#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 -8.20 -2.74 7.83 4.13 -1.26 -4.73 115.26 110.30 1p6s n ASN 2 Ca 0.00 1.30 -0.04 0.00 1.68 0.00 0.00 54.58 57.52 1p6s n ASN 2 Cb 0.00 -3.64 0.04 0.00 -1.54 0.00 0.00 39.78 34.64 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 -3.88 1.81 -3.25 3.52 0.00 -1.26 -5.07 120.64 112.52 1p6s n GLU 3 Ca 0.01 -3.54 -0.40 0.00 0.00 0.00 0.00 57.16 53.23 1p6s n GLU 3 Cb 0.55 -1.61 -0.08 0.00 0.00 0.00 0.00 31.44 30.30 1p6s n GLU 3 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1p6s s VAL 4 N -3.79 5.06 0.45 3.84 1.01 -1.26 -5.06 120.40 120.64 1p6s s VAL 4 Ca 0.29 0.68 -0.03 0.00 0.00 0.00 0.00 61.98 62.93 1p6s s VAL 4 Cb 0.35 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 1p6s s VAL 4 CO -0.02 -0.01 0.70 -0.44 0.00 0.00 0.00 175.10 175.33 1p6s s SER 5 N 1.63 6.13 0.10 3.32 0.01 -1.26 -4.77 113.70 118.85 1p6s s SER 5 Ca 0.20 0.64 -0.21 0.00 1.31 0.00 0.00 55.95 57.89 1p6s s SER 5 Cb -0.16 -2.00 -0.07 0.00 0.21 0.00 0.00 66.02 64.01 1p6s s SER 5 CO 0.11 -0.56 0.63 -0.69 0.41 0.00 0.00 173.24 173.13 1p6s s VAL 6 N -2.60 4.64 -0.21 3.43 1.01 -1.26 0.42 120.40 125.83 1p6s s VAL 6 Ca 0.46 1.36 -0.02 0.00 0.00 0.00 0.00 61.98 63.78 1p6s s VAL 6 Cb -0.10 -3.97 -0.20 0.00 0.00 0.00 0.00 36.38 32.11 1p6s s VAL 6 CO 0.41 0.54 -0.01 -0.38 0.00 0.00 0.00 175.10 175.66 1p6s n ILE 7 N 1.71 1.60 -3.70 2.22 -0.00 0.13 -4.83 119.36 116.49 1p6s n ILE 7 Ca -0.09 -0.59 -0.13 0.00 -0.00 0.00 0.00 62.75 61.95 1p6s n ILE 7 Cb 0.50 -1.55 -0.09 0.00 -0.00 0.00 0.00 39.64 38.49 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 0.57 -0.04 0.38 2.36 -1.08 -5.01 119.74 114.39 1p6s s LYS 8 Ca -0.30 0.75 0.03 0.00 -2.55 0.00 0.00 55.97 53.89 1p6s s LYS 8 Cb 0.08 0.24 0.00 0.00 -1.05 0.00 0.00 37.83 37.10 1p6s s LYS 8 CO 0.66 -0.09 -0.13 -1.21 1.55 0.00 0.00 175.35 176.13 1p6s s GLU 9 N 0.51 1.47 0.05 4.03 2.02 -1.26 -0.09 118.70 125.42 1p6s s GLU 9 Ca -0.02 -0.45 -0.28 0.00 0.02 0.00 0.00 54.97 54.24 1p6s s GLU 9 Cb -0.04 -1.28 0.09 0.00 0.10 0.00 0.00 34.13 33.00 1p6s s GLU 9 CO -0.02 0.14 1.07 0.20 0.02 0.00 0.00 175.26 176.67 1p6s s GLY 10 N 0.25 -0.32 0.03 -1.39 0.00 -0.23 -5.01 107.32 100.64 1p6s s GLY 10 Ca -0.06 0.54 -0.19 0.00 0.00 0.00 0.00 44.72 45.01 1p6s s GLY 10 CO 0.02 0.13 0.54 -0.98 0.00 0.00 0.00 173.10 