#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 -1.76 -2.91 7.83 2.85 -1.26 -4.94 115.26 115.08 1p6s n ASN 2 Ca 0.00 -0.74 -0.13 0.00 -0.11 0.00 0.00 54.58 53.60 1p6s n ASN 2 Cb 0.00 -4.48 0.01 0.00 1.24 0.00 0.00 39.78 36.55 1p6s n ASN 2 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1p6s n GLU 3 N -4.25 1.06 -2.47 1.20 0.28 -1.26 -5.11 120.64 110.09 1p6s n GLU 3 Ca -0.28 -3.21 -0.40 0.00 -0.16 0.00 0.00 57.16 53.11 1p6s n GLU 3 Cb 0.67 -1.40 -0.04 0.00 1.43 0.00 0.00 31.44 32.09 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 -2.57 3.49 0.45 3.84 1.01 -1.26 -5.05 120.40 120.31 1p6s s VAL 4 Ca 0.33 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.82 1p6s s VAL 4 Cb 0.40 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.87 1p6s s VAL 4 CO -0.02 0.35 0.29 -1.54 0.00 0.00 0.00 175.10 174.17 1p6s n SER 5 N 1.27 2.57 -4.74 3.32 3.41 -1.26 -4.87 113.62 113.32 1p6s n SER 5 Ca -0.01 -2.61 -0.40 0.00 -0.26 0.00 0.00 58.87 55.59 1p6s n SER 5 Cb 0.45 0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.36 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 -2.30 4.91 -0.14 -3.33 1.01 -1.26 -0.75 120.40 118.54 1p6s s VAL 6 Ca 0.22 1.45 -0.22 0.00 0.00 0.00 0.00 61.98 63.43 1p6s s VAL 6 Cb -0.02 -4.04 -0.25 0.00 0.00 0.00 0.00 36.38 32.08 1p6s s VAL 6 CO 0.14 0.33 0.55 0.40 0.00 0.00 0.00 175.10 176.51 1p6s h ILE 7 N 4.40 1.28 -2.52 2.22 1.08 -0.05 -3.46 117.51 120.46 1p6s h ILE 7 Ca -0.43 -2.33 -0.09 0.00 -0.39 0.00 0.00 64.86 61.62 1p6s h ILE 7 Cb 1.20 2.82 -0.24 0.00 -3.07 0.00 0.00 36.82 37.53 1p6s h ILE 7 CO 0.73 0.55 -0.16 -0.75 -0.69 0.00 0.00 178.15 177.82 1p6s s LYS 8 N -2.36 0.54 0.02 2.37 2.47 -1.10 -5.01 119.74 116.68 1p6s s LYS 8 Ca -0.22 0.76 0.04 0.00 -1.56 0.00 0.00 55.97 54.99 1p6s s LYS 8 Cb 0.02 0.19 -0.02 0.00 -1.46 0.00 0.00 37.83 36.57 1p6s s LYS 8 CO 0.69 -0.10 -0.13 -1.83 0.16 0.00 0.00 175.35 174.14 1p6s s GLU 9 N 0.65 0.97 0.10 4.03 -1.05 -1.26 -0.00 118.70 122.14 1p6s s GLU 9 Ca -0.03 -0.63 -0.26 0.00 -0.15 0.00 0.00 54.97 53.89 1p6s s GLU 9 Cb -0.05 -0.96 0.08 0.00 -0.44 0.00 0.00 34.13 32.76 1p6s s GLU 9 CO -0.04 0.25 0.98 0.20 0.95 0.00 0.00 175.26 177.59 1p6s s GLY 10 N -0.80 -0.29 -0.14 -3.83 0.00 0.85 -4.98 107.32 98.13 1p6s s GLY 10 Ca 0.03 0.36 -0.24 0.00 0.00 0.00 0.00 44.72 44.86 1p6s s GLY 10 CO 0.01 0.08 0.78 -0.98 0.00 0.00 0.00 173.10 172.98 1p6s s TRP 11 N -3.17 3.47 0.21 1.90 0.52 -1.26 0.25 118.94 120.86 1p6s s TRP 11 Ca 0.11 1.23 0.06 0.00 0.02 0.00 0.00 56.10 57.52 1p6s s TRP 11 Cb -0.01 -2.93 -0.05 0.00 -1.15 0.00 0.00 33.47 29.33 1p6s s TRP 11 CO -0.00 -0.13 -0.10 -0.51 0.02 0.00 0.00 176.95 176.23 1p6s s LEU 12 N 1.69 2.48 -0.22 2.99 1.43 0.54 -3.48 118.68 124.12 1p6s s LEU 12 Ca 0.37 -1.08 -0.09 0.00 -1.03 0.00 0.00 54.13 52.30 1p6s s LEU 12 Cb -0.17 -0.52 -0.05 0.00 0.03 0.00 0.00 46.19 45.49 1p6s s LEU 12 CO 0.14 -0.30 0.12 -1.00 0.23 0.00 0.00 176.35 175.55 1p6s s HIS 13 N -3.14 3.29 -0.03 0.29 3.76 0.17 0.46 115.29 120.08 1p6s s HIS 13 Ca 0.23 0.13 0.07 0.00 -0.15 0.00 0.00 55.06 55.34 1p6s s HIS 13 Cb 0.02 -2.20 -0.01 0.00 1.11 0.00 0.00 32.58 31.49 1p6s s HIS 13 CO 0.06 0.07 -0.23 0.21 -0.85 0.00 0.00 174.74 174.01 1p6s s LYS 14 N 0.84 2.03 0.09 1.40 2.36 -0.58 -0.16 119.74 125.71 1p6s s LYS 14 Ca 0.06 -0.82 -0.31 0.00 -2.55 0.00 0.00 55.97 52.35 1p6s s LYS 14 Cb -0.13 -1.87 -0.06 0.00 -1.05 0.00 0.00 37.83 34.71 1p6s s LYS 14 CO 0.03 0.44 1.24 0.50 1.55 0.00 0.00 175.35 179.11 1p6s s ARG 15 N -0.39 4.42 0.00 4.03 3.52 -1.25 -1.91 118.95 127.36 1p6s s ARG 15 Ca 0.05 1.84 0.00 0.00 -0.13 0.00 0.00 55.73 57.49 1p6s s ARG 15 Cb -0.10 -3.31 0.00 