#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 3.09 -2.71 7.83 4.13 -1.26 -4.60 115.26 121.75 1p6s n ASN 2 Ca 0.00 -3.80 -0.04 0.00 1.68 0.00 0.00 54.58 52.42 1p6s n ASN 2 Cb 0.00 -0.62 0.10 0.00 -1.54 0.00 0.00 39.78 37.72 1p6s n ASN 2 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1p6s n GLU 3 N -1.06 1.36 -2.76 3.52 0.28 -1.26 -5.13 120.64 115.59 1p6s n GLU 3 Ca 0.37 -2.08 -0.38 0.00 -0.16 0.00 0.00 57.16 54.90 1p6s n GLU 3 Cb 1.00 -0.30 -0.06 0.00 1.43 0.00 0.00 31.44 33.51 1p6s n GLU 3 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1p6s s VAL 4 N -1.01 4.13 0.40 3.84 1.01 -1.26 -5.07 120.40 122.44 1p6s s VAL 4 Ca 0.18 1.95 0.03 0.00 0.00 0.00 0.00 61.98 64.15 1p6s s VAL 4 Cb 0.41 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1p6s s VAL 4 CO -0.08 0.32 0.27 -1.54 0.00 0.00 0.00 175.10 174.07 1p6s n SER 5 N 1.02 2.37 -4.55 3.32 3.41 -1.26 -4.89 113.62 113.04 1p6s n SER 5 Ca -0.00 -2.43 -0.34 0.00 -0.26 0.00 0.00 58.87 55.84 1p6s n SER 5 Cb 0.48 -0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.32 1p6s n SER 5 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1p6s s VAL 6 N -2.05 4.00 -0.19 -3.33 1.01 -1.26 0.11 120.40 118.68 1p6s s VAL 6 Ca 0.21 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1p6s s VAL 6 Cb -0.02 -2.73 -0.22 0.00 0.00 0.00 0.00 36.38 33.42 1p6s s VAL 6 CO 0.13 0.53 0.08 -0.38 0.00 0.00 0.00 175.10 175.46 1p6s n ILE 7 N 3.10 1.56 -3.83 2.22 -0.00 0.45 -4.85 119.36 117.99 1p6s n ILE 7 Ca -0.18 -0.68 -0.12 0.00 -0.00 0.00 0.00 62.75 61.77 1p6s n ILE 7 Cb 0.53 -1.25 -0.13 0.00 -0.00 0.00 0.00 39.64 38.78 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 -2.53 0.11 -0.02 0.38 2.47 -1.07 -4.99 119.74 114.08 1p6s s LYS 8 Ca -0.23 0.14 -0.00 0.00 -1.56 0.00 0.00 55.97 54.32 1p6s s LYS 8 Cb 0.08 0.04 0.03 0.00 -1.46 0.00 0.00 37.83 36.51 1p6s s LYS 8 CO 0.71 -0.02 0.04 -1.83 0.16 0.00 0.00 175.35 174.42 1p6s s GLU 9 N 0.12 -0.02 0.17 4.03 -1.05 -1.26 0.67 118.70 121.35 1p6s s GLU 9 Ca -0.01 0.20 -0.25 0.00 -0.15 0.00 0.00 54.97 54.77 1p6s s GLU 9 Cb -0.01 -0.22 0.06 0.00 -0.44 0.00 0.00 34.13 33.52 1p6s s GLU 9 CO -0.00 -0.15 0.94 0.20 0.95 0.00 0.00 175.26 177.20 1p6s s GLY 10 N 1.00 -0.21 -0.02 -3.83 0.00 -0.07 -4.98 107.32 99.21 1p6s s GLY 10 Ca -0.08 0.07 -0.18 0.00 0.00 0.00 0.00 44.72 44.53 1p6s s GLY 10 CO -0.03 0.02 0.51 -0.98 0.00 0.00 0.00 173.10 172.62 1p6s s TRP 11 N -3.32 3.68 0.13 1.90 0.52 -1.26 -0.54 118.94 120.05 1p6s s TRP 11 Ca 0.12 1.09 0.07 0.00 0.02 0.00 0.00 56.10 57.40 1p6s s TRP 11 Cb -0.02 -2.49 -0.04 0.00 -1.15 0.00 0.00 33.47 29.78 1p6s s TRP 11 CO 0.03 0.43 -0.17 -0.51 0.02 0.00 0.00 176.95 176.75 1p6s s LEU 12 N -0.41 2.38 -0.24 2.99 1.43 0.79 -2.60 118.68 123.02 1p6s s LEU 12 Ca 0.27 -0.78 -0.09 0.00 -1.03 0.00 0.00 54.13 52.50 1p6s s LEU 12 Cb -0.17 -0.72 -0.04 0.00 0.03 0.00 0.00 46.19 45.28 1p6s s LEU 12 CO 0.15 -0.05 0.12 -1.00 0.23 0.00 0.00 176.35 175.80 1p6s s HIS 13 N -1.80 3.21 0.01 0.29 3.76 0.22 0.68 115.29 121.65 1p6s s HIS 13 Ca 0.10 -0.03 0.07 0.00 -0.15 0.00 0.00 55.06 55.06 1p6s s HIS 13 Cb -0.07 -2.25 -0.02 0.00 1.11 0.00 0.00 32.58 31.35 1p6s s HIS 13 CO 0.04 -0.10 -0.23 0.15 -0.85 0.00 0.00 174.74 173.76 1p6s s LYS 14 N 1.26 1.70 0.31 1.40 1.02 -0.06 -0.05 119.74 125.31 1p6s s LYS 14 Ca 0.06 -0.89 -0.28 0.00 0.02 0.00 0.00 55.97 54.88 1p6s s LYS 14 Cb -0.14 -1.72 -0.09 0.00 -0.52 0.00 0.00 37.83 35.35 1p6s s LYS 14 CO 0.05 0.46 1.09 0.50 -0.92 0.00 0.00 175.35 176.53 1p6s s ARG 15 N -0.82 4.51 0.98 1.68 3.52 -1.26 -0.58 118.95 126.98 1p6s s ARG 15 Ca 0.09 1.73 -0.15 0.00 -0.13 0.00 0.00 55.73 57.27 1p6s s ARG 15 Cb -0.09 -3.02 0.19 0.00 -1.56 0.00 0.00 34.95 30.47 1p6s s ARG 15 CO 0.00 0.12 1.19 0.20 -0.81 0.00 0.00 175.30 176.00 1p6s s GLY 16 N -1.06 1.64 -0.09 8.12 0.00 -0.50 -4.92 107.32 110.51 1p6s s GLY 16 Ca 0.48 -0.83 -0.26 0.00 0.00 0.00 0.00 44.72 44.11 1p6s s GLY 16 CO 0.37 -0.14 0.93 -2.09 0.00 0.00 0.00 173.10 172.18 1p6s h GLU 17 N -1.75 -0.02 0.00 2.90 4.57 -1.96 -3.40 114.58 114.92 1p6s h GLU 17 Ca -0.47 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 1p6s h GLU 17 Cb 1.29 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1p6s h GLU 17 CO 0.49 0.70 -0.04 2.48 -1.18 0.00 0.00 179.01 181.45 1p6s n TYR 18 N -4.74 0.00 0.36 0.92 0.18 -1.26 -4.72 117.16 107.90 1p6s n TYR 18 Ca -0.09 -0.41 0.12 0.00 1.88 0.00 0.00 57.90 59.40 1p6s n TYR 18 Cb 0.36 -0.05 0.04 0.00 -0.38 0.00 0.00 39.34 39.31 1p6s n TYR 18 CO 0.00 0.00 0.00 1.51 -2.08 0.00 0.00 176.86 176.29 1p6s n ILE 19 N -0.47 0.38 -3.72 -3.48 3.06 -1.26 -4.97 119.36 108.90 1p6s n ILE 19 Ca 0.02 -0.38 -0.27 0.00 -2.50 0.00 0.00 62.75 59.62 1p6s n ILE 19 Cb 0.41 -0.10 0.05 0.00 0.54 0.00 0.00 39.64 40.53 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 -2.29 -6.41 -3.79 9.51 0.00 -1.26 -4.96 118.16 108.95 1p6s n LYS 20 Ca 0.01 0.70 -0.12 0.00 0.00 0.00 0.00 58.31 58.91 1p6s n LYS 20 Cb 0.49 -5.66 -0.08 0.00 0.00 0.00 0.00 35.03 29.78 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 -3.29 0.08 -0.27 3.15 2.01 -1.26 -4.98 115.64 111.08 1p6s s THR 21 Ca 0.61 -0.66 -0.15 0.00 0.31 0.00 0.00 61.69 61.80 1p6s s THR 21 Cb -0.29 -0.77 -0.04 0.00 0.01 0.00 0.00 72.50 71.42 1p6s s THR 21 CO 0.75 -0.36 0.36 0.26 -0.69 0.00 0.00 174.62 174.94 1p6s s TRP 22 N -2.00 3.24 -0.04 4.92 0.52 -1.26 -1.41 118.94 122.91 1p6s s TRP 22 Ca -0.09 0.37 -0.00 0.00 0.02 0.00 0.00 56.10 56.40 1p6s s TRP 22 Cb -0.03 -2.56 -0.03 0.00 -1.15 0.00 0.00 33.47 29.69 1p6s s TRP 22 CO -0.00 -0.23 -0.00 -0.98 0.02 0.00 0.00 176.95 175.75 1p6s s ARG 23 N 2.05 2.87 0.18 4.98 3.03 0.25 -4.75 118.95 127.56 1p6s s ARG 23 Ca 0.14 -0.51 -0.30 0.00 2.03 0.00 0.00 55.73 57.09 1p6s s ARG 23 Cb -0.16 -2.72 -0.08 0.00 -1.03 0.00 0.00 34.95 30.96 1p6s s ARG 23 CO 0.10 0.66 1.14 -1.25 -1.13 0.00 0.00 175.30 174.82 1p6s s PRO 24 N -1.21 4.55 0.01 3.89 0.04 -1.26 -0.88 135.00 140.14 1p6s s PRO 24 Ca 0.16 1.77 0.01 0.00 0.04 0.00 0.00 61.00 62.98 1p6s s PRO 24 Cb -0.11 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 1p6s s PRO 24 CO 0.06 0.01 -0.02 1.03 0.04 0.00 0.00 177.00 178.12 1p6s s ARG 25 N -0.29 0.20 -0.57 4.56 0.52 0.21 -4.91 118.95 118.68 1p6s s ARG 25 Ca 0.51 -0.22 -0.28 0.00 -0.52 0.00 0.00 55.73 55.22 1p6s s ARG 25 Cb -0.30 -0.10 0.01 0.00 0.52 0.00 0.00 34.95 35.07 1p6s s ARG 25 CO 0.35 0.02 1.44 -0.47 0.02 0.00 0.00 175.30 176.67 1p6s s TYR 26 N -0.41 2.23 -0.06 -0.53 6.14 0.65 -0.15 117.35 125.23 1p6s s TYR 26 Ca -0.03 0.47 0.04 0.00 0.64 0.00 0.00 57.07 58.18 1p6s s TYR 26 Cb -0.03 -4.38 -0.02 0.00 0.42 0.00 0.00 41.96 37.95 1p6s s TYR 26 CO -0.00 -2.03 -0.16 -0.06 0.64 0.00 0.00 175.55 173.95 1p6s s PHE 27 N 6.24 2.67 -0.00 4.97 0.08 0.30 0.41 117.98 132.65 1p6s s PHE 27 Ca 0.53 -0.27 -0.03 0.00 0.12 0.00 0.00 56.93 57.28 1p6s s PHE 27 Cb -0.11 -1.64 -0.01 0.00 -0.57 0.00 0.00 43.02 40.69 1p6s s PHE 27 CO 0.24 0.10 0.04 -0.48 -0.10 0.00 0.00 175.22 175.02 1p6s s LEU 28 N -0.55 1.90 -0.14 -0.37 2.34 -0.50 -0.89 118.68 120.47 1p6s s LEU 28 Ca 0.08 -0.19 -0.11 0.00 0.06 0.00 0.00 54.13 53.96 1p6s s LEU 28 Cb -0.11 0.28 -0.05 0.00 -0.56 0.00 0.00 46.19 45.75 1p6s s LEU 28 CO 0.01 -0.21 0.22 -0.22 -1.06 0.00 0.00 176.35 175.09 1p6s s LEU 29 N -0.87 4.31 0.52 1.48 2.96 0.21 -0.22 118.68 127.07 1p6s