172.81 1p6s s TRP 11 N -2.93 3.75 0.12 1.90 0.52 -1.26 0.18 118.94 121.23 1p6s s TRP 11 Ca 0.12 1.19 0.07 0.00 0.02 0.00 0.00 56.10 57.50 1p6s s TRP 11 Cb 0.01 -2.48 -0.04 0.00 -1.15 0.00 0.00 33.47 29.81 1p6s s TRP 11 CO -0.02 0.53 -0.17 -0.51 0.02 0.00 0.00 176.95 176.81 1p6s s LEU 12 N -0.84 2.37 -0.40 2.99 1.43 0.11 -4.30 118.68 120.05 1p6s s LEU 12 Ca 0.28 -0.77 -0.15 0.00 -1.03 0.00 0.00 54.13 52.47 1p6s s LEU 12 Cb -0.19 -0.70 0.01 0.00 0.03 0.00 0.00 46.19 45.35 1p6s s LEU 12 CO 0.17 -0.06 0.31 -1.00 0.23 0.00 0.00 176.35 176.00 1p6s s HIS 13 N -1.76 3.23 0.00 0.29 3.76 0.15 0.56 115.29 121.52 1p6s s HIS 13 Ca 0.09 -0.49 0.07 0.00 -0.15 0.00 0.00 55.06 54.57 1p6s s HIS 13 Cb -0.07 -2.61 -0.02 0.00 1.11 0.00 0.00 32.58 30.99 1p6s s HIS 13 CO 0.04 -0.56 -0.20 0.21 -0.85 0.00 0.00 174.74 173.38 1p6s s LYS 14 N 1.74 1.57 0.35 1.40 2.20 0.43 0.61 119.74 128.04 1p6s s LYS 14 Ca 0.06 -0.80 -0.23 0.00 -0.36 0.00 0.00 55.97 54.64 1p6s s LYS 14 Cb -0.18 -1.57 -0.10 0.00 -1.51 0.00 0.00 37.83 34.47 1p6s s LYS 14 CO 0.11 0.42 0.92 -0.98 -0.36 0.00 0.00 175.35 175.45 1p6s s ARG 15 N -0.71 4.39 0.00 4.03 1.70 -1.26 -0.81 118.95 126.30 1p6s s ARG 15 Ca 0.08 1.18 0.00 0.00 -0.47 0.00 0.00 55.73 56.51 1p6s s ARG 15 Cb -0.08 -2.56 0.00 0.00 -0.57 0.00 0.00 34.95 31.74 1p6s s ARG 15 CO 0.00 0.17 0.00 0.41 -1.08 0.00 0.00 175.30 174.80 1p6s n GLY 16 N 0.08 -0.56 3.71 3.88 0.00 -1.21 -4.94 105.19 106.14 1p6s n GLY 16 Ca 0.04 0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1p6s n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p6s s GLU 17 N -2.00 1.96 0.43 1.61 2.02 -1.26 -4.87 118.70 116.59 1p6s s GLU 17 Ca 0.00 1.85 0.30 0.00 0.02 0.00 0.00 54.97 57.14 1p6s s GLU 17 Cb 0.00 -1.80 1.49 0.00 0.10 0.00 0.00 34.13 33.92 1p6s s GLU 17 CO 0.00 -2.00 1.90 0.10 0.02 0.00 0.00 175.26 175.29 1p6s h TYR 18 N -0.41 0.00 0.00 1.61 -0.00 -2.00 -2.14 116.97 114.03 1p6s h TYR 18 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.25 1p6s h TYR 18 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.04 1p6s h TYR 18 CO 0.45 0.00 0.00 1.51 -0.00 0.00 0.00 178.16 180.12 1p6s n ILE 19 N -2.59 0.00 -3.08 -0.90 3.06 -1.26 -4.91 119.36 109.68 1p6s n ILE 19 Ca -0.01 0.00 -0.04 0.00 -2.50 0.00 0.00 62.75 60.20 1p6s n ILE 19 Cb 0.12 -0.48 0.02 0.00 0.54 0.00 0.00 39.64 39.84 