0.00 -1.56 0.00 0.00 34.95 29.97 1p6s s ARG 15 CO 0.01 -0.27 0.00 0.41 -0.81 0.00 0.00 175.30 174.63 1p6s n GLY 16 N 3.15 -0.58 1.05 8.12 0.00 -0.54 -4.87 105.19 111.53 1p6s n GLY 16 Ca 0.09 -0.41 0.14 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 -2.26 0.27 1.61 4.07 -1.26 -0.74 120.64 122.32 1p6s n GLU 17 Ca 0.00 1.68 0.12 0.00 -0.06 0.00 0.00 57.16 58.90 1p6s n GLU 17 Cb 0.00 -2.70 0.74 0.00 -0.06 0.00 0.00 31.44 29.42 1p6s n GLU 17 CO 0.00 0.00 0.00 0.10 -0.06 0.00 0.00 177.13 177.17 1p6s h TYR 18 N -1.00 0.00 -0.01 4.31 -0.00 -2.02 -1.83 116.97 116.41 1p6s h TYR 18 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.67 1p6s h TYR 18 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.71 1p6s h TYR 18 CO -0.19 0.10 -0.14 1.51 -0.00 0.00 0.00 178.16 179.44 1p6s n ILE 19 N -3.81 0.00 -3.46 -0.90 3.06 -1.26 -4.98 119.36 108.01 1p6s n ILE 19 Ca -0.02 -0.23 -0.23 0.00 -2.50 0.00 0.00 62.75 59.77 1p6s n ILE 19 Cb 0.20 0.62 0.06 0.00 0.54 0.00 0.00 39.64 41.05 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 -0.05 -1.74 -4.30 9.51 4.81 0.08 -5.00 118.16 121.47 1p6s n LYS 20 Ca 0.15 0.67 -0.16 0.00 -0.87 0.00 0.00 58.31 58.10 1p6s n LYS 20 Cb 0.39 -4.99 -0.10 0.00 0.02 0.00 0.00 35.03 30.34 1p6s n LYS 20 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1p6s s THR 21 N -3.43 0.37 -0.65 3.15 2.01 -0.19 -4.63 115.64 112.26 1p6s s THR 21 Ca 0.47 -2.00 -0.24 0.00 0.31 0.00 0.00 61.69 60.23 1p6s s THR 21 Cb -0.11 -2.57 0.05 0.00 0.01 0.00 0.00 72.50 69.88 1p6s s THR 21 CO 0.80 0.00 1.05 0.26 -0.69 0.00 0.00 174.62 176.04 1p6s s TRP 22 N -3.80 2.59 0.03 4.92 0.52 -1.26 -1.47 118.94 120.48 1p6s s TRP 22 Ca 0.37 -0.25 -0.01 0.00 0.02 0.00 0.00 56.10 56.23 1p6s s TRP 22 Cb 0.07 -4.35 -0.04 0.00 -1.15 0.00 0.00 33.47 28.00 1p6s s TRP 22 CO 0.15 -1.70 0.17 0.50 0.02 0.00 0.00 176.95 176.09 1p6s s ARG 23 N 4.53 3.34 0.04 4.98 3.52 -0.80 -4.65 118.95 129.90 1p6s s ARG 23 Ca 0.28 -0.43 -0.30 0.00 -0.13 0.00 0.00 55.73 55.15 1p6s s ARG 23 Cb -0.13 -3.01 -0.06 0.00 -1.56 0.00 0.00 34.95 30.19 1p6s s ARG 23 CO 0.14 0.63 1.34 -1.25 -0.81 0.00 0.00 175.30 175.36 1p6s s PRO 24 N -2.21 4.33 0.01 5.12 0.04 -1.26 -1.53 135.00 139.49 1p6s s PRO 24 Ca 0.30 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.28 1p6s s PRO 24 Cb -0.13 -3.45 -0.01 0.00 0.04 0.00 0.00 34.50 30.95 1p6s s PRO 24 CO 0.23 -0.47 -0.02 1.03 0.04 0.00 0.00 177.00 177.80 1p6s s ARG 25 N 1.81 0.20 -0.48 4.56 0.52 0.17 -4.89 118.95 120.85 1p6s s ARG 25 Ca 0.62 -0.36 -0.28 0.00 -0.52 0.00 0.00 55.73 55.19 1p6s s ARG 25 Cb -0.32 0.04 -0.00 0.00 0.52 0.00 0.00 34.95 35.19 1p6s s ARG 25 CO 0.28 -0.02 1.58 -0.47 0.02 0.00 0.00 175.30 176.69 1p6s s TYR 26 N -0.84 2.09 -0.14 -0.53 6.14 -0.09 -0.34 117.35 123.64 1p6s s TYR 26 Ca -0.09 0.61 -0.07 0.00 0.64 0.00 0.00 57.07 58.16 1p6s s TYR 26 Cb -0.06 -4.26 -0.04 0.00 0.42 0.00 0.00 41.96 38.02 1p6s s TYR 26 CO -0.01 -2.27 0.11 -0.06 0.64 0.00 0.00 175.55 173.96 1p6s s PHE 27 N 6.62 3.45 -0.07 4.97 0.40 0.14 -0.41 117.98 133.08 1p6s s PHE 27 Ca 0.64 0.38 0.02 0.00 -0.60 0.00 0.00 56.93 57.36 1p6s s PHE 27 Cb -0.15 -2.00 0.02 0.00 0.51 0.00 0.00 43.02 41.40 1p6s s PHE 27 CO 0.28 0.52 -0.11 -0.51 0.70 0.00 0.00 175.22 176.10 1p6s s LEU 28 N -0.48 1.52 -0.17 -0.37 1.02 0.11 -0.10 118.68 120.21 1p6s s LEU 28 Ca 0.11 -0.29 -0.09 0.00 0.02 0.00 0.00 54.13 53.89 1p6s s LEU 28 Cb -0.12 -0.80 -0.05 0.00 0.02 0.00 0.00 46.19 45.25 1p6s s LEU 28 CO 0.02 -0.01 0.14 -0.22 0.02 0.00 0.00 176.35 176.30 1p6s s LEU 29 N 0.92 4.27 0.41 1.79 2.96 1.00 0.43 118.68 130.46 1p6s s LEU 29 Ca -0.10 0.32 0.08 0.00 -0.22 0.00 0.00 54.13 54.21 