#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 -0.14 -0.96 7.83 4.22 -1.26 -5.03 114.94 119.60 1p6s s ASN 2 Ca 0.00 -0.48 -0.09 0.00 -2.14 0.00 0.00 52.86 50.16 1p6s s ASN 2 Cb 0.00 0.51 -0.02 0.00 1.28 0.00 0.00 41.25 43.02 1p6s s ASN 2 CO 0.00 -0.95 0.78 1.21 -2.04 0.00 0.00 177.10 176.09 1p6s n GLU 3 N -0.51 -1.55 -3.56 3.55 2.13 -1.26 -4.96 120.64 114.49 1p6s n GLU 3 Ca -0.06 0.90 -0.37 0.00 0.66 0.00 0.00 57.16 58.29 1p6s n GLU 3 Cb 0.60 -4.83 -0.09 0.00 0.27 0.00 0.00 31.44 27.39 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 -3.25 5.29 0.64 6.31 1.01 -1.26 -5.07 120.40 124.06 1p6s s VAL 4 Ca 0.28 0.34 -0.07 0.00 0.00 0.00 0.00 61.98 62.53 1p6s s VAL 4 Cb -0.07 -3.58 0.02 0.00 0.00 0.00 0.00 36.38 32.75 1p6s s VAL 4 CO 0.80 0.29 0.97 -0.94 0.00 0.00 0.00 175.10 176.22 1p6s s SER 5 N 1.23 5.44 0.03 3.32 1.04 -1.26 -4.77 113.70 118.72 1p6s s SER 5 Ca 0.11 0.78 -0.22 0.00 0.48 0.00 0.00 55.95 57.10 1p6s s SER 5 Cb -0.14 -1.67 -0.06 0.00 0.10 0.00 0.00 66.02 64.25 1p6s s SER 5 CO 0.07 -1.21 0.64 -0.69 0.98 0.00 0.00 173.24 173.02 1p6s s VAL 6 N -3.12 4.82 -0.25 5.02 1.01 -1.26 0.10 120.40 126.72 1p6s s VAL 6 Ca 0.56 1.35 0.05 0.00 0.00 0.00 0.00 61.98 63.94 1p6s s VAL 6 Cb -0.11 -3.98 -0.19 0.00 0.00 0.00 0.00 36.38 32.11 1p6s s VAL 6 CO 0.47 0.43 -0.17 -0.38 0.00 0.00 0.00 175.10 175.45 1p6s n ILE 7 N 2.54 1.46 -3.77 2.22 -0.00 0.19 -4.80 119.36 117.20 1p6s n ILE 7 Ca -0.06 -0.63 -0.10 0.00 -0.00 0.00 0.00 62.75 61.96 1p6s n ILE 7 Cb 0.51 -1.21 -0.06 0.00 -0.00 0.00 0.00 39.64 38.87 1p6s n ILE 7 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 1p6s s LYS 8 N -2.51 0.98 -0.01 0.38 2.20 -0.99 -5.00 119.74 114.79 1p6s s LYS 8 Ca -0.30 -0.87 0.00 0.00 -0.36 0.00 0.00 55.97 54.45 1p6s s LYS 8 Cb 0.08 0.40 0.01 0.00 -1.51 0.00 0.00 37.83 36.82 1p6s s LYS 8 CO 0.65 -0.35 0.01 -1.83 -0.36 0.00 0.00 175.35 173.46 1p6s s GLU 9 N -3.85 0.01 0.13 4.03 -1.05 -1.26 0.25 118.70 116.96 1p6s s GLU 9 Ca 0.05 0.07 -0.26 0.00 -0.15 0.00 0.00 54.97 54.69 1p6s s GLU 9 Cb 0.03 -0.13 0.07 0.00 -0.44 0.00 0.00 34.13 33.67 1p6s s GLU 9 CO -0.10 -0.07 1.02 0.20 0.95 0.00 0.00 175.26 177.26 1p6s s GLY 10 N 0.46 -0.24 -0.17 -3.83 0.00 -0.27 -5.01 107.32 98.26 1p6s s GLY 10 Ca -0.04 0.18 -0.08 0.00 0.00 0.00 0.00 44.72 44.78 1p6s s GLY 10 CO -0.01 0.18 0.10 -0.98 0.00 0.00 0.00 173.10 172.39 1p6s s TRP 11 N -3.07 3.37 0.03 1.90 0.52 -1.26 0.73 118.94 121.15 1p6s s TRP 11 Ca 0.13 0.26 0.05 0.00 0.02 0.00 0.00 56.10 56.57 1p6s s TRP 11 Cb -0.00 -2.07 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 1p6s s TRP 11 CO 0.02 0.33 -0.16 -0.51 0.02 0.00 0.00 176.95 176.65 1p6s s LEU 12 N 0.06 2.13 0.15 2.99 1.43 0.13 -3.48 118.68 122.08 1p6s s LEU 12 Ca 0.08 -0.42 -0.27 0.00 -1.03 0.00 0.00 54.13 52.49 1p6s s LEU 12 Cb -0.12 -0.73 -0.07 0.00 0.03 0.00 0.00 46.19 45.30 1p6s s LEU 12 CO -0.00 0.10 0.83 -1.00 0.23 0.00 0.00 176.35 176.52 1p6s s HIS 13 N -0.70 3.88 -0.05 0.29 3.76 0.33 0.07 115.29 122.87 1p6s s HIS 13 Ca 0.04 1.68 0.05 0.00 -0.15 0.00 0.00 55.06 56.68 1p6s s HIS 13 Cb -0.07 -2.86 -0.00 0.00 1.11 0.00 0.00 32.58 30.75 1p6s s HIS 13 CO 0.01 0.41 -0.19 0.21 -0.85 0.00 0.00 174.74 174.32 1p6s s LYS 14 N -0.76 2.05 0.24 1.40 2.36 0.12 -0.23 119.74 124.93 1p6s s LYS 14 Ca 0.39 -0.70 -0.30 0.00 -2.55 0.00 0.00 55.97 52.82 1p6s s LYS 14 Cb -0.23 -1.75 -0.09 0.00 -1.05 0.00 0.00 37.83 34.71 1p6s s LYS 14 CO 0.27 0.27 1.22 0.50 1.55 0.00 0.00 175.35 179.17 1p6s s ARG 15 N 0.01 4.48 0.00 4.03 3.00 -1.26 -0.69 118.95 128.52 1p6s s ARG 15 Ca -0.05 1.97 0.00 0.00 -1.00 0.00 0.00 55.73 56.65 1p6s s ARG 15 Cb -0.13 -3.18 0.00 0.00 0.00 