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 -0.88 -1.56 -4.23 9.51 4.81 -0.80 -5.04 118.16 119.96 1p6s n LYS 20 Ca 0.15 1.29 -0.17 0.00 -0.87 0.00 0.00 58.31 58.70 1p6s n LYS 20 Cb 0.07 -5.70 -0.15 0.00 0.02 0.00 0.00 35.03 29.27 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 -3.11 0.53 -0.40 3.15 2.01 -1.26 -5.05 115.64 111.50 1p6s s THR 21 Ca 0.13 -0.26 -0.21 0.00 0.31 0.00 0.00 61.69 61.67 1p6s s THR 21 Cb -0.02 -0.46 0.01 0.00 0.01 0.00 0.00 72.50 72.05 1p6s s THR 21 CO 0.73 0.16 0.64 0.26 -0.69 0.00 0.00 174.62 175.72 1p6s s TRP 22 N -0.02 3.10 0.07 4.92 0.52 -1.26 -3.36 118.94 122.91 1p6s s TRP 22 Ca 0.01 0.11 0.01 0.00 0.02 0.00 0.00 56.10 56.25 1p6s s TRP 22 Cb -0.04 -3.26 -0.04 0.00 -1.15 0.00 0.00 33.47 28.98 1p6s s TRP 22 CO -0.00 -0.77 0.16 1.03 0.02 0.00 0.00 176.95 177.39 1p6s s ARG 23 N 2.77 3.21 0.16 4.98 1.81 0.01 -4.64 118.95 127.26 1p6s s ARG 23 Ca 0.23 -0.55 -0.30 0.00 -1.72 0.00 0.00 55.73 53.39 1p6s s ARG 23 Cb -0.14 -2.91 -0.08 0.00 -0.45 0.00 0.00 34.95 31.38 1p6s s ARG 23 CO 0.17 0.59 1.17 -1.25 -0.68 0.00 0.00 175.30 175.30 1p6s s PRO 24 N -2.49 4.51 -0.00 3.54 0.04 -1.26 -0.43 135.00 138.91 1p6s s PRO 24 Ca 0.33 1.81 -0.01 0.00 0.04 0.00 0.00 61.00 63.17 1p6s s PRO 24 Cb -0.13 -3.27 -0.00 0.00 0.04 0.00 0.00 34.50 31.15 1p6s s PRO 24 CO 0.26 -0.06 0.02 1.03 0.04 0.00 0.00 177.00 178.28 1p6s s ARG 25 N -0.10 0.11 -0.24 4.56 0.52 0.19 -4.87 118.95 119.12 1p6s s ARG 25 Ca 0.53 -0.11 -0.29 0.00 -0.52 0.00 0.00 55.73 55.33 1p6s s ARG 25 Cb -0.31 0.04 -0.01 0.00 0.52 0.00 0.00 34.95 35.19 1p6s s ARG 25 CO 0.35 -0.02 1.32 -0.47 0.02 0.00 0.00 175.30 176.50 1p6s s TYR 26 N -0.35 2.68 -0.10 -0.53 5.04 0.06 0.09 117.35 124.23 1p6s s TYR 26 Ca -0.04 0.88 -0.00 0.00 -2.44 0.00 0.00 57.07 55.47 1p6s s TYR 26 Cb -0.03 -3.77 -0.02 0.00 0.35 0.00 0.00 41.96 38.49 1p6s s TYR 26 CO -0.00 -1.85 -0.09 -0.06 -1.34 0.00 0.00 175.55 172.22 1p6s s PHE 27 N 4.13 2.89 -0.11 4.97 0.40 0.13 0.44 117.98 130.83 1p6s s PHE 27 Ca 0.57 -0.26 0.01 0.00 -0.60 0.00 0.00 56.93 56.66 1p6s s PHE 27 Cb -0.19 -1.80 0.02 0.00 0.51 0.00 0.00 43.02 41.55 1p6s s PHE 27 CO 0.21 0.07 -0.14 -0.51 0.70 0.00 0.00 175.22 175.55 1p6s s LEU 28 N -0.19 1.64 -0.24 -0.37 1.43 0.41 -1.07 118.68 120.29 1p6s s LEU 28 Ca 0.02 -0.40 -0.11 0.00 -1.03 0.00 0.00 54.13 52.61 