s LEU 29 Ca -0.10 0.48 0.08 0.00 -0.22 0.00 0.00 54.13 54.37 1p6s s LEU 29 Cb -0.06 -2.23 0.06 0.00 0.50 0.00 0.00 46.19 44.46 1p6s s LEU 29 CO 0.00 0.24 0.72 -0.54 -1.32 0.00 0.00 176.35 175.45 1p6s s LYS 30 N -0.20 2.48 0.25 1.98 -0.14 0.06 -0.41 119.74 123.76 1p6s s LYS 30 Ca 0.15 -1.44 0.25 0.00 -1.36 0.00 0.00 55.97 53.57 1p6s s LYS 30 Cb -0.13 -2.67 0.93 0.00 -1.68 0.00 0.00 37.83 34.28 1p6s s LYS 30 CO 0.03 -0.67 1.74 0.45 -0.76 0.00 0.00 175.35 176.15 1p6s n SER 31 N -2.13 0.76 -0.51 2.83 2.88 0.12 -2.75 113.62 114.81 1p6s n SER 31 Ca 0.13 0.64 0.11 0.00 -1.33 0.00 0.00 58.87 58.41 1p6s n SER 31 Cb 0.60 -0.82 0.40 0.00 -0.75 0.00 0.00 64.21 63.65 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 -2.29 1.55 -0.55 -3.46 2.03 -1.26 -4.90 116.55 107.66 1p6s n ASP 32 Ca 0.03 -1.67 -0.00 0.00 0.52 0.00 0.00 54.79 53.67 1p6s n ASP 32 Cb 0.31 -0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.62 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 1.11 0.93 3.01 0.27 0.00 -1.11 -4.84 105.19 104.56 1p6s n GLY 33 Ca 0.16 -0.66 -0.21 0.00 0.00 0.00 0.00 46.02 45.31 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 1.33 -0.18 1.61 1.04 -1.26 -0.40 113.70 112.84 1p6s s SER 34 Ca 0.01 -0.21 -0.11 0.00 0.48 0.00 0.00 55.95 56.12 1p6s s SER 34 Cb -0.00 -0.41 -0.05 0.00 0.10 0.00 0.00 66.02 65.66 1p6s s SER 34 CO 0.01 0.06 0.20 0.12 0.98 0.00 0.00 173.24 174.61 1p6s s PHE 35 N 0.28 3.44 -0.21 5.02 2.19 0.18 -0.76 117.98 128.12 1p6s s PHE 35 Ca -0.05 0.45 -0.08 0.00 0.33 0.00 0.00 56.93 57.58 1p6s s PHE 35 Cb -0.10 -2.22 -0.04 0.00 -1.31 0.00 0.00 43.02 39.35 1p6s s PHE 35 CO 0.01 0.29 0.08 0.42 1.83 0.00 0.00 175.22 177.85 1p6s s ILE 36 N 0.33 4.70 -0.30 3.12 -1.09 0.69 -0.25 121.20 128.41 1p6s s ILE 36 Ca 0.12 -0.05 -0.08 0.00 -2.23 0.00 0.00 60.65 58.40 1p6s s ILE 36 Cb -0.12 -3.15 0.01 0.00 -1.58 0.00 0.00 42.46 37.62 1p6s s ILE 36 CO 0.01 0.40 0.11 -0.83 -1.23 0.00 0.00 174.94 173.40 1p6s s GLY 37 N 0.86 1.82 -0.14 6.18 0.00 0.19 -1.41 107.32 114.82 1p6s s GLY 37 Ca 0.04 -1.46 -0.02 0.00 0.00 0.00 0.00 44.72 43.28 1p6s s GLY 37 CO 0.02 0.67 -0.06 -0.47 0.00 0.00 0.00 173.10 173.27 1p6s s TYR 38 N 1.53 2.97 0.51 1.90 6.14 0.16 -0.53 117.35 130.05 1p6s s TYR 38 Ca 0.03 -0.32 0.18 0.00 0.64 0.00 0.00 57.07 57.59 1p6s s TYR 38 Cb -0.17 -1.90 1.29 0.00 0.42 0.00 0.00 41.96 41.60 1p6s s TYR 38 CO 0.04 -0.02 2.13 1.57 0.64 0.00 0.00 175.55 179.91 1p6s h LYS 39 N 6.51 0.00 0.00 4.97 2.10 -1.93 0.19 116.57 128.40 1p6s h LYS 39 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1p6s h LYS 39 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1p6s h LYS 39 CO 0.60 0.03 0.00 -1.91 -2.00 0.00 0.00 179.45 176.17 1p6s n GLU 40 N -4.41 0.00 -1.42 0.07 4.07 -1.26 -4.54 120.64 113.16 1p6s n GLU 40 Ca -0.03 0.00 -0.29 0.00 -0.06 0.00 0.00 57.16 56.78 1p6s n GLU 40 Cb 0.12 0.00 0.15 0.00 -0.06 0.00 0.00 31.44 31.65 1p6s n GLU 40 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1p6s s ARG 41 N 1.12 0.82 0.01 5.31 0.52 -1.26 -4.52 118.95 120.94 1p6s s ARG 41 Ca 0.00 0.33 -0.30 0.00 -0.52 0.00 0.00 55.73 55.23 1p6s s ARG 41 Cb 0.00 -1.80 -0.04 0.00 0.52 0.00 0.00 34.95 33.63 1p6s s ARG 41 CO 0.00 -2.43 1.16 -1.25 0.02 0.00 0.00 175.30 172.80 1p6s s PRO 42 N -5.20 4.43 -0.25 3.54 0.04 -1.26 -4.93 135.00 131.37 1p6s s PRO 42 Ca 0.65 1.67 0.14 0.00 0.04 0.00 0.00 61.00 63.49 1p6s s PRO 42 Cb -0.16 -3.44 0.79 0.00 0.04 0.00 0.00 34.50 31.74 1p6s s PRO 42 CO 0.55 -0.29 1.73 0.39 0.04 0.00 0.00 177.00 179.42 1p6s n GLU 43 N 4.37 4.60 -2.90 4.56 4.71 -1.26 -4.98 120.64 129.75 1p6s n GLU 43 Ca 0.09 -3.14 -0.33 0.00 -0.01 0.00 0.00 57.16 