0.00 0.00 34.95 31.64 1p6s s ARG 15 CO 0.03 -0.07 0.83 0.41 0.00 0.00 0.00 175.30 176.50 1p6s n GLY 16 N 1.67 -2.95 1.62 8.12 0.00 -0.70 -4.92 105.19 108.02 1p6s n GLY 16 Ca 0.02 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 -1.88 0.00 -0.05 1.61 4.07 -1.26 -5.01 120.64 118.12 1p6s n GLU 17 Ca 0.00 0.00 -0.05 0.00 -0.06 0.00 0.00 57.16 57.05 1p6s n GLU 17 Cb 0.00 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.31 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 -2.44 0.00 -1.23 4.31 0.18 -1.26 -5.02 117.16 111.70 1p6s n TYR 18 Ca 0.00 0.00 -0.30 0.00 1.88 0.00 0.00 57.90 59.48 1p6s n TYR 18 Cb 0.00 -0.45 0.13 0.00 -0.38 0.00 0.00 39.34 38.64 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 -2.22 2.72 -0.54 -3.48 2.07 -1.26 -4.93 121.20 113.55 1p6s s ILE 19 Ca -0.07 0.23 -0.03 0.00 -1.41 0.00 0.00 60.65 59.38 1p6s s ILE 19 Cb 0.03 -2.74 0.22 0.00 0.13 0.00 0.00 42.46 40.10 1p6s s ILE 19 CO 0.36 -0.30 2.33 0.29 -1.91 0.00 0.00 174.94 175.71 1p6s n LYS 20 N -3.83 2.39 -4.83 3.50 5.02 -1.26 -4.63 118.16 114.52 1p6s n LYS 20 Ca 0.07 -2.58 -0.33 0.00 -2.02 0.00 0.00 58.31 53.46 1p6s n LYS 20 Cb 0.55 -2.08 -0.13 0.00 -0.02 0.00 0.00 35.03 33.35 1p6s n LYS 20 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1p6s s THR 21 N -3.27 3.15 -0.16 -0.18 2.01 -1.26 -5.06 115.64 110.86 1p6s s THR 21 Ca 0.52 -0.68 0.01 0.00 0.31 0.00 0.00 61.69 61.86 1p6s s THR 21 Cb 0.38 -2.26 0.02 0.00 0.01 0.00 0.00 72.50 70.65 1p6s s THR 21 CO -0.18 0.58 -0.20 0.26 -0.69 0.00 0.00 174.62 174.39 1p6s s TRP 22 N -0.51 2.63 -0.10 4.92 0.52 -1.26 -1.73 118.94 123.41 1p6s s TRP 22 Ca 0.07 -1.47 -0.05 0.00 0.02 0.00 0.00 56.10 54.66 1p6s s TRP 22 Cb -0.12 -1.82 -0.04 0.00 -1.15 0.00 0.00 33.47 30.34 1p6s s TRP 22 CO 0.02 -0.72 0.11 1.03 0.02 0.00 0.00 176.95 177.41 1p6s s ARG 23 N 1.16 3.32 0.29 4.98 1.81 0.13 -4.71 118.95 125.94 1p6s s ARG 23 Ca 0.01 -0.22 -0.29 0.00 -1.72 0.00 0.00 55.73 53.51 1p6s s ARG 23 Cb -0.14 -3.08 -0.10 0.00 -0.45 0.00 0.00 34.95 31.18 1p6s s ARG 23 CO -0.09 0.75 1.28 -1.25 -0.68 0.00 0.00 175.30 175.31 1p6s s PRO 24 N -1.09 4.41 0.01 3.54 0.04 -1.26 0.16 135.00 140.81 1p6s s PRO 24 Ca 0.16 2.12 -0.00 0.00 0.04 0.00 0.00 61.00 63.31 1p6s s PRO 24 Cb -0.12 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.30 1p6s s PRO 24 CO 0.05 -0.14 -0.01 1.03 0.04 0.00 0.00 177.00 177.97 1p6s s ARG 25 N -1.36 0.11 -0.47 4.56 3.00 0.11 -4.87 118.95 120.03 1p6s s ARG 25 Ca 0.50 -0.22 -0.28 0.00 0.00 0.00 0.00 55.73 55.73 1p6s s ARG 25 Cb -0.38 0.04 0.01 0.00 0.00 0.00 0.00 34.95 34.62 1p6s s ARG 25 CO 0.48 -0.02 1.41 -0.47 0.00 0.00 0.00 175.30 176.70 1p6s s TYR 26 N -0.53 2.36 -0.10 -0.53 5.04 0.26 0.20 117.35 124.05 1p6s s TYR 26 Ca -0.06 0.60 -0.11 0.00 -2.44 0.00 0.00 57.07 55.07 1p6s s TYR 26 Cb -0.04 -4.35 -0.05 0.00 0.35 0.00 0.00 41.96 37.88 1p6s s TYR 26 CO -0.00 -1.95 0.25 -0.06 -1.34 0.00 0.00 175.55 172.44 1p6s s PHE 27 N 5.69 3.60 -0.13 4.97 0.40 0.22 0.26 117.98 133.00 1p6s s PHE 27 Ca 0.58 0.67 0.02 0.00 -0.60 0.00 0.00 56.93 57.60 1p6s s PHE 27 Cb -0.12 -2.14 0.01 0.00 0.51 0.00 0.00 43.02 41.28 1p6s s PHE 27 CO 0.30 0.59 -0.20 -0.51 0.70 0.00 0.00 175.22 176.09 1p6s s LEU 28 N -0.67 2.00 -0.10 -0.37 2.01 0.60 -1.11 118.68 121.05 1p6s s LEU 28 Ca 0.17 -0.55 -0.13 0.00 0.01 0.00 0.00 54.13 53.63 1p6s s LEU 28 Cb -0.14 -1.34 -0.05 0.00 0.01 0.00 0.00 46.19 44.68 1p6s s LEU 28 CO 0.06 0.07 0.32 -0.22 1.01 0.00 0.00 176.35 177.59 1p6s s LEU 29 N 0.82 4.35 0.47 1.79 0.20 0.14 -0.68 118.68 125.77 1p6s s LEU 29 Ca -0.08 0.68 0.06 0.00 0.69 0.00 0.00 54.13 55.48 1p6s s LEU 29 Cb -0.16 -2.42 -0.02 0.00 -0.43 0.00 