1p6s s LEU 29 Cb -0.15 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.45 1p6s s LEU 29 CO 0.01 0.26 0.49 -0.54 -1.32 0.00 0.00 176.35 175.25 1p6s s LYS 30 N -0.11 2.76 0.00 1.98 1.02 -0.01 0.62 119.74 126.01 1p6s s LYS 30 Ca 0.11 -1.31 0.23 0.00 0.02 0.00 0.00 55.97 55.02 1p6s s LYS 30 Cb -0.11 -2.64 1.16 0.00 -0.52 0.00 0.00 37.83 35.71 1p6s s LYS 30 CO 0.00 -0.20 1.77 0.45 -0.92 0.00 0.00 175.35 176.45 1p6s n SER 31 N -1.72 0.00 -0.22 2.83 2.88 0.07 -2.80 113.62 114.66 1p6s n SER 31 Ca 0.06 0.03 0.14 0.00 -1.33 0.00 0.00 58.87 57.76 1p6s n SER 31 Cb 0.60 -0.31 0.62 0.00 -0.75 0.00 0.00 64.21 64.36 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 -1.31 0.77 -0.26 -3.46 2.03 -1.26 -4.90 116.55 108.15 1p6s n ASP 32 Ca 0.10 -0.98 0.00 0.00 0.52 0.00 0.00 54.79 54.43 1p6s n ASP 32 Cb 0.20 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.59 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 1.20 0.95 3.18 0.27 0.00 -1.12 -4.69 105.19 104.97 1p6s n GLY 33 Ca 0.17 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.70 1.64 -0.09 1.61 1.04 -1.26 -1.01 113.70 112.94 1p6s s SER 34 Ca 0.00 -0.67 0.04 0.00 0.48 0.00 0.00 55.95 55.81 1p6s s SER 34 Cb 0.00 -0.04 -0.00 0.00 0.10 0.00 0.00 66.02 66.08 1p6s s SER 34 CO 0.00 -0.12 -0.23 0.12 0.98 0.00 0.00 173.24 173.99 1p6s s PHE 35 N -1.56 2.44 -0.20 5.02 2.19 0.87 -0.83 117.98 125.92 1p6s s PHE 35 Ca 0.00 -0.93 -0.07 0.00 0.33 0.00 0.00 56.93 56.26 1p6s s PHE 35 Cb -0.08 -1.63 -0.03 0.00 -1.31 0.00 0.00 43.02 39.96 1p6s s PHE 35 CO 0.02 -0.36 0.04 0.42 1.83 0.00 0.00 175.22 177.17 1p6s s ILE 36 N 0.24 4.39 -0.32 3.12 -1.09 0.17 0.71 121.20 128.42 1p6s s ILE 36 Ca -0.15 -0.17 -0.05 0.00 -2.23 0.00 0.00 60.65 58.06 1p6s s ILE 36 Cb -0.17 -3.00 0.04 0.00 -1.58 0.00 0.00 42.46 37.75 1p6s s ILE 36 CO 0.07 0.42 0.06 -0.83 -1.23 0.00 0.00 174.94 173.43 1p6s s GLY 37 N 0.88 1.80 -0.07 6.18 0.00 0.12 0.07 107.32 116.29 1p6s s GLY 37 Ca 0.03 -1.70 -0.04 0.00 0.00 0.00 0.00 44.72 43.01 1p6s s GLY 37 CO 0.02 0.72 0.11 -0.47 0.00 0.00 0.00 173.10 173.49 1p6s s TYR 38 N 1.37 3.46 0.28 1.90 6.14 0.46 -0.83 117.35 130.12 1p6s s TYR 38 Ca -0.02 0.38 0.07 0.00 0.64 0.00 0.00 57.07 58.14 1p6s s TYR 38 Cb -0.19 -1.86 0.41 0.00 0.42 0.00 0.00 41.96 40.74 1p6s s TYR 38 CO 0.01 0.64 1.67 -0.22 0.64 0.00 0.00 175.55 178.29 1p6s h LYS 39 N 4.65 0.21 -3.53 4.97 3.64 -1.92 -0.21 116.57 124.37 1p6s h LYS 39 Ca -0.52 -0.11 -0.06 0.00 -1.27 0.00 0.00 60.65 58.69 1p6s h LYS 39 Cb 1.21 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.90 1p6s h LYS 39 CO 0.60 0.64 -0.17 -2.00 -2.27 0.00 0.00 179.45 176.25 1p6s s GLU 40 N -4.01 1.00 -0.29 1.90 2.56 -1.26 -4.61 118.70 113.98 1p6s s GLU 40 Ca -0.04 -0.80 -0.29 0.00 0.00 0.00 0.00 54.97 53.84 1p6s s GLU 40 Cb 0.13 0.43 -0.07 0.00 2.00 0.00 0.00 34.13 36.62 1p6s s GLU 40 CO 0.77 -0.37 2.26 -2.13 -0.56 0.00 0.00 175.26 175.23 1p6s n ARG 41 N -0.17 1.65 -3.12 4.30 0.63 -1.26 -4.85 116.66 113.84 1p6s n ARG 41 Ca -0.16 0.40 -0.32 0.00 -0.92 0.00 0.00 57.85 56.86 1p6s n ARG 41 Cb 0.63 -3.12 -0.06 0.00 0.45 0.00 0.00 32.46 30.36 1p6s n ARG 41 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1p6s s PRO 42 N 6.67 4.00 0.04 -0.14 0.04 -1.26 -4.87 135.00 139.48 1p6s s PRO 42 Ca 1.03 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.73 1p6s s PRO 42 Cb -0.41 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 31.71 1p6s s PRO 42 CO 0.36 0.14 0.00 -1.91 0.04 0.00 0.00 177.00 175.64 1p6s n GLU 43 N -0.41 0.00 -1.35 4.56 0.00 -1.26 -5.05 120.64 117.13 1p6s n GLU 43 Ca 0.04 0.00 0.17 0.00 0.00 0.00 0.00 57.16 57.36 1p6s n GLU 43 Cb 0.53 0.00 -0.08 