53.77 1p6s n GLU 43 Cb 0.47 -2.23 -0.07 0.00 -1.01 0.00 0.00 31.44 28.60 1p6s n GLU 43 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1p6s s ALA 44 N -2.81 3.14 0.15 0.62 0.00 -1.26 -4.98 121.76 116.61 1p6s s ALA 44 Ca 0.54 0.32 -0.06 0.00 0.00 0.00 0.00 51.96 52.75 1p6s s ALA 44 Cb 0.42 -3.05 -0.03 0.00 0.00 0.00 0.00 23.12 20.46 1p6s s ALA 44 CO 0.15 0.19 1.39 -1.00 0.00 0.00 0.00 175.76 176.49 1p6s h PRO 45 N 2.18 0.59 0.00 0.00 0.13 -1.93 -3.44 132.00 129.53 1p6s h PRO 45 Ca -0.48 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.18 1p6s h PRO 45 Cb 1.18 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1p6s h PRO 45 CO 0.63 1.09 0.00 -3.47 -0.23 0.00 0.00 178.00 176.02 1p6s n ASP 46 N -3.89 0.00 -2.47 1.44 2.03 -1.26 -5.02 116.55 107.38 1p6s n ASP 46 Ca -0.05 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.23 1p6s n ASP 46 Cb 0.71 0.00 0.09 0.00 -0.72 0.00 0.00 41.12 41.21 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 -1.97 1.22 -2.39 -0.67 -0.06 -1.26 -4.97 117.38 107.28 1p6s n GLN 47 Ca 0.00 -1.50 -0.29 0.00 -2.00 0.00 0.00 57.00 53.22 1p6s n GLN 47 Cb 0.00 0.17 0.01 0.00 -4.06 0.00 0.00 30.24 26.35 1p6s n GLN 47 CO 0.00 0.00 0.00 -2.37 -0.20 0.00 0.00 177.06 174.49 1p6s n THR 48 N -1.21 2.54 -3.06 1.69 5.66 -1.26 -5.03 114.28 113.61 1p6s n THR 48 Ca -0.15 -4.83 -0.40 0.00 -3.05 0.00 0.00 64.05 55.61 1p6s n THR 48 Cb 0.85 -1.26 -0.05 0.00 -1.55 0.00 0.00 70.33 68.32 1p6s n THR 48 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1p6s s LEU 49 N -3.61 4.20 -0.32 1.09 2.34 -1.26 -4.78 118.68 116.33 1p6s s LEU 49 Ca 0.49 0.99 -0.29 0.00 0.06 0.00 0.00 54.13 55.38 1p6s s LEU 49 Cb 0.41 -3.00 0.01 0.00 -0.56 0.00 0.00 46.19 43.04 1p6s s LEU 49 CO -0.22 -0.25 1.24 -2.16 -1.06 0.00 0.00 176.35 173.91 1p6s s PRO 50 N 1.61 3.93 0.11 1.48 0.04 -1.26 -5.00 135.00 135.93 1p6s s PRO 50 Ca 0.33 1.15 -0.31 0.00 0.04 0.00 0.00 61.00 62.21 1p6s s PRO 50 Cb -0.16 -3.85 -0.07 0.00 0.04 0.00 0.00 34.50 30.45 1p6s s PRO 50 CO 0.13 -1.09 1.32 -1.25 0.04 0.00 0.00 177.00 176.14 1p6s s PRO 51 N 4.07 4.37 -0.14 0.56 0.04 -1.26 -4.96 135.00 137.68 1p6s s PRO 51 Ca 0.53 1.98 -0.27 0.00 0.04 0.00 0.00 61.00 63.28 1p6s s PRO 51 Cb -0.15 -3.27 -0.24 0.00 0.04 0.00 0.00 34.50 30.88 1p6s s PRO 51 CO 0.22 -0.35 0.70 -0.07 0.04 0.00 0.00 177.00 177.55 1p6s h LEU 52 N 6.54 0.00 -8.97 -3.56 3.38 -1.94 -3.45 115.31 107.31 1p6s h LEU 52 Ca -0.42 -0.91 -0.63 0.00 0.09 0.00 0.00 57.88 56.00 1p6s h LEU 52 Cb 1.21 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.77 1p6s h LEU 52 CO 0.83 0.97 -0.62 0.20 0.09 0.00 0.00 178.44 179.91 1p6s s ASN 53 N -6.18 5.14 -0.24 -0.43 -0.87 0.32 -4.96 114.94 107.72 1p6s s ASN 53 Ca -0.18 -0.03 0.01 0.00 -1.57 0.00 0.00 52.86 51.10 1p6s s ASN 53 Cb -0.03 -1.84 0.06 0.00 -0.02 0.00 0.00 41.25 39.42 1p6s s ASN 53 CO 0.64 0.18 -0.08 0.20 -2.57 0.00 0.00 177.10 175.47 1p6s s ASN 54 N 0.29 3.98 -0.09 -1.22 -0.87 -1.26 0.55 114.94 116.32 1p6s s ASN 54 Ca -0.01 -1.21 -0.01 0.00 -1.57 0.00 0.00 52.86 50.07 1p6s s ASN 54 Cb -0.13 -1.31 -0.03 0.00 -0.02 0.00 0.00 41.25 39.75 1p6s s ASN 54 CO 0.02 -0.21 -0.03 0.12 -2.57 0.00 0.00 177.10 174.43 1p6s s PHE 55 N 1.30 3.06 -0.26 2.20 5.36 0.66 -4.96 117.98 125.34 1p6s s PHE 55 Ca -0.06 0.05 -0.11 0.00 -0.96 0.00 0.00 56.93 55.86 1p6s s PHE 55 Cb -0.19 -1.79 -0.05 0.00 -0.34 0.00 0.00 43.02 40.65 1p6s s PHE 55 CO -0.06 0.34 0.18 -1.12 -1.46 0.00 0.00 175.22 173.09 1p6s s SER 56 N -0.65 6.07 -0.47 6.13 0.01 -1.26 0.50 113.70 124.03 1p6s s SER 56 Ca 0.10 0.05 0.08 0.00 1.31 0.00 0.00 55.95 57.50 1p6s s SER 56 Cb -0.12 -2.11 0.37 0.00 0.21 0.00 0.00 66.02 64.37 