0.00 46.19 43.17 1p6s s LEU 29 CO -0.01 0.22 0.24 -0.54 -0.29 0.00 0.00 176.35 175.97 1p6s s LYS 30 N -0.28 2.25 0.00 1.98 -0.14 -0.20 0.54 119.74 123.89 1p6s s LYS 30 Ca 0.19 -1.95 0.23 0.00 -1.36 0.00 0.00 55.97 53.08 1p6s s LYS 30 Cb -0.14 -1.99 1.21 0.00 -1.68 0.00 0.00 37.83 35.23 1p6s s LYS 30 CO 0.08 -0.31 1.76 0.45 -0.76 0.00 0.00 175.35 176.56 1p6s n SER 31 N -1.43 0.00 -0.08 2.83 2.88 0.12 -2.97 113.62 114.96 1p6s n SER 31 Ca -0.03 -0.17 0.14 0.00 -1.33 0.00 0.00 58.87 57.48 1p6s n SER 31 Cb 0.65 -0.23 0.81 0.00 -0.75 0.00 0.00 64.21 64.68 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 -1.23 0.23 -0.54 -3.46 2.03 -1.26 -4.86 116.55 107.45 1p6s n ASP 32 Ca 0.12 -1.16 -0.01 0.00 0.52 0.00 0.00 54.79 54.26 1p6s n ASP 32 Cb 0.16 -0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.56 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 0.99 0.82 3.41 0.27 0.00 -1.16 -4.58 105.19 104.94 1p6s n GLY 33 Ca 0.21 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.01 -0.50 -0.04 1.61 1.04 -1.26 0.32 113.70 111.86 1p6s s SER 34 Ca 0.02 0.82 0.04 0.00 0.48 0.00 0.00 55.95 57.31 1p6s s SER 34 Cb -0.01 0.84 -0.00 0.00 0.10 0.00 0.00 66.02 66.95 1p6s s SER 34 CO 0.02 -0.30 -0.16 0.72 0.98 0.00 0.00 173.24 174.50 1p6s s PHE 35 N -0.26 1.61 -0.16 5.02 -0.71 0.38 -1.04 117.98 122.82 1p6s s PHE 35 Ca -0.04 -0.47 -0.06 0.00 -1.04 0.00 0.00 56.93 55.32 1p6s s PHE 35 Cb -0.03 -1.10 -0.04 0.00 -1.21 0.00 0.00 43.02 40.64 1p6s s PHE 35 CO 0.03 -0.17 0.03 0.42 -1.34 0.00 0.00 175.22 174.19 1p6s s ILE 36 N 0.11 4.56 -0.15 -4.49 1.09 0.14 -1.32 121.20 121.15 1p6s s ILE 36 Ca -0.05 -0.12 -0.10 0.00 -1.10 0.00 0.00 60.65 59.27 1p6s s ILE 36 Cb -0.12 -3.02 -0.05 0.00 -1.06 0.00 0.00 42.46 38.22 1p6s s ILE 36 CO 0.02 0.50 0.19 -0.83 -0.10 0.00 0.00 174.94 174.72 1p6s s GLY 37 N 0.09 2.14 -0.01 6.18 0.00 0.15 -0.29 107.32 115.59 1p6s s GLY 37 Ca 0.04 -0.59 0.03 0.00 0.00 0.00 0.00 44.72 44.20 1p6s s GLY 37 CO 0.01 0.05 -0.09 -0.47 0.00 0.00 0.00 173.10 172.60 1p6s s TYR 38 N -0.12 2.83 0.32 1.90 6.14 0.14 -0.04 117.35 128.51 1p6s s TYR 38 Ca 0.13 -0.07 0.06 0.00 0.64 0.00 0.00 57.07 57.83 1p6s s TYR 38 Cb -0.12 -1.61 0.73 0.00 0.42 0.00 0.00 41.96 41.38 1p6s s TYR 38 CO 0.02 0.33 1.82 -0.22 0.64 0.00 0.00 175.55 178.14 1p6s h LYS 39 N 4.73 0.77 0.00 4.97 3.64 -1.90 0.75 116.57 129.53 1p6s h LYS 39 Ca -0.48 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 1p6s h LYS 39 Cb 1.17 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1p6s h LYS 39 CO 0.52 0.51 0.00 -1.91 -2.27 0.00 0.00 179.45 176.30 1p6s n GLU 40 N -4.65 0.00 -2.26 1.90 2.13 -1.26 -4.51 120.64 111.99 1p6s n GLU 40 Ca 0.20 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.59 1p6s n GLU 40 Cb 0.49 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.18 1p6s n GLU 40 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1p6s s ARG 41 N -0.86 3.69 0.18 5.31 3.00 -1.26 -4.57 118.95 124.42 1p6s s ARG 41 Ca 0.00 1.28 -0.30 0.00 0.00 0.00 0.00 55.73 56.71 1p6s s ARG 41 Cb 0.00 -4.01 -0.07 0.00 0.00 0.00 0.00 34.95 30.86 1p6s s ARG 41 CO 0.00 -1.42 1.00 -1.25 0.00 0.00 0.00 175.30 173.63 1p6s s PRO 42 N 4.77 4.71 0.01 3.54 0.04 -1.26 -4.73 135.00 142.08 1p6s s PRO 42 Ca 0.65 1.56 0.00 0.00 0.04 0.00 0.00 61.00 63.25 1p6s s PRO 42 Cb -0.19 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.04 1p6s s PRO 42 CO 0.29 0.26 0.00 -1.91 0.04 0.00 0.00 177.00 175.68 1p6s n GLU 43 N 2.20 0.00 -1.27 4.56 4.07 -1.26 -5.11 120.64 123.83 1p6s n GLU 43 Ca 0.01 0.00 0.15 0.00 -0.06 0.00 0.00 57.16 57.26 1p6s n GLU 43 Cb 0.47 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.77 