0.00 0.00 0.00 0.00 31.44 31.89 1p6s n GLU 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1p6s n ALA 44 N -2.53 -3.53 -0.04 4.31 0.00 -1.26 -4.43 120.51 113.03 1p6s n ALA 44 Ca 0.00 0.80 -0.15 0.00 0.00 0.00 0.00 53.44 54.09 1p6s n ALA 44 Cb 0.00 -1.43 -0.09 0.00 0.00 0.00 0.00 19.45 17.93 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 -1.31 0.41 -0.47 0.00 0.13 -2.04 -3.41 132.00 125.29 1p6s h PRO 45 Ca -0.15 -0.31 -0.30 0.00 -0.87 0.00 0.00 66.00 64.38 1p6s h PRO 45 Cb 1.28 0.06 -0.20 0.00 0.13 0.00 0.00 31.00 32.26 1p6s h PRO 45 CO 0.06 0.93 -0.63 -3.47 -0.23 0.00 0.00 178.00 174.67 1p6s n ASP 46 N -4.38 -1.86 -3.13 1.44 -0.08 -1.26 -5.07 116.55 102.20 1p6s n ASP 46 Ca -0.08 -3.37 0.05 0.00 -1.51 0.00 0.00 54.79 49.88 1p6s n ASP 46 Cb 0.51 1.30 0.00 0.00 2.34 0.00 0.00 41.12 45.27 1p6s n ASP 46 CO 0.00 0.00 0.00 -1.58 0.12 0.00 0.00 177.20 175.74 1p6s s GLN 47 N -0.08 0.26 0.44 -0.67 2.00 -1.26 -5.15 119.66 115.19 1p6s s GLN 47 Ca 0.29 0.21 -0.23 0.00 -2.00 0.00 0.00 55.36 53.63 1p6s s GLN 47 Cb 0.26 0.10 -0.08 0.00 0.80 0.00 0.00 33.01 34.10 1p6s s GLN 47 CO -0.13 -0.47 1.12 -0.08 -0.50 0.00 0.00 175.29 175.23 1p6s s THR 48 N 2.84 3.35 0.12 -0.34 -1.32 -1.26 -4.57 115.64 114.46 1p6s s THR 48 Ca 0.23 1.01 0.10 0.00 -1.21 0.00 0.00 61.69 61.82 1p6s s THR 48 Cb -0.03 -3.51 -0.04 0.00 -1.51 0.00 0.00 72.50 67.41 1p6s s THR 48 CO -0.23 -0.02 -0.26 -0.76 -2.21 0.00 0.00 174.62 171.14 1p6s s LEU 49 N -2.94 2.32 0.89 9.08 1.02 -1.26 -5.12 118.68 122.66 1p6s s LEU 49 Ca 0.62 -0.74 -0.12 0.00 0.02 0.00 0.00 54.13 53.92 1p6s s LEU 49 Cb -0.26 -1.16 0.12 0.00 0.02 0.00 0.00 46.19 44.92 1p6s s LEU 49 CO 0.31 0.16 1.10 -2.16 0.02 0.00 0.00 176.35 175.78 1p6s s PRO 50 N -2.03 1.33 0.10 1.29 0.04 -1.26 -4.96 135.00 129.52 1p6s s PRO 50 Ca 0.13 0.71 -0.31 0.00 0.04 0.00 0.00 61.00 61.56 1p6s s PRO 50 Cb -0.10 -1.83 -0.08 0.00 0.04 0.00 0.00 34.50 32.53 1p6s s PRO 50 CO 0.06 -2.16 1.46 -1.25 0.04 0.00 0.00 177.00 175.15 1p6s s PRO 51 N -5.01 4.28 0.06 0.56 0.04 -1.26 -4.94 135.00 128.73 1p6s s PRO 51 Ca 0.63 2.14 -0.26 0.00 0.04 0.00 0.00 61.00 63.55 1p6s s PRO 51 Cb -0.17 -3.32 -0.17 0.00 0.04 0.00 0.00 34.50 30.88 1p6s s PRO 51 CO 0.56 -0.53 1.60 1.25 0.04 0.00 0.00 177.00 179.92 1p6s h LEU 52 N 7.25 -0.24 -8.32 -3.56 5.85 -1.94 -3.43 115.31 110.93 1p6s h LEU 52 Ca -0.42 -0.06 -0.63 0.00 0.84 0.00 0.00 57.88 57.61 1p6s h LEU 52 Cb 1.20 0.06 -0.32 0.00 0.37 0.00 0.00 40.66 41.98 1p6s h LEU 52 CO 0.89 -0.09 -0.86 0.20 -0.34 0.00 0.00 178.44 178.23 1p6s s ASN 53 N -5.02 2.65 -0.13 1.25 0.01 -0.01 -4.98 114.94 108.72 1p6s s ASN 53 Ca -0.15 -0.45 0.03 0.00 -0.71 0.00 0.00 52.86 51.58 1p6s s ASN 53 Cb 0.04 -0.90 0.00 0.00 0.41 0.00 0.00 41.25 40.81 1p6s s ASN 53 CO 0.64 0.17 -0.22 0.21 -1.51 0.00 0.00 177.10 176.39 1p6s s ASN 54 N 0.11 3.20 -0.06 -1.22 2.47 -1.26 0.13 114.94 118.31 1p6s s ASN 54 Ca -0.08 -0.56 0.03 0.00 0.42 0.00 0.00 52.86 52.66 1p6s s ASN 54 Cb -0.14 -1.45 -0.02 0.00 -1.45 0.00 0.00 41.25 38.18 1p6s s ASN 54 CO 0.04 0.11 -0.14 -0.36 -3.72 0.00 0.00 177.10 173.04 1p6s s PHE 55 N 0.64 2.73 -0.17 0.43 0.08 0.22 -4.95 117.98 116.95 1p6s s PHE 55 Ca -0.11 -0.20 0.01 0.00 0.12 0.00 0.00 56.93 56.76 1p6s s PHE 55 Cb -0.16 -1.66 0.02 0.00 -0.57 0.00 0.00 43.02 40.65 1p6s s PHE 55 CO 0.02 0.15 -0.20 -1.12 -0.10 0.00 0.00 175.22 173.98 1p6s s SER 56 N -0.62 3.10 -0.26 1.36 0.01 -1.26 -0.09 113.70 115.94 1p6s s SER 56 Ca 0.09 -0.63 -0.07 0.00 1.31 0.00 0.00 55.95 56.64 1p6s s SER 56 Cb -0.11 -1.46 -0.15 0.00 0.21 0.00 0.00 66.02 64.51 1p6s s SER 56 CO 0.01 0.01 -0.23 0.55 0.41 0.00 0.00 173.24 173.99 1p6s n VAL 57 