1p6s s SER 56 CO 0.02 0.01 0.91 0.55 0.41 0.00 0.00 173.24 175.14 1p6s n VAL 57 N 4.68 1.80 0.01 3.43 3.14 0.46 -4.87 118.33 126.99 1p6s n VAL 57 Ca -0.14 -4.92 -0.18 0.00 -2.96 0.00 0.00 64.34 56.13 1p6s n VAL 57 Cb 0.52 -0.83 -0.14 0.00 -1.06 0.00 0.00 33.84 32.33 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 2.92 -0.05 -1.97 1.55 0.00 -1.88 -3.44 119.26 116.39 1p6s h ALA 58 Ca 0.12 -0.65 -0.39 0.00 0.00 0.00 0.00 54.91 54.00 1p6s h ALA 58 Cb 0.78 0.08 -0.31 0.00 0.00 0.00 0.00 17.79 18.33 1p6s h ALA 58 CO 0.70 0.27 -0.71 -2.00 0.00 0.00 0.00 179.25 177.50 1p6s s GLU 59 N -2.36 0.69 0.35 0.00 2.56 -1.26 -4.73 118.70 113.94 1p6s s GLU 59 Ca -0.16 -1.04 0.05 0.00 0.00 0.00 0.00 54.97 53.82 1p6s s GLU 59 Cb -0.00 -0.79 -0.03 0.00 2.00 0.00 0.00 34.13 35.30 1p6s s GLU 59 CO 0.78 -1.23 0.18 0.00 -0.56 0.00 0.00 175.26 174.44 1p6s s GLN 61 N -3.67 4.08 0.07 0.00 -0.21 -1.23 -4.98 119.66 113.73 1p6s s GLN 61 Ca 0.33 0.21 0.08 0.00 0.02 0.00 0.00 55.36 56.00 1p6s s GLN 61 Cb 0.03 -3.34 -0.03 0.00 1.00 0.00 0.00 33.01 30.67 1p6s s GLN 61 CO 0.19 0.42 -0.21 -0.48 -2.12 0.00 0.00 175.29 173.09 1p6s s LEU 62 N -0.12 2.23 -0.20 2.90 0.05 -1.26 -0.80 118.68 121.47 1p6s s LEU 62 Ca 0.20 -0.60 -0.10 0.00 0.05 0.00 0.00 54.13 53.67 1p6s s LEU 62 Cb -0.14 -0.97 0.07 0.00 -2.05 0.00 0.00 46.19 43.10 1p6s s LEU 62 CO 0.08 0.12 0.48 -0.32 -0.55 0.00 0.00 176.35 176.16 1p6s s MET 63 N -1.53 0.46 0.32 1.48 1.75 0.16 -4.97 119.30 116.98 1p6s s MET 63 Ca 0.08 0.96 -0.19 0.00 -1.25 0.00 0.00 55.69 55.28 1p6s s MET 63 Cb -0.09 0.11 -0.09 0.00 2.84 0.00 0.00 34.83 37.59 1p6s s MET 63 CO 0.03 -0.17 0.81 0.15 -0.65 0.00 0.00 175.02 175.18 1p6s s LYS 64 N 1.72 4.20 0.29 4.11 1.02 -1.26 0.13 119.74 129.95 1p6s s LYS 64 Ca -0.08 0.91 -0.11 0.00 0.02 0.00 0.00 55.97 56.70 1p6s s LYS 64 Cb -0.08 -2.55 0.01 0.00 -0.52 0.00 0.00 37.83 34.68 1p6s s LYS 64 CO -0.15 0.20 0.53 -0.08 -0.92 0.00 0.00 175.35 174.93 1p6s s THR 65 N -1.85 0.00 -0.13 2.17 -1.32 -0.15 -4.87 115.64 109.48 1p6s s THR 65 Ca 0.52 -1.38 0.16 0.00 -1.21 0.00 0.00 61.69 59.78 1p6s s THR 65 Cb -0.13 -2.38 0.29 0.00 -1.51 0.00 0.00 72.50 68.77 1p6s s THR 65 CO 0.18 0.00 1.15 -0.62 -2.21 0.00 0.00 174.62 173.12 1p6s n GLU 66 N -0.45 1.17 -4.43 7.08 -0.58 -1.26 -0.68 120.64 121.48 1p6s n GLU 66 Ca -0.02 -2.55 -0.20 0.00 -0.42 0.00 0.00 57.16 53.97 1p6s n GLU 66 Cb 0.61 -1.37 -0.14 0.00 -0.57 0.00 0.00 31.44 29.98 1p6s n GLU 66 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 1p6s s ARG 67 N -2.55 0.95 0.29 3.49 6.06 -1.26 -2.93 118.95 123.00 1p6s s ARG 67 Ca 0.30 -0.62 0.08 0.00 -2.50 0.00 0.00 55.73 52.99 1p6s s ARG 67 Cb 0.27 -0.93 0.43 0.00 0.06 0.00 0.00 34.95 34.78 1p6s s ARG 67 CO -0.00 0.24 1.67 -1.00 -2.50 0.00 0.00 175.30 173.71 1p6s h PRO 68 N 5.32 0.13 -6.18 5.12 0.13 -2.01 -3.48 132.00 131.03 1p6s h PRO 68 Ca -0.36 -0.07 -0.55 0.00 -0.87 0.00 0.00 66.00 64.15 1p6s h PRO 68 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.25 1p6s h PRO 68 CO 0.46 0.61 -0.54 1.03 -0.23 0.00 0.00 178.00 179.33 1p6s s ARG 69 N -3.92 2.98 0.77 0.86 0.52 -1.24 -5.10 118.95 113.83 1p6s s ARG 69 Ca -0.03 -0.89 -0.12 0.00 -0.52 0.00 0.00 55.73 54.17 1p6s s ARG 69 Cb 0.13 -2.66 0.06 0.00 0.52 0.00 0.00 34.95 33.00 1p6s s ARG 69 CO 0.77 0.46 1.11 -1.25 0.02 0.00 0.00 175.30 176.41 1p6s s PRO 70 N -3.35 2.14 -0.99 3.54 0.04 -1.15 -4.01 135.00 131.22 1p6s s PRO 70 Ca 0.32 1.33 -0.02 0.00 0.04 0.00 0.00 61.00 62.67 1p6s s PRO 70 Cb -0.10 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 1p6s s PRO 70 CO 0.24 -1.75 0.84 0.09 0.04 0.00 0.00 177.00 176.46 1p6s n ASN 71 N -3.35 -3.96 -4.48 6.66 