1p6s n GLU 43 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1p6s n ALA 44 N -2.26 -3.27 -0.04 4.31 0.00 -1.26 -4.61 120.51 113.38 1p6s n ALA 44 Ca 0.00 0.82 -0.15 0.00 0.00 0.00 0.00 53.44 54.10 1p6s n ALA 44 Cb 0.00 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 17.98 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 -1.19 0.51 0.00 0.00 0.13 -2.02 -3.42 132.00 126.01 1p6s h PRO 45 Ca -0.17 -0.39 -0.20 0.00 -0.87 0.00 0.00 66.00 64.37 1p6s h PRO 45 Cb 1.20 0.07 -0.14 0.00 0.13 0.00 0.00 31.00 32.26 1p6s h PRO 45 CO 0.07 1.01 -0.29 -3.47 -0.23 0.00 0.00 178.00 175.08 1p6s n ASP 46 N -4.28 -1.93 -3.15 1.44 2.03 -1.26 -5.09 116.55 104.31 1p6s n ASP 46 Ca -0.07 -2.76 0.05 0.00 0.52 0.00 0.00 54.79 52.53 1p6s n ASP 46 Cb 0.56 1.35 -0.01 0.00 -0.72 0.00 0.00 41.12 42.30 1p6s n ASP 46 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1p6s s GLN 47 N 0.19 0.20 0.16 -0.67 -0.44 -1.26 -5.13 119.66 112.71 1p6s s GLN 47 Ca 0.20 0.27 -0.31 0.00 -2.50 0.00 0.00 55.36 53.02 1p6s s GLN 47 Cb 0.32 0.14 -0.11 0.00 -1.64 0.00 0.00 33.01 31.72 1p6s s GLN 47 CO -0.08 -0.29 1.68 -0.08 0.50 0.00 0.00 175.29 177.02 1p6s s THR 48 N 2.95 2.45 0.22 -0.34 -1.32 -1.26 -4.67 115.64 113.67 1p6s s THR 48 Ca 0.13 0.23 0.04 0.00 -1.21 0.00 0.00 61.69 60.88 1p6s s THR 48 Cb -0.07 -3.15 -0.03 0.00 -1.51 0.00 0.00 72.50 67.74 1p6s s THR 48 CO -0.17 0.01 0.36 -0.76 -2.21 0.00 0.00 174.62 171.84 1p6s s LEU 49 N 1.62 4.30 0.59 9.08 1.43 -1.26 -5.09 118.68 129.35 1p6s s LEU 49 Ca 0.74 0.14 -0.16 0.00 -1.03 0.00 0.00 54.13 53.82 1p6s s LEU 49 Cb -0.46 -2.92 -0.04 0.00 0.03 0.00 0.00 46.19 42.81 1p6s s LEU 49 CO 0.32 -0.05 1.07 -2.16 0.23 0.00 0.00 176.35 175.76 1p6s s PRO 50 N -3.77 3.26 0.63 1.29 0.04 -1.26 -5.02 135.00 130.17 1p6s s PRO 50 Ca 0.35 1.28 -0.15 0.00 0.04 0.00 0.00 61.00 62.51 1p6s s PRO 50 Cb -0.10 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.41 1p6s s PRO 50 CO 0.29 -0.86 1.10 -1.25 0.04 0.00 0.00 177.00 176.32 1p6s s PRO 51 N -3.95 2.97 -0.20 0.56 0.04 -1.26 -4.99 135.00 128.17 1p6s s PRO 51 Ca 0.65 1.35 0.18 0.00 0.04 0.00 0.00 61.00 63.22 1p6s s PRO 51 Cb -0.17 -1.98 -0.25 0.00 0.04 0.00 0.00 34.50 32.14 1p6s s PRO 51 CO 0.36 -1.11 0.07 -0.11 0.04 0.00 0.00 177.00 176.25 1p6s n LEU 52 N -2.25 0.00 -3.89 -3.56 7.94 -1.22 -4.96 117.00 109.06 1p6s n LEU 52 Ca 0.10 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.82 1p6s n LEU 52 Cb 0.52 0.49 -0.16 0.00 0.53 0.00 0.00 43.42 44.81 1p6s n LEU 52 CO 0.47 0.49 -0.40 0.21 -1.11 0.00 0.00 177.39 177.06 1p6s s ASN 53 N -5.45 0.66 -0.02 1.96 2.47 0.94 -4.99 114.94 110.50 1p6s s ASN 53 Ca -0.10 -0.08 0.07 0.00 0.42 0.00 0.00 52.86 53.16 1p6s s ASN 53 Cb 0.06 -0.26 -0.02 0.00 -1.45 0.00 0.00 41.25 39.59 1p6s s ASN 53 CO 0.82 -0.03 -0.22 0.54 -3.72 0.00 0.00 177.10 174.49 1p6s s ASN 54 N 0.61 2.64 -0.02 -4.21 2.20 -1.26 0.33 114.94 115.22 1p6s s ASN 54 Ca -0.07 -0.41 0.01 0.00 -0.94 0.00 0.00 52.86 51.44 1p6s s ASN 54 Cb -0.10 -0.35 0.02 0.00 -2.00 0.00 0.00 41.25 38.81 1p6s s ASN 54 CO -0.00 0.27 -0.00 -0.36 -2.94 0.00 0.00 177.10 174.06 1p6s s PHE 55 N -0.46 0.30 -0.08 1.54 0.40 -0.43 -4.94 117.98 114.31 1p6s s PHE 55 Ca 0.07 -0.01 0.02 0.00 -0.60 0.00 0.00 56.93 56.41 1p6s s PHE 55 Cb -0.09 -0.37 0.01 0.00 0.51 0.00 0.00 43.02 43.08 1p6s s PHE 55 CO -0.00 -0.11 -0.13 0.45 0.70 0.00 0.00 175.22 176.13 1p6s s SER 56 N 0.84 1.97 -0.09 1.36 0.15 -1.26 -0.47 113.70 116.19 1p6s s SER 56 Ca -0.08 -0.33 0.15 0.00 0.70 0.00 0.00 55.95 56.39 1p6s s SER 56 Cb -0.12 -0.89 0.33 0.00 -1.71 0.00 0.00 66.02 63.63 1p6s s SER 56 CO -0.01 0.02 1.15 0.55 1.20 0.00 0.00 173.24 176.15 1p6s n