N 4.54 1.53 -3.70 3.43 3.14 -0.18 -4.93 118.33 122.16 1p6s n VAL 57 Ca -0.21 -0.46 -0.26 0.00 -2.96 0.00 0.00 64.34 60.46 1p6s n VAL 57 Cb 0.50 -1.69 0.01 0.00 -1.06 0.00 0.00 33.84 31.60 1p6s n VAL 57 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1p6s n ALA 58 N -3.71 -2.34 -2.10 1.55 0.00 -1.17 -3.97 120.51 108.76 1p6s n ALA 58 Ca -0.49 -0.31 -0.03 0.00 0.00 0.00 0.00 53.44 52.62 1p6s n ALA 58 Cb 0.93 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 19.29 1p6s n ALA 58 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1p6s n GLU 59 N -2.90 -3.17 -3.92 0.00 0.00 -1.26 -5.10 120.64 104.30 1p6s n GLU 59 Ca -0.19 2.52 -0.08 0.00 0.00 0.00 0.00 57.16 59.41 1p6s n GLU 59 Cb 0.50 -3.54 -0.03 0.00 0.00 0.00 0.00 31.44 28.36 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 -3.93 4.28 0.05 0.00 -0.44 -1.25 -5.01 119.66 113.37 1p6s s GLN 61 Ca 0.16 0.27 0.05 0.00 -2.50 0.00 0.00 55.36 53.34 1p6s s GLN 61 Cb -0.04 -3.42 -0.03 0.00 -1.64 0.00 0.00 33.01 27.88 1p6s s GLN 61 CO 0.08 0.22 -0.13 -1.17 0.50 0.00 0.00 175.29 174.79 1p6s s LEU 62 N 0.49 2.23 -0.01 3.68 0.20 -1.26 -0.85 118.68 123.16 1p6s s LEU 62 Ca 0.21 -0.54 -0.14 0.00 0.69 0.00 0.00 54.13 54.35 1p6s s LEU 62 Cb -0.14 -0.49 0.02 0.00 -0.43 0.00 0.00 46.19 45.15 1p6s s LEU 62 CO 0.07 -0.05 0.30 0.00 -0.29 0.00 0.00 176.35 176.38 1p6s s MET 63 N -1.46 0.67 0.30 1.98 0.23 0.10 -4.98 119.30 116.15 1p6s s MET 63 Ca -0.02 -0.23 -0.09 0.00 -1.03 0.00 0.00 55.69 54.32 1p6s s MET 63 Cb -0.09 0.30 -0.06 0.00 -1.53 0.00 0.00 34.83 33.44 1p6s s MET 63 CO 0.02 -0.19 0.63 -1.59 -2.03 0.00 0.00 175.02 171.86 1p6s s LYS 64 N -1.44 3.76 0.35 3.16 -2.85 -1.26 -0.11 119.74 121.35 1p6s s LYS 64 Ca -0.13 0.28 -0.09 0.00 -1.00 0.00 0.00 55.97 55.02 1p6s s LYS 64 Cb -0.05 -2.56 0.02 0.00 -2.06 0.00 0.00 37.83 33.19 1p6s s LYS 64 CO 0.03 0.17 0.61 -0.08 0.10 0.00 0.00 175.35 176.19 1p6s s THR 65 N -2.07 0.00 -0.13 3.79 -1.32 0.57 -4.87 115.64 111.61 1p6s s THR 65 Ca 0.48 -1.32 0.15 0.00 -1.21 0.00 0.00 61.69 59.79 1p6s s THR 65 Cb -0.11 -2.68 0.30 0.00 -1.51 0.00 0.00 72.50 68.50 1p6s s THR 65 CO 0.26 0.00 1.15 -0.62 -2.21 0.00 0.00 174.62 173.21 1p6s n GLU 66 N -0.53 1.14 -3.95 7.08 1.02 -1.26 -1.19 120.64 122.95 1p6s n GLU 66 Ca -0.03 -2.57 -0.11 0.00 -0.02 0.00 0.00 57.16 54.43 1p6s n GLU 66 Cb 0.61 -1.33 -0.13 0.00 -0.02 0.00 0.00 31.44 30.57 1p6s n GLU 66 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1p6s s ARG 67 N -2.47 0.19 0.38 3.49 0.52 -1.26 -3.66 118.95 116.14 1p6s s ARG 67 Ca 0.30 -0.32 0.28 0.00 -0.52 0.00 0.00 55.73 55.47 1p6s s ARG 67 Cb 0.28 -0.00 1.07 0.00 0.52 0.00 0.00 34.95 36.82 1p6s s ARG 67 CO -0.01 -0.01 1.82 -1.00 0.02 0.00 0.00 175.30 176.11 1p6s h PRO 68 N 5.40 0.00 -6.09 3.54 0.13 -2.01 -3.48 132.00 129.49 1p6s h PRO 68 Ca -0.28 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.23 1p6s h PRO 68 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1p6s h PRO 68 CO 0.46 0.00 -0.72 1.03 -0.23 0.00 0.00 178.00 178.54 1p6s s ARG 69 N -3.42 1.75 0.68 0.86 1.81 -1.24 -5.13 118.95 114.26 1p6s s ARG 69 Ca 0.04 -1.84 -0.14 0.00 -1.72 0.00 0.00 55.73 52.06 1p6s s ARG 69 Cb 0.09 -1.74 0.01 0.00 -0.45 0.00 0.00 34.95 32.86 1p6s s ARG 69 CO 0.49 0.25 1.12 -1.25 -0.68 0.00 0.00 175.30 175.22 1p6s s PRO 70 N -3.56 2.63 -0.95 3.54 0.04 -1.24 -4.08 135.00 131.38 1p6s s PRO 70 Ca 0.31 1.40 -0.07 0.00 0.04 0.00 0.00 61.00 62.68 1p6s s PRO 70 Cb -0.02 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 1p6s s PRO 70 CO 0.16 -1.38 0.80 0.09 0.04 0.00 0.00 177.00 176.71 1p6s n ASN 71 N -2.62 -6.65 -4.37 6.66 3.02 -1.24 -4.78 115.26 105.28 1p6s n ASN 