.29 -0.00 0.00 0.00 177.39 179.03