VAL 57 N 3.95 1.05 0.01 4.45 3.14 0.15 -4.69 118.33 126.40 1p6s n VAL 57 Ca -0.21 -1.79 -0.01 0.00 -2.96 0.00 0.00 64.34 59.36 1p6s n VAL 57 Cb 0.52 0.30 -0.00 0.00 -1.06 0.00 0.00 33.84 33.59 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 0.66 -0.25 -0.84 1.55 0.00 -1.67 -3.37 119.26 115.34 1p6s h ALA 58 Ca -0.08 -0.01 -0.50 0.00 0.00 0.00 0.00 54.91 54.32 1p6s h ALA 58 Cb 1.37 0.02 -0.27 0.00 0.00 0.00 0.00 17.79 18.91 1p6s h ALA 58 CO 0.03 -0.25 0.45 -1.91 0.00 0.00 0.00 179.25 177.58 1p6s n GLU 59 N -2.50 2.39 -2.52 0.00 2.13 -1.26 -4.83 120.64 114.04 1p6s n GLU 59 Ca -0.01 -3.22 -0.06 0.00 0.66 0.00 0.00 57.16 54.53 1p6s n GLU 59 Cb 0.02 -2.14 -0.01 0.00 0.27 0.00 0.00 31.44 29.58 1p6s n GLU 59 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1p6s s GLN 61 N -2.36 2.13 -0.02 0.00 -0.44 -1.26 -4.97 119.66 112.75 1p6s s GLN 61 Ca 0.00 -0.57 0.05 0.00 -2.50 0.00 0.00 55.36 52.34 1p6s s GLN 61 Cb 0.00 -1.70 -0.01 0.00 -1.64 0.00 0.00 33.01 29.66 1p6s s GLN 61 CO 0.00 0.09 -0.17 -1.17 0.50 0.00 0.00 175.29 174.54 1p6s s LEU 62 N 0.52 2.00 0.05 3.68 0.20 -1.26 -2.85 118.68 121.02 1p6s s LEU 62 Ca -0.15 -0.33 0.03 0.00 0.69 0.00 0.00 54.13 54.37 1p6s s LEU 62 Cb -0.16 -0.92 -0.03 0.00 -0.43 0.00 0.00 46.19 44.65 1p6s s LEU 62 CO 0.05 0.20 -0.09 0.00 -0.29 0.00 0.00 176.35 176.22 1p6s s MET 63 N -0.30 0.61 0.31 1.98 0.23 0.14 -4.98 119.30 117.28 1p6s s MET 63 Ca 0.04 -0.84 -0.05 0.00 -1.03 0.00 0.00 55.69 53.81 1p6s s MET 63 Cb -0.08 -0.40 -0.05 0.00 -1.53 0.00 0.00 34.83 32.77 1p6s s MET 63 CO -0.00 0.07 0.58 -1.59 -2.03 0.00 0.00 175.02 172.05 1p6s s LYS 64 N -1.76 3.64 0.24 3.16 0.00 -1.26 -0.12 119.74 123.63 1p6s s LYS 64 Ca -0.07 0.04 -0.14 0.00 0.00 0.00 0.00 55.97 55.80 1p6s s LYS 64 Cb -0.09 -2.62 0.00 0.00 0.00 0.00 0.00 37.83 35.12 1p6s s LYS 64 CO 0.01 0.18 0.49 -0.08 0.00 0.00 0.00 175.35 175.94 1p6s s THR 65 N -2.14 0.01 -0.18 3.79 -1.32 0.54 -4.87 115.64 111.47 1p6s s THR 65 Ca 0.45 -1.30 0.16 0.00 -1.21 0.00 0.00 61.69 59.78 1p6s s THR 65 Cb -0.11 -2.09 0.45 0.00 -1.51 0.00 0.00 72.50 69.24 1p6s s THR 65 CO 0.31 -0.03 1.33 -1.84 -2.21 0.00 0.00 174.62 172.18 1p6s n GLU 66 N -0.37 2.21 -4.00 7.08 0.28 -1.26 -1.27 120.64 123.30 1p6s n GLU 66 Ca -0.03 -2.83 -0.10 0.00 -0.16 0.00 0.00 57.16 54.04 1p6s n GLU 66 Cb 0.62 -1.73 -0.11 0.00 1.43 0.00 0.00 31.44 31.65 1p6s n GLU 66 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 1p6s s ARG 67 N -2.92 0.36 0.41 3.44 1.70 -1.26 -3.55 118.95 117.13 1p6s s ARG 67 Ca 0.39 -0.62 0.29 0.00 -0.47 0.00 0.00 55.73 55.32 1p6s s ARG 67 Cb 0.33 -0.00 1.13 0.00 -0.57 0.00 0.00 34.95 35.84 1p6s s ARG 67 CO 0.05 -0.02 1.85 -1.00 -1.08 0.00 0.00 175.30 175.10 1p6s h PRO 68 N 4.68 0.00 -6.13 3.89 0.13 -2.01 -3.48 132.00 129.09 1p6s h PRO 68 Ca -0.33 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.20 1p6s h PRO 68 Cb 1.21 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 1p6s h PRO 68 CO 0.41 0.00 -0.71 1.03 -0.23 0.00 0.00 178.00 178.50 1p6s s ARG 69 N -3.47 1.83 0.80 0.86 1.81 -1.24 -5.13 118.95 114.41 1p6s s ARG 69 Ca 0.03 -1.76 -0.11 0.00 -1.72 0.00 0.00 55.73 52.18 1p6s s ARG 69 Cb 0.09 -1.82 0.07 0.00 -0.45 0.00 0.00 34.95 32.84 1p6s s ARG 69 CO 0.49 0.27 1.10 -1.25 -0.68 0.00 0.00 175.30 175.23 1p6s s PRO 70 N -3.58 2.02 -0.94 3.54 0.04 -1.23 -4.19 135.00 130.66 1p6s s PRO 70 Ca 0.31 1.18 -0.06 0.00 0.04 0.00 0.00 61.00 62.47 1p6s s PRO 70 Cb -0.03 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.61 1p6s s PRO 70 CO 0.16 -1.82 0.80 0.09 0.04 0.00 0.00 177.00 176.28 1p6s n ASN 71 N -3.64 -6.72 -4.31 6.66 3.02 -1.25 -4.80 115.26 104.23 1p6s n ASN 71 Ca 