71 Ca 0.10 -0.58 -0.23 0.00 -0.03 0.00 0.00 54.58 53.84 1p6s n ASN 71 Cb 0.52 -4.65 -0.11 0.00 -0.61 0.00 0.00 39.78 34.93 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 -3.25 2.03 -0.10 3.41 2.01 -0.33 -2.53 115.64 116.88 1p6s s THR 72 Ca 0.28 -2.01 0.04 0.00 0.31 0.00 0.00 61.69 60.31 1p6s s THR 72 Cb -0.06 -1.98 0.00 0.00 0.01 0.00 0.00 72.50 70.48 1p6s s THR 72 CO 0.78 -0.27 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.84 1p6s s PHE 73 N -2.01 2.47 -0.05 4.92 0.40 0.11 -0.32 117.98 123.49 1p6s s PHE 73 Ca 0.19 -1.02 0.06 0.00 -0.60 0.00 0.00 56.93 55.56 1p6s s PHE 73 Cb -0.06 -1.66 -0.01 0.00 0.51 0.00 0.00 43.02 41.80 1p6s s PHE 73 CO 0.08 -0.42 -0.23 0.08 0.70 0.00 0.00 175.22 175.43 1p6s s VAL 74 N 0.39 1.92 -0.06 -0.44 1.01 0.84 -0.41 120.40 123.65 1p6s s VAL 74 Ca -0.18 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 60.86 1p6s s VAL 74 Cb -0.18 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 1p6s s VAL 74 CO 0.08 0.54 -0.22 -0.51 0.00 0.00 0.00 175.10 174.98 1p6s s ILE 75 N -0.12 1.86 -0.20 2.22 1.10 0.78 0.03 121.20 126.87 1p6s s ILE 75 Ca -0.04 -0.94 -0.04 0.00 -0.51 0.00 0.00 60.65 59.12 1p6s s ILE 75 Cb -0.13 -1.59 0.06 0.00 0.15 0.00 0.00 42.46 40.96 1p6s s ILE 75 CO 0.03 0.52 0.06 -0.13 -2.11 0.00 0.00 174.94 173.32 1p6s s ARG 76 N 0.02 0.41 -0.22 3.50 1.81 -0.03 -4.34 118.95 120.09 1p6s s ARG 76 Ca -0.07 -0.34 -0.04 0.00 -1.72 0.00 0.00 55.73 53.57 1p6s s ARG 76 Cb -0.14 -1.94 -0.19 0.00 -0.45 0.00 0.00 34.95 32.23 1p6s s ARG 76 CO 0.04 -0.69 -0.06 0.00 -0.68 0.00 0.00 175.30 173.91 1p6s s LEU 78 N -6.86 3.76 -0.40 0.00 1.43 -1.26 -4.95 118.68 110.39 1p6s s LEU 78 Ca -0.32 -0.15 0.04 0.00 -1.03 0.00 0.00 54.13 52.67 1p6s s LEU 78 Cb 0.09 -2.38 0.60 0.00 0.03 0.00 0.00 46.19 44.53 1p6s s LEU 78 CO 0.63 0.07 1.82 1.67 0.23 0.00 0.00 176.35 180.78 1p6s n GLN 79 N -0.33 2.12 0.23 1.70 7.27 -1.26 -4.61 117.38 122.51 1p6s n GLN 79 Ca -0.08 -2.70 0.00 0.00 0.07 0.00 0.00 57.00 54.29 1p6s n GLN 79 Cb 0.55 -2.06 0.00 0.00 2.41 0.00 0.00 30.24 31.14 1p6s n GLN 79 CO 0.00 0.00 0.00 1.87 0.07 0.00 0.00 177.06 179.00 1p6s n TRP 80 N -0.98 -4.62 -3.51 3.69 -0.00 -1.26 -5.10 117.44 105.67 1p6s n TRP 80 Ca 0.54 1.56 -0.38 0.00 -0.00 0.00 0.00 57.50 59.21 1p6s n TRP 80 Cb 1.55 3.84 -0.09 0.00 -0.00 0.00 0.00 31.31 36.61 1p6s n TRP 80 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1p6s s THR 81 N -2.00 5.26 -0.68 5.87 2.01 -1.26 -4.98 115.64 119.85 1p6s s THR 81 Ca 0.00 0.40 0.01 0.00 0.31 0.00 0.00 61.69 62.41 1p6s s THR 81 Cb 0.00 -3.61 0.38 0.00 0.01 0.00 0.00 72.50 69.28 1p6s s THR 81 CO 0.00 0.24 1.70 1.07 -0.69 0.00 0.00 174.62 176.94 1p6s n THR 82 N 4.75 3.16 -2.42 -0.82 5.66 -1.26 -4.42 114.28 118.94 1p6s n THR 82 Ca -0.11 -4.40 -0.41 0.00 -3.05 0.00 0.00 64.05 56.08 1p6s n THR 82 Cb 0.51 -1.24 -0.04 0.00 -1.55 0.00 0.00 70.33 68.02 1p6s n THR 82 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1p6s s VAL 83 N -5.19 3.68 0.07 1.08 0.11 -1.26 -4.62 120.40 114.27 1p6s s VAL 83 Ca 0.52 1.41 0.00 0.00 -2.93 0.00 0.00 61.98 60.98 1p6s s VAL 83 Cb 0.43 -3.90 0.00 0.00 -1.53 0.00 0.00 36.38 31.38 1p6s s VAL 83 CO -0.29 0.23 0.00 -0.38 -3.33 0.00 0.00 175.10 171.32 1p6s n ILE 84 N 2.53-10.79 -1.23 7.04 5.41 -1.26 -4.97 119.36 116.08 1p6s n ILE 84 Ca 0.04 2.50 0.00 0.00 1.00 0.00 0.00 62.75 66.29 1p6s n ILE 84 Cb 0.45 -5.13 0.00 0.00 -0.71 0.00 0.00 39.64 34.25 1p6s n ILE 84 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1p6s n GLU 85 N 1.42 -3.44 0.11 0.38 1.02 -1.26 -4.95 120.64 113.91 1p6s n GLU 85 Ca 0.00 2.48 0.00 0.00 -0.02 0.00 0.00 57.16 59.62 1p6s n GLU 85 Cb 0.00 -2.73 