5.03 -1.25 -4.94 115.26 108.98 1p6s n ASN 71 Ca 0.10 -0.58 -0.24 0.00 0.87 0.00 0.00 54.58 54.73 1p6s n ASN 71 Cb 0.52 -4.59 -0.10 0.00 -1.02 0.00 0.00 39.78 34.59 1p6s n ASN 71 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1p6s s THR 72 N -3.33 2.52 0.09 3.41 2.01 0.14 -3.76 115.64 116.72 1p6s s THR 72 Ca 0.19 -2.36 0.10 0.00 0.31 0.00 0.00 61.69 59.93 1p6s s THR 72 Cb -0.02 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 1p6s s THR 72 CO 0.64 -0.38 -0.26 -0.36 -0.69 0.00 0.00 174.62 173.57 1p6s s PHE 73 N -2.45 2.33 0.01 4.92 0.08 0.56 -0.98 117.98 122.45 1p6s s PHE 73 Ca 0.30 -0.38 0.02 0.00 0.12 0.00 0.00 56.93 56.98 1p6s s PHE 73 Cb -0.05 -1.32 -0.01 0.00 -0.57 0.00 0.00 43.02 41.07 1p6s s PHE 73 CO 0.15 0.25 -0.07 0.08 -0.10 0.00 0.00 175.22 175.52 1p6s s VAL 74 N -0.95 0.58 -0.02 -0.44 1.01 0.12 -0.78 120.40 119.92 1p6s s VAL 74 Ca 0.13 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1p6s s VAL 74 Cb -0.10 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.77 1p6s s VAL 74 CO 0.04 0.06 -0.07 -0.51 0.00 0.00 0.00 175.10 174.63 1p6s s ILE 75 N -0.39 0.59 -0.64 2.22 2.07 0.15 0.41 121.20 125.60 1p6s s ILE 75 Ca 0.01 -0.27 -0.08 0.00 -1.41 0.00 0.00 60.65 58.90 1p6s s ILE 75 Cb -0.04 -0.53 0.17 0.00 0.13 0.00 0.00 42.46 42.19 1p6s s ILE 75 CO -0.00 0.19 0.51 -0.13 -1.91 0.00 0.00 174.94 173.60 1p6s s ARG 76 N 0.14 2.85 0.18 3.50 3.00 0.02 -4.48 118.95 124.16 1p6s s ARG 76 Ca -0.02 -2.29 0.10 0.00 0.00 0.00 0.00 55.73 53.52 1p6s s ARG 76 Cb -0.06 -4.00 -0.04 0.00 0.00 0.00 0.00 34.95 30.85 1p6s s ARG 76 CO -0.00 -1.21 -0.21 0.00 0.00 0.00 0.00 175.30 173.88 1p6s s LEU 78 N -2.66 -0.08 0.00 0.00 1.02 -1.26 -5.00 118.68 110.71 1p6s s LEU 78 Ca 0.18 0.67 0.00 0.00 0.02 0.00 0.00 54.13 55.00 1p6s s LEU 78 Cb -0.07 -2.25 0.00 0.00 0.02 0.00 0.00 46.19 43.89 1p6s s LEU 78 CO 0.08 -4.69 0.16 0.00 0.02 0.00 0.00 176.35 171.92 1p6s n GLN 79 N -5.15 0.00 0.00 1.70 3.00 -1.26 -4.81 117.38 110.85 1p6s n GLN 79 Ca 0.14 0.20 0.00 0.00 -0.01 0.00 0.00 57.00 57.33 1p6s n GLN 79 Cb 0.60 -0.81 0.00 0.00 0.00 0.00 0.00 30.24 30.03 1p6s n GLN 79 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1p6s n TRP 80 N -1.10 0.00 -1.44 1.08 7.02 -1.26 -4.73 117.44 117.02 1p6s n TRP 80 Ca 0.00 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.19 1p6s n TRP 80 Cb 0.00 0.00 0.14 0.00 -2.42 0.00 0.00 31.31 29.03 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 0.00 2.10 0.24 -0.99 -4.23 -1.26 -4.96 115.64 106.53 1p6s s THR 81 Ca 0.00 0.03 0.08 0.00 -1.18 0.00 0.00 61.69 60.62 1p6s s THR 81 Cb 0.00 -2.71 -0.06 0.00 1.34 0.00 0.00 72.50 71.06 1p6s s THR 81 CO 0.00 -0.04 1.54 0.00 -0.54 0.00 0.00 174.62 175.57 1p6s h THR 82 N -1.58 1.47 -3.59 3.99 1.03 -2.01 -3.44 112.91 108.78 1p6s h THR 82 Ca -0.51 -2.31 -0.52 0.00 -0.01 0.00 0.00 66.41 63.06 1p6s h THR 82 Cb 1.33 2.24 -0.03 0.00 -1.07 0.00 0.00 68.15 70.62 1p6s h THR 82 CO 0.61 0.66 0.26 0.68 -0.01 0.00 0.00 175.52 177.72 1p6s s VAL 83 N -3.49 4.35 -0.37 0.00 -7.23 -1.26 -5.03 120.40 107.36 1p6s s VAL 83 Ca -0.02 1.88 -0.05 0.00 -1.81 0.00 0.00 61.98 61.98 1p6s s VAL 83 Cb 0.12 -4.23 0.07 0.00 0.56 0.00 0.00 36.38 32.90 1p6s s VAL 83 CO 0.78 0.46 0.16 -0.63 -0.31 0.00 0.00 175.10 175.56 1p6s s ILE 84 N -0.80 3.64 -0.18 -0.62 -1.09 -1.26 -4.98 121.20 115.92 1p6s s ILE 84 Ca 0.40 -1.49 -0.06 0.00 -2.23 0.00 0.00 60.65 57.27 1p6s s ILE 84 Cb -0.24 -3.23 -0.03 0.00 -1.58 0.00 0.00 42.46 37.39 1p6s s ILE 84 CO 0.28 -0.39 0.01 -1.61 -1.23 0.00 0.00 174.94 172.00 1p6s s GLU 85 N 1.32 3.77 0.21 2.79 2.02 -1.26 -4.95 118.70 122.59 1p6s s GLU 85 Ca 0.02 -0.45 0.00 0.00 0.02 0.00 