0.09 -0.56 -0.24 0.00 -0.03 0.00 0.00 54.58 53.85 1p6s n ASN 71 Cb 0.53 -4.70 -0.12 0.00 -0.61 0.00 0.00 39.78 34.88 1p6s n ASN 71 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1p6s s THR 72 N -3.24 1.79 -0.10 3.41 2.01 -0.40 -2.60 115.64 116.51 1p6s s THR 72 Ca 0.27 -1.66 0.04 0.00 0.31 0.00 0.00 61.69 60.65 1p6s s THR 72 Cb -0.05 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 70.79 1p6s s THR 72 CO 0.78 -0.12 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.99 1p6s s PHE 73 N -1.39 2.51 0.04 4.92 0.40 0.56 -0.33 117.98 124.69 1p6s s PHE 73 Ca 0.10 -1.02 0.07 0.00 -0.60 0.00 0.00 56.93 55.47 1p6s s PHE 73 Cb -0.09 -1.68 -0.02 0.00 0.51 0.00 0.00 43.02 41.74 1p6s s PHE 73 CO 0.05 -0.41 -0.19 0.08 0.70 0.00 0.00 175.22 175.45 1p6s s VAL 74 N 0.35 1.53 -0.16 -0.44 1.01 0.83 -0.82 120.40 122.69 1p6s s VAL 74 Ca -0.19 -1.11 -0.02 0.00 0.00 0.00 0.00 61.98 60.66 1p6s s VAL 74 Cb -0.18 -1.33 0.05 0.00 0.00 0.00 0.00 36.38 34.92 1p6s s VAL 74 CO 0.09 0.19 0.02 -0.51 0.00 0.00 0.00 175.10 174.88 1p6s s ILE 75 N -0.77 0.58 0.00 2.22 2.07 0.26 0.26 121.20 125.81 1p6s s ILE 75 Ca 0.06 -0.42 0.00 0.00 -1.41 0.00 0.00 60.65 58.88 1p6s s ILE 75 Cb -0.08 -0.96 0.00 0.00 0.13 0.00 0.00 42.46 41.55 1p6s s ILE 75 CO 0.01 -0.06 0.00 0.54 -1.91 0.00 0.00 174.94 173.53 1p6s n ARG 76 N 5.05 0.00 -1.37 3.50 5.12 -1.13 -2.60 116.66 125.22 1p6s n ARG 76 Ca -0.09 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 1p6s n ARG 76 Cb 0.48 -0.32 0.00 0.00 -1.16 0.00 0.00 32.46 31.46 1p6s n ARG 76 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1p6s n LEU 78 N 0.32 -7.21 -3.82 0.00 -0.00 -1.26 -4.92 117.00 100.11 1p6s n LEU 78 Ca 0.00 0.62 -0.40 0.00 -0.00 0.00 0.00 56.01 56.23 1p6s n LEU 78 Cb 0.00 -3.13 -0.01 0.00 -0.00 0.00 0.00 43.42 40.28 1p6s n LEU 78 CO 0.00 -2.22 0.97 0.00 -0.00 0.00 0.00 177.39 176.14 1p6s n GLN 79 N -0.05 4.27 -0.03 1.96 10.64 -1.26 -4.52 117.38 128.38 1p6s n GLN 79 Ca 0.07 -4.61 -0.02 0.00 -1.83 0.00 0.00 57.00 50.61 1p6s n GLN 79 Cb 0.40 -2.45 -0.01 0.00 -0.86 0.00 0.00 30.24 27.32 1p6s n GLN 79 CO 0.00 0.00 0.00 0.91 -1.83 0.00 0.00 177.06 176.14 1p6s n TRP 80 N 0.98 0.32 -3.48 2.61 7.02 -1.26 -4.89 117.44 118.74 1p6s n TRP 80 Ca 0.30 0.14 -0.28 0.00 -1.02 0.00 0.00 57.50 56.64 1p6s n TRP 80 Cb 0.34 -0.42 -0.11 0.00 -2.42 0.00 0.00 31.31 28.69 1p6s n TRP 80 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1p6s s THR 81 N -1.61 0.51 -0.53 -0.99 -4.23 -1.26 -4.97 115.64 102.57 1p6s s THR 81 Ca -0.08 -2.37 -0.18 0.00 -1.18 0.00 0.00 61.69 57.89 1p6s s THR 81 Cb 0.01 -1.37 0.02 0.00 1.34 0.00 0.00 72.50 72.51 1p6s s THR 81 CO 0.12 -1.09 0.64 0.41 -0.54 0.00 0.00 174.62 174.15 1p6s n THR 82 N 3.33 -8.23 -1.97 3.99 -1.04 -1.26 -4.97 114.28 104.13 1p6s n THR 82 Ca 0.20 0.39 -0.30 0.00 -2.04 0.00 0.00 64.05 62.30 1p6s n THR 82 Cb 0.42 -5.79 0.03 0.00 -1.82 0.00 0.00 70.33 63.16 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 -2.41 4.15 -1.07 12.58 0.11 -1.26 -4.93 120.40 127.57 1p6s s VAL 83 Ca 0.22 0.60 -0.23 0.00 -2.93 0.00 0.00 61.98 59.64 1p6s s VAL 83 Cb -0.04 -3.68 -0.03 0.00 -1.53 0.00 0.00 36.38 31.10 1p6s s VAL 83 CO 0.81 -0.87 1.83 0.27 -3.33 0.00 0.00 175.10 173.81 1p6s s ILE 84 N -3.21 3.65 0.43 7.04 -4.36 -1.26 -4.95 121.20 118.54 1p6s s ILE 84 Ca 0.56 -0.82 -0.26 0.00 -0.26 0.00 0.00 60.65 59.86 1p6s s ILE 84 Cb -0.11 -4.53 -0.09 0.00 1.25 0.00 0.00 42.46 38.98 1p6s s ILE 84 CO 0.52 -1.28 1.43 -1.61 0.24 0.00 0.00 174.94 174.24 1p6s s GLU 85 N 6.11 3.82 -0.14 0.37 0.41 -1.26 -5.00 118.70 123.00 1p6s s GLU 85 Ca 0.63 2.44 0.01 0.00 -0.41 0.00 0.00 54.97 57.64 1p6s s GLU 85 Cb -0.02 -2.75 