0.00 0.00 -0.02 0.00 0.00 31.44 28.69 1p6s n GLU 85 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1p6s n ARG 86 N 0.17 0.00 -3.96 3.49 0.63 -1.26 -4.89 116.66 110.83 1p6s n ARG 86 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 1p6s n ARG 86 Cb 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 32.77 1p6s n ARG 86 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 1p6s s THR 87 N -1.44 0.14 -0.10 5.15 -1.32 -1.26 -0.15 115.64 116.65 1p6s s THR 87 Ca 0.00 -0.15 -0.08 0.00 -1.21 0.00 0.00 61.69 60.25 1p6s s THR 87 Cb 0.00 -0.14 0.03 0.00 -1.51 0.00 0.00 72.50 70.89 1p6s s THR 87 CO 0.00 -0.01 0.26 0.72 -2.21 0.00 0.00 174.62 173.37 1p6s s PHE 88 N -0.17 -0.30 0.11 9.09 -0.12 0.45 -4.67 117.98 122.37 1p6s s PHE 88 Ca -0.01 0.73 0.02 0.00 -0.05 0.00 0.00 56.93 57.62 1p6s s PHE 88 Cb -0.01 0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.42 1p6s s PHE 88 CO -0.00 -0.17 0.19 -1.01 -0.05 0.00 0.00 175.22 174.18 1p6s s HIS 89 N 0.50 3.36 0.20 3.49 3.76 0.78 0.04 115.29 127.41 1p6s s HIS 89 Ca -0.03 0.12 0.07 0.00 -0.15 0.00 0.00 55.06 55.07 1p6s s HIS 89 Cb -0.04 -1.65 -0.04 0.00 1.11 0.00 0.00 32.58 31.95 1p6s s HIS 89 CO -0.03 0.54 0.09 0.14 -0.85 0.00 0.00 174.74 174.63 1p6s s VAL 90 N -1.59 4.10 -0.53 -0.90 -7.23 -1.05 0.43 120.40 113.63 1p6s s VAL 90 Ca 0.33 -1.38 0.24 0.00 -1.81 0.00 0.00 61.98 59.36 1p6s s VAL 90 Cb -0.12 -3.13 0.27 0.00 0.56 0.00 0.00 36.38 33.96 1p6s s VAL 90 CO 0.26 -0.20 1.59 -0.78 -0.31 0.00 0.00 175.10 175.65 1p6s h ASP 91 N 2.21 0.00 -4.85 4.85 1.82 -1.89 -3.44 116.42 115.11 1p6s h ASP 91 Ca -0.47 -0.02 -0.23 0.00 -0.39 0.00 0.00 57.03 55.92 1p6s h ASP 91 Cb 1.22 0.00 -0.21 0.00 0.68 0.00 0.00 39.33 41.02 1p6s h ASP 91 CO 0.61 0.01 -0.72 -0.44 -1.61 0.00 0.00 179.24 177.09 1p6s s SER 92 N -5.45 0.63 0.14 2.28 0.01 -1.26 -5.04 113.70 105.00 1p6s s SER 92 Ca 0.07 -0.55 -0.12 0.00 1.31 0.00 0.00 55.95 56.66 1p6s s SER 92 Cb 0.08 0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.36 1p6s s SER 92 CO 0.66 -0.26 1.52 1.55 0.41 0.00 0.00 173.24 177.12 1p6s h PRO 93 N 4.48 0.90 -0.12 12.44 0.13 -1.94 -2.70 132.00 145.19 1p6s h PRO 93 Ca -0.34 -0.40 -0.05 0.00 -0.87 0.00 0.00 66.00 64.33 1p6s h PRO 93 Cb 1.20 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1p6s h PRO 93 CO 0.42 1.05 -0.17 -0.44 -0.23 0.00 0.00 178.00 178.63 1p6s h ASP 94 N 0.73 0.19 -0.53 1.44 3.32 -2.01 -2.61 116.42 116.95 1p6s h ASP 94 Ca 0.09 -0.04 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 1p6s h ASP 94 Cb 0.79 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.27 1p6s h ASP 94 CO 0.06 0.38 0.07 -0.08 -1.72 0.00 0.00 179.24 177.95 1p6s h GLU 95 N 0.18 0.89 -0.72 3.56 4.81 -1.90 -2.35 114.58 119.06 1p6s h GLU 95 Ca 0.04 -0.25 0.11 0.00 -0.13 0.00 0.00 59.36 59.13 1p6s h GLU 95 Cb 0.42 -0.10 -0.08 0.00 0.63 0.00 0.00 28.75 29.62 1p6s h GLU 95 CO 0.03 0.88 0.31 -0.09 -0.73 0.00 0.00 179.01 179.41 1p6s h ARG 96 N 0.77 0.49 -0.51 1.92 2.43 -1.19 0.17 114.38 118.46 1p6s h ARG 96 Ca 0.16 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.19 1p6s h ARG 96 Cb 0.43 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1p6s h ARG 96 CO 0.01 0.33 -0.12 0.93 -1.51 0.00 0.00 179.97 179.61 1p6s h GLU 97 N 0.51 0.97 -0.57 0.20 3.07 -1.49 -2.76 114.58 114.50 1p6s h GLU 97 Ca 0.37 -0.35 -0.08 0.00 -0.50 0.00 0.00 59.36 58.79 1p6s h GLU 97 Cb 0.48 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 1p6s h GLU 97 CO -0.33 1.02 0.03 1.49 -1.40 0.00 0.00 179.01 179.82 1p6s h GLU 98 N 0.86 0.97 -0.37 2.33 4.57 -0.58 -2.40 114.58 119.96 1p6s h GLU 98 Ca 0.13 -0.28 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1p6s