0.00 54.97 54.55 1p6s s GLU 85 Cb -0.21 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 30.93 1p6s s GLU 85 CO 0.00 0.17 0.00 -2.13 0.02 0.00 0.00 175.26 173.32 1p6s n ARG 86 N 3.79 0.00 -4.60 1.61 3.00 -1.26 -4.67 116.66 114.53 1p6s n ARG 86 Ca -0.17 0.00 -0.34 0.00 -0.00 0.00 0.00 57.85 57.35 1p6s n ARG 86 Cb 0.52 -0.05 -0.12 0.00 0.00 0.00 0.00 32.46 32.81 1p6s n ARG 86 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1p6s s THR 87 N -2.00 3.59 -0.06 5.15 -4.23 -1.26 0.32 115.64 117.15 1p6s s THR 87 Ca 0.00 -0.49 -0.07 0.00 -1.18 0.00 0.00 61.69 59.95 1p6s s THR 87 Cb 0.00 -2.51 0.02 0.00 1.34 0.00 0.00 72.50 71.34 1p6s s THR 87 CO 0.00 0.55 0.19 0.72 -0.54 0.00 0.00 174.62 175.54 1p6s s PHE 88 N -0.15 -0.17 0.15 3.99 -0.12 0.04 -4.70 117.98 117.01 1p6s s PHE 88 Ca 0.02 0.41 0.03 0.00 -0.05 0.00 0.00 56.93 57.34 1p6s s PHE 88 Cb -0.13 0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.28 1p6s s PHE 88 CO 0.03 -0.14 0.20 -1.01 -0.05 0.00 0.00 175.22 174.25 1p6s s HIS 89 N -0.19 3.33 0.16 3.49 3.76 0.92 -0.32 115.29 126.44 1p6s s HIS 89 Ca -0.03 0.07 0.05 0.00 -0.15 0.00 0.00 55.06 55.00 1p6s s HIS 89 Cb -0.03 -1.60 -0.04 0.00 1.11 0.00 0.00 32.58 32.02 1p6s s HIS 89 CO 0.01 0.52 0.11 0.14 -0.85 0.00 0.00 174.74 174.67 1p6s s VAL 90 N -1.71 4.35 0.42 -0.90 -7.23 -1.25 0.69 120.40 114.78 1p6s s VAL 90 Ca 0.33 -1.13 0.09 0.00 -1.81 0.00 0.00 61.98 59.46 1p6s s VAL 90 Cb -0.11 -3.21 0.23 0.00 0.56 0.00 0.00 36.38 33.85 1p6s s VAL 90 CO 0.26 -0.10 2.02 -0.78 -0.31 0.00 0.00 175.10 176.19 1p6s h ASP 91 N 2.49 0.31 -4.86 4.85 1.82 -1.84 -3.43 116.42 115.76 1p6s h ASP 91 Ca -0.47 -0.03 -0.20 0.00 -0.39 0.00 0.00 57.03 55.94 1p6s h ASP 91 Cb 1.20 -0.08 -0.17 0.00 0.68 0.00 0.00 39.33 40.96 1p6s h ASP 91 CO 0.62 0.30 -0.70 -0.55 -1.61 0.00 0.00 179.24 177.30 1p6s s SER 92 N -6.82 0.77 0.21 2.28 0.15 -1.26 -5.04 113.70 103.98 1p6s s SER 92 Ca -0.07 -0.81 -0.06 0.00 0.70 0.00 0.00 55.95 55.70 1p6s s SER 92 Cb 0.17 0.11 0.16 0.00 -1.71 0.00 0.00 66.02 64.74 1p6s s SER 92 CO 0.72 -0.41 1.67 1.55 1.20 0.00 0.00 173.24 177.97 1p6s h PRO 93 N 3.65 0.96 -0.07 5.44 0.13 -1.90 -2.40 132.00 137.81 1p6s h PRO 93 Ca -0.35 -0.30 -0.08 0.00 -0.87 0.00 0.00 66.00 64.40 1p6s h PRO 93 Cb 1.17 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1p6s h PRO 93 CO 0.55 0.96 -0.32 0.38 -0.23 0.00 0.00 178.00 179.35 1p6s h ASP 94 N 0.87 0.12 -0.76 1.44 2.03 -1.99 -2.54 116.42 115.60 1p6s h ASP 94 Ca 0.15 -0.04 0.03 0.00 -0.73 0.00 0.00 57.03 56.45 1p6s h ASP 94 Cb 0.56 -0.03 -0.05 0.00 -0.83 0.00 0.00 39.33 38.98 1p6s h ASP 94 CO 0.03 0.44 0.48 -0.33 -1.03 0.00 0.00 179.24 178.84 1p6s h GLU 95 N 0.11 0.91 -0.94 4.15 3.07 -1.84 -1.34 114.58 118.70 1p6s h GLU 95 Ca 0.01 -0.05 0.12 0.00 -0.50 0.00 0.00 59.36 58.94 1p6s h GLU 95 Cb 0.63 -0.21 -0.08 0.00 -0.84 0.00 0.00 28.75 28.25 1p6s h GLU 95 CO 0.05 0.60 0.57 -0.09 -1.40 0.00 0.00 179.01 178.73 1p6s h ARG 96 N 0.94 0.87 -0.41 2.33 2.43 -1.31 0.31 114.38 119.54 1p6s h ARG 96 Ca 0.31 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.34 1p6s h ARG 96 Cb 0.02 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1p6s h ARG 96 CO -0.11 0.57 -0.07 0.93 -1.51 0.00 0.00 179.97 179.78 1p6s h GLU 97 N 0.90 0.78 -0.71 0.20 5.08 -1.28 -2.51 114.58 117.03 1p6s h GLU 97 Ca 0.47 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1p6s h GLU 97 Cb 0.48 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 1p6s h GLU 97 CO -0.27 0.89 0.42 1.49 -1.00 0.00 0.00 179.01 180.54 1p6s h GLU 98 N 0.60 0.96 -0.36 2.33 4.81 -0.34 -2.17 114.58 120.41 1p6s h GLU 98 Ca 0.11 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1p6s