0.00 0.00 -1.78 0.00 0.00 34.13 29.58 1p6s s GLU 85 CO 0.03 -0.72 -0.18 0.50 -0.49 0.00 0.00 175.26 174.40 1p6s s ARG 86 N -2.34 3.14 -0.02 1.61 6.06 -1.07 -5.00 118.95 121.33 1p6s s ARG 86 Ca 0.58 -0.80 0.03 0.00 -2.50 0.00 0.00 55.73 53.05 1p6s s ARG 86 Cb -0.44 -2.52 -0.00 0.00 0.06 0.00 0.00 34.95 32.05 1p6s s ARG 86 CO 0.57 0.04 -0.10 0.99 -2.50 0.00 0.00 175.30 174.30 1p6s s THR 87 N 0.73 0.84 0.03 4.11 2.01 -1.26 -0.58 115.64 121.52 1p6s s THR 87 Ca -0.08 -0.42 -0.08 0.00 0.31 0.00 0.00 61.69 61.43 1p6s s THR 87 Cb -0.16 -0.73 -0.00 0.00 0.01 0.00 0.00 72.50 71.62 1p6s s THR 87 CO 0.01 0.25 0.15 0.72 -0.69 0.00 0.00 174.62 175.06 1p6s s PHE 88 N 0.01 0.10 0.16 4.92 -0.12 0.00 -4.36 117.98 118.69 1p6s s PHE 88 Ca -0.00 -0.32 0.05 0.00 -0.05 0.00 0.00 56.93 56.62 1p6s s PHE 88 Cb -0.07 -0.07 -0.04 0.00 -0.63 0.00 0.00 43.02 42.21 1p6s s PHE 88 CO 0.00 -0.37 0.10 -1.01 -0.05 0.00 0.00 175.22 173.89 1p6s s HIS 89 N -2.29 3.08 0.25 3.49 3.76 0.68 -0.32 115.29 123.94 1p6s s HIS 89 Ca -0.07 -0.04 -0.01 0.00 -0.15 0.00 0.00 55.06 54.79 1p6s s HIS 89 Cb -0.03 -1.49 -0.04 0.00 1.11 0.00 0.00 32.58 32.13 1p6s s HIS 89 CO -0.03 0.52 0.44 0.14 -0.85 0.00 0.00 174.74 174.96 1p6s s VAL 90 N -1.73 5.16 0.06 -0.90 -7.23 -1.07 0.12 120.40 114.82 1p6s s VAL 90 Ca 0.30 -0.38 0.19 0.00 -1.81 0.00 0.00 61.98 60.29 1p6s s VAL 90 Cb -0.10 -3.77 0.15 0.00 0.56 0.00 0.00 36.38 33.22 1p6s s VAL 90 CO 0.22 -0.28 1.68 0.44 -0.31 0.00 0.00 175.10 176.85 1p6s h ASP 91 N 1.64 0.00 -5.17 4.85 5.19 -1.92 -3.43 116.42 117.58 1p6s h ASP 91 Ca -0.49 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 55.85 1p6s h ASP 91 Cb 1.20 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 40.59 1p6s h ASP 91 CO 0.66 0.36 -0.22 -0.94 -3.12 0.00 0.00 179.24 175.98 1p6s s SER 92 N -6.36 -0.05 0.20 6.45 1.04 -1.26 -5.04 113.70 108.68 1p6s s SER 92 Ca 0.01 -0.65 -0.08 0.00 0.48 0.00 0.00 55.95 55.72 1p6s s SER 92 Cb 0.10 0.45 0.13 0.00 0.10 0.00 0.00 66.02 66.79 1p6s s SER 92 CO 0.69 -0.88 1.68 1.55 0.98 0.00 0.00 173.24 177.26 1p6s h PRO 93 N 2.49 1.06 -0.11 4.02 0.13 -1.97 -2.48 132.00 135.14 1p6s h PRO 93 Ca -0.32 -0.30 -0.04 0.00 -0.87 0.00 0.00 66.00 64.46 1p6s h PRO 93 Cb 1.23 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1p6s h PRO 93 CO 0.47 1.00 -0.13 -0.44 -0.23 0.00 0.00 178.00 178.67 1p6s h ASP 94 N 0.98 0.16 -0.07 1.44 5.19 -2.00 -2.76 116.42 119.37 1p6s h ASP 94 Ca 0.19 -0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 56.55 1p6s h ASP 94 Cb 0.49 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 39.95 1p6s h ASP 94 CO 0.02 0.32 -0.03 -0.33 -3.12 0.00 0.00 179.24 176.10 1p6s h GLU 95 N 0.17 0.14 -0.99 3.56 5.08 -1.86 -1.44 114.58 119.24 1p6s h GLU 95 Ca 0.03 -0.06 0.09 0.00 -1.00 0.00 0.00 59.36 58.43 1p6s h GLU 95 Cb 0.34 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.51 1p6s h GLU 95 CO 0.02 0.50 0.63 -0.09 -1.00 0.00 0.00 179.01 179.07 1p6s h ARG 96 N -0.22 1.02 -0.37 2.33 2.43 -1.30 0.51 114.38 118.77 1p6s h ARG 96 Ca 0.02 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.00 1p6s h ARG 96 Cb 0.45 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1p6s h ARG 96 CO 0.01 0.67 -0.26 1.49 -1.51 0.00 0.00 179.97 180.37 1p6s h GLU 97 N 1.05 0.76 -0.31 0.20 4.57 -1.38 -2.50 114.58 116.97 1p6s h GLU 97 Ca 0.46 -0.32 -0.12 0.00 -1.18 0.00 0.00 59.36 58.19 1p6s h GLU 97 Cb 0.35 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1p6s h GLU 97 CO -0.21 0.94 -0.31 0.93 -1.18 0.00 0.00 179.01 179.17 1p6s h GLU 98 N 0.65 0.65 -0.20 1.92 4.39 -0.02 -2.61 114.58 119.36 1p6s h GLU 98 Ca 0.08 -0.29 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 