h GLU 98 Cb 0.67 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 1p6s h GLU 98 CO 0.05 0.94 0.24 -1.49 -1.18 0.00 0.00 179.01 177.56 1p6s h TRP 99 N 0.90 0.48 -0.75 0.92 -0.00 -0.57 -2.13 115.95 114.81 1p6s h TRP 99 Ca 0.17 0.01 0.02 0.00 -0.00 0.00 0.00 58.89 59.08 1p6s h TRP 99 Cb 0.49 -0.16 -0.04 0.00 -0.00 0.00 0.00 29.16 29.45 1p6s h TRP 99 CO 0.03 0.32 0.49 1.98 -0.00 0.00 0.00 178.44 181.26 1p6s h MET 100 N 0.50 0.95 -0.47 0.49 4.05 -1.30 -1.53 114.93 117.62 1p6s h MET 100 Ca 0.14 -0.06 0.02 0.00 -0.28 0.00 0.00 59.70 59.52 1p6s h MET 100 Cb -0.03 -0.21 -0.03 0.00 -0.80 0.00 0.00 31.60 30.52 1p6s h MET 100 CO -0.03 0.63 0.28 0.00 0.23 0.00 0.00 176.91 178.02 1p6s h ARG 101 N 0.98 0.55 -0.47 0.39 2.47 -1.02 -1.36 114.38 115.93 1p6s h ARG 101 Ca 0.28 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.93 1p6s h ARG 101 Cb -0.07 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.11 1p6s h ARG 101 CO -0.08 0.36 0.15 0.00 0.56 0.00 0.00 179.97 180.96 1p6s h ALA 102 N 1.21 0.61 -0.92 0.04 0.00 -0.99 -2.10 119.26 117.10 1p6s h ALA 102 Ca 0.19 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1p6s h ALA 102 Cb 0.01 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 1p6s h ALA 102 CO -0.08 0.26 0.61 0.82 0.00 0.00 0.00 179.25 180.86 1p6s h ILE 103 N 0.62 1.22 -0.45 0.00 2.04 -0.94 -1.90 117.51 118.10 1p6s h ILE 103 Ca 0.15 -0.42 -0.08 0.00 1.00 0.00 0.00 64.86 65.51 1p6s h ILE 103 Cb 0.26 -0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.21 1p6s h ILE 103 CO -0.01 0.22 -0.03 -0.61 0.00 0.00 0.00 178.15 177.73 1p6s h GLN 104 N 1.23 0.82 -0.81 2.37 -0.00 -0.97 -2.17 115.11 115.58 1p6s h GLN 104 Ca 0.35 -0.28 -0.02 0.00 -0.00 0.00 0.00 58.65 58.70 1p6s h GLN 104 Cb -0.11 -0.07 -0.04 0.00 0.00 0.00 0.00 27.48 27.27 1p6s h GLN 104 CO -0.08 0.89 0.44 0.52 0.00 0.00 0.00 178.83 180.60 1p6s h MET 105 N 0.66 1.13 -0.52 1.69 2.86 -0.88 -2.12 114.93 117.76 1p6s h MET 105 Ca 0.12 -0.13 -0.08 0.00 -2.06 0.00 0.00 59.70 57.55 1p6s h MET 105 Cb 0.54 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 1p6s h MET 105 CO 0.03 0.83 0.00 0.28 1.06 0.00 0.00 176.91 179.11 1p6s h VAL 106 N 1.13 1.26 -1.01 -2.22 2.07 -1.18 -2.84 116.25 113.46 1p6s h VAL 106 Ca 0.29 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.74 1p6s h VAL 106 Cb 0.03 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.68 1p6s h VAL 106 CO -0.05 0.39 0.66 0.00 0.02 0.00 0.00 177.57 178.60 1p6s h ALA 107 N 0.94 1.31 -0.58 1.67 0.00 -0.89 0.37 119.26 122.09 1p6s h ALA 107 Ca 0.15 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1p6s h ALA 107 Cb 0.53 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1p6s h ALA 107 CO 0.03 0.61 0.33 -0.91 0.00 0.00 0.00 179.25 179.31 1p6s h ASN 108 N 1.32 0.51 1.68 0.00 2.35 -1.16 -2.07 115.58 118.21 1p6s h ASN 108 Ca 0.39 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 56.10 1p6s h ASN 108 Cb -0.08 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1p6s h ASN 108 CO -0.10 0.35 -0.33 0.28 -1.65 0.00 0.00 177.43 175.98 1p6s h SER 109 N 0.64 0.00 0.85 5.81 0.02 -1.25 -3.23 113.55 116.39 1p6s h SER 109 Ca 0.24 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.15 1p6s h SER 109 Cb 0.09 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1p6s h SER 109 CO -0.13 0.22 -0.19 -0.07 -1.14 0.00 0.00 176.83 175.51 1p6s h LEU 110 N 0.00 0.00 0.00 5.07 4.07 0.41 -3.52 115.31 121.34 1p6s h LEU 110 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1p6s h LEU 110 Cb 1.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 1p6s h LEU 110 CO 0.03 0.19 0.00 0.29 -1.08 0.00 0.00 178.44 177.87