h GLU 98 Cb 0.59 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 1p6s h GLU 98 CO 0.04 0.69 0.23 -1.49 -0.73 0.00 0.00 179.01 177.74 1p6s h TRP 99 N 0.96 0.47 -0.52 0.92 -0.00 -0.88 -1.64 115.95 115.26 1p6s h TRP 99 Ca 0.25 0.00 0.04 0.00 -0.00 0.00 0.00 58.89 59.19 1p6s h TRP 99 Cb -0.02 -0.15 -0.04 0.00 -0.00 0.00 0.00 29.16 28.94 1p6s h TRP 99 CO -0.01 0.32 0.26 1.98 -0.00 0.00 0.00 178.44 180.99 1p6s h MET 100 N 0.48 0.50 -0.66 0.49 4.05 -1.13 -0.85 114.93 117.81 1p6s h MET 100 Ca 0.13 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.49 1p6s h MET 100 Cb -0.02 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 30.64 1p6s h MET 100 CO -0.03 0.33 0.31 0.00 0.23 0.00 0.00 176.91 177.75 1p6s h ARG 101 N 0.51 0.96 -0.54 0.39 2.47 -1.10 -2.01 114.38 115.05 1p6s h ARG 101 Ca 0.23 -0.15 -0.02 0.00 -1.26 0.00 0.00 59.98 58.78 1p6s h ARG 101 Cb 0.13 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.26 1p6s h ARG 101 CO -0.16 0.77 0.24 0.00 0.56 0.00 0.00 179.97 181.38 1p6s h ALA 102 N 1.14 0.70 -0.95 0.04 0.00 -0.73 -1.77 119.26 117.69 1p6s h ALA 102 Ca 0.22 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1p6s h ALA 102 Cb 0.14 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1p6s h ALA 102 CO -0.03 0.28 0.58 0.82 0.00 0.00 0.00 179.25 180.91 1p6s h ILE 103 N 0.73 1.26 -0.60 0.00 2.04 -0.91 -1.84 117.51 118.19 1p6s h ILE 103 Ca 0.18 -0.54 -0.09 0.00 1.00 0.00 0.00 64.86 65.41 1p6s h ILE 103 Cb 0.15 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.12 1p6s h ILE 103 CO -0.02 0.27 0.01 -0.61 0.00 0.00 0.00 178.15 177.80 1p6s h GLN 104 N 1.30 1.05 -0.55 2.37 5.75 -1.01 -2.32 115.11 121.70 1p6s h GLN 104 Ca 0.34 -0.33 -0.09 0.00 -0.15 0.00 0.00 58.65 58.42 1p6s h GLN 104 Cb -0.07 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.36 1p6s h GLN 104 CO -0.07 1.03 0.01 1.98 -2.65 0.00 0.00 178.83 179.13 1p6s h MET 105 N 0.95 0.96 -0.69 1.69 4.05 -0.91 -2.31 114.93 118.67 1p6s h MET 105 Ca 0.17 -0.30 -0.07 0.00 -0.28 0.00 0.00 59.70 59.21 1p6s h MET 105 Cb 0.55 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.23 1p6s h MET 105 CO 0.03 0.97 0.14 0.28 0.23 0.00 0.00 176.91 178.55 1p6s h VAL 106 N 0.84 1.26 -0.43 -5.77 2.07 -1.25 -2.67 116.25 110.31 1p6s h VAL 106 Ca 0.16 -1.01 -0.07 0.00 0.82 0.00 0.00 66.70 66.60 1p6s h VAL 106 Cb 0.52 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1p6s h VAL 106 CO 0.03 0.38 -0.01 0.00 0.02 0.00 0.00 177.57 177.99 1p6s h ALA 107 N 1.08 1.18 -0.99 1.67 0.00 -1.27 0.60 119.26 121.54 1p6s h ALA 107 Ca 0.21 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1p6s h ALA 107 Cb 0.41 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1p6s h ALA 107 CO 0.01 0.54 0.64 -0.91 0.00 0.00 0.00 179.25 179.52 1p6s h ASN 108 N 0.66 1.15 0.89 0.00 2.35 -1.07 -0.73 115.58 118.83 1p6s h ASN 108 Ca 0.13 -0.04 -0.22 0.00 -0.55 0.00 0.00 56.30 55.62 1p6s h ASN 108 Cb 0.42 -0.29 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 1p6s h ASN 108 CO 0.02 0.85 -1.17 0.77 -1.65 0.00 0.00 177.43 176.24 1p6s h SER 109 N 1.35 0.00 -0.45 5.81 4.64 -1.32 -3.32 113.55 120.26 1p6s h SER 109 Ca 0.36 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.57 1p6s h SER 109 Cb -0.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 1p6s h SER 109 CO -0.07 0.93 -0.16 -0.07 -0.87 0.00 0.00 176.83 176.58 1p6s h LEU 110 N 0.00 0.92 0.00 5.97 4.07 -0.47 -3.52 115.31 122.28 1p6s h LEU 110 Ca -0.09 -0.38 0.00 0.00 0.08 0.00 0.00 57.88 57.48 1p6s h LEU 110 Cb 1.79 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 43.28 1p6s h LEU 110 CO 0.11 1.09 0.00 0.29 -1.08 0.00 0.00 178.44 178.85