1p6s h GLU 98 Cb 0.78 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 1p6s h GLU 98 CO 0.06 0.88 -0.01 -1.49 -1.16 0.00 0.00 179.01 177.29 1p6s h TRP 99 N 0.55 0.40 -0.51 4.33 -0.00 -0.81 0.09 115.95 120.01 1p6s h TRP 99 Ca 0.06 -0.07 0.03 0.00 -0.00 0.00 0.00 58.89 58.91 1p6s h TRP 99 Cb 0.81 -0.10 -0.04 0.00 -0.00 0.00 0.00 29.16 29.83 1p6s h TRP 99 CO 0.04 0.57 0.29 1.98 -0.00 0.00 0.00 178.44 181.31 1p6s h MET 100 N 0.12 0.55 -0.43 0.49 4.05 -1.41 0.34 114.93 118.63 1p6s h MET 100 Ca 0.06 -0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.38 1p6s h MET 100 Cb 0.42 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.08 1p6s h MET 100 CO 0.01 0.37 0.01 -0.09 0.23 0.00 0.00 176.91 177.44 1p6s h ARG 101 N 0.57 0.76 -0.50 0.39 9.65 -1.38 -1.89 114.38 121.98 1p6s h ARG 101 Ca 0.21 -0.24 -0.08 0.00 -1.10 0.00 0.00 59.98 58.78 1p6s h ARG 101 Cb 0.05 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.54 1p6s h ARG 101 CO -0.11 0.82 0.02 0.00 2.80 0.00 0.00 179.97 183.50 1p6s h ALA 102 N 0.91 0.67 -0.70 2.80 0.00 -0.53 -1.56 119.26 120.84 1p6s h ALA 102 Ca 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1p6s h ALA 102 Cb 0.47 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1p6s h ALA 102 CO 0.02 0.46 0.39 0.82 0.00 0.00 0.00 179.25 180.94 1p6s h ILE 103 N 0.73 1.22 -0.50 0.00 2.04 -0.25 -2.20 117.51 118.56 1p6s h ILE 103 Ca 0.14 -0.54 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 1p6s h ILE 103 Cb 0.49 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1p6s h ILE 103 CO 0.02 0.24 -0.07 -0.61 0.00 0.00 0.00 178.15 177.73 1p6s h GLN 104 N 0.97 0.93 -0.45 2.37 5.75 -1.18 0.87 115.11 124.37 1p6s h GLN 104 Ca 0.25 -0.33 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 1p6s h GLN 104 Cb 0.04 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 1p6s h GLN 104 CO -0.04 0.99 0.25 1.98 -2.65 0.00 0.00 178.83 179.36 1p6s h MET 105 N 0.78 0.62 -0.09 1.69 4.05 -1.01 0.37 114.93 121.34 1p6s h MET 105 Ca 0.13 -0.07 -0.19 0.00 -0.28 0.00 0.00 59.70 59.30 1p6s h MET 105 Cb 0.61 -0.12 0.01 0.00 -0.80 0.00 0.00 31.60 31.30 1p6s h MET 105 CO 0.04 0.48 -0.67 0.28 0.23 0.00 0.00 176.91 177.26 1p6s h VAL 106 N 0.59 1.33 -0.64 -5.77 2.07 -1.36 -2.94 116.25 109.53 1p6s h VAL 106 Ca 0.16 -1.96 0.01 0.00 0.82 0.00 0.00 66.70 65.73 1p6s h VAL 106 Cb 0.03 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.97 1p6s h VAL 106 CO -0.03 0.60 0.42 0.00 0.02 0.00 0.00 177.57 178.59 1p6s h ALA 107 N 0.47 1.55 0.00 1.67 0.00 -0.67 -1.01 119.26 121.26 1p6s h ALA 107 Ca -0.06 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1p6s h ALA 107 Cb 1.32 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1p6s h ALA 107 CO 0.14 0.42 -0.24 -0.91 0.00 0.00 0.00 179.25 178.65 1p6s h ASN 108 N 0.86 0.00 0.25 0.00 2.35 -0.91 0.35 115.58 118.48 1p6s h ASN 108 Ca 0.24 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.64 1p6s h ASN 108 Cb -0.09 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.29 1p6s h ASN 108 CO -0.05 0.24 -1.65 0.28 -1.65 0.00 0.00 177.43 174.61 1p6s h SER 109 N 0.00 0.65 -0.24 5.81 0.02 -1.05 -3.36 113.55 115.38 1p6s h SER 109 Ca -0.00 -0.87 0.00 0.00 -0.84 0.00 0.00 61.79 60.08 1p6s h SER 109 Cb 0.85 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1p6s h SER 109 CO 0.03 1.72 0.00 0.00 -1.14 0.00 0.00 176.83 177.44 1p6s n LEU 110 N -3.61 2.70 0.00 5.07 -0.00 -0.52 -5.12 117.00 115.52 1p6s n LEU 110 Ca -0.21 -1.54 0.00 0.00 -0.00 0.00 0.00 56.01 54.25 1p6s n LEU 110 Cb 1.08 -0.16 0.00 0.00 -0.00 0.00 0.00 43.42 44.34 1p6s n LEU 110 CO 0.54 0.61 0.00 0.29 -0.00 0.00 0.00 177.39 178.83