1p6s s LEU 28 Cb -0.13 -1.03 -0.05 0.00 0.03 0.00 0.00 46.19 45.01 1p6s s LEU 28 CO 0.03 -0.00 0.16 -0.22 0.23 0.00 0.00 176.35 176.55 1p6s s LEU 29 N 1.07 4.11 0.47 1.79 1.98 0.87 0.23 118.68 129.21 1p6s s LEU 29 Ca -0.05 0.11 0.08 0.00 -2.89 0.00 0.00 54.13 51.38 1p6s s LEU 29 Cb -0.15 -2.11 0.03 0.00 0.66 0.00 0.00 46.19 44.63 1p6s s LEU 29 CO -0.02 0.06 0.60 -0.54 -1.89 0.00 0.00 176.35 174.56 1p6s s LYS 30 N 1.07 2.61 0.00 1.98 1.02 -0.86 0.21 119.74 125.77 1p6s s LYS 30 Ca 0.08 -1.44 0.25 0.00 0.02 0.00 0.00 55.97 54.88 1p6s s LYS 30 Cb -0.14 -2.64 1.21 0.00 -0.52 0.00 0.00 37.83 35.74 1p6s s LYS 30 CO 0.05 -0.45 1.83 0.45 -0.92 0.00 0.00 175.35 176.30 1p6s n SER 31 N -1.92 0.00 -0.28 2.83 2.88 0.17 -3.05 113.62 114.24 1p6s n SER 31 Ca 0.09 0.09 0.14 0.00 -1.33 0.00 0.00 58.87 57.87 1p6s n SER 31 Cb 0.60 -0.35 0.69 0.00 -0.75 0.00 0.00 64.21 64.40 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 -1.35 0.87 -0.65 -3.46 2.03 -1.26 -4.89 116.55 107.84 1p6s n ASP 32 Ca 0.10 -1.31 -0.01 0.00 0.52 0.00 0.00 54.79 54.09 1p6s n ASP 32 Cb 0.22 -0.00 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 1.09 0.87 2.96 0.27 0.00 -1.17 -4.82 105.19 104.39 1p6s n GLY 33 Ca 0.21 -0.64 -0.16 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 -3.02 0.61 -0.12 1.61 0.01 -1.26 -0.96 113.70 110.58 1p6s s SER 34 Ca 0.03 -0.09 -0.05 0.00 1.31 0.00 0.00 55.95 57.15 1p6s s SER 34 Cb -0.01 -0.07 -0.04 0.00 0.21 0.00 0.00 66.02 66.11 1p6s s SER 34 CO 0.04 0.06 0.07 0.12 0.41 0.00 0.00 173.24 173.94 1p6s s PHE 35 N -0.12 3.34 -0.21 2.43 2.19 -0.03 -2.02 117.98 123.55 1p6s s PHE 35 Ca 0.02 0.29 -0.07 0.00 0.33 0.00 0.00 56.93 57.50 1p6s s PHE 35 Cb -0.02 -1.91 -0.03 0.00 -1.31 0.00 0.00 43.02 39.75 1p6s s PHE 35 CO -0.00 0.49 0.05 0.42 1.83 0.00 0.00 175.22 178.01 1p6s s ILE 36 N -0.64 4.38 -0.25 3.12 -1.09 0.13 0.74 121.20 127.60 1p6s s ILE 36 Ca 0.11 -0.16 -0.06 0.00 -2.23 0.00 0.00 60.65 58.31 1p6s s ILE 36 Cb -0.12 -3.01 -0.02 0.00 -1.58 0.00 0.00 42.46 37.74 1p6s s ILE 36 CO 0.02 0.40 0.03 -0.83 -1.23 0.00 0.00 174.94 173.34 1p6s s GLY 37 N 1.05 1.72 -0.15 6.18 0.00 0.19 -0.45 107.32 115.85 1p6s s GLY 37 Ca 0.04 -1.18 -0.02 0.00 0.00 0.00 0.00 44.72 43.55 1p6s s GLY 37 CO 0.03 0.51 -0.07 -0.47 0.00 0.00 0.00 173.10 173.10 1p6s s TYR 38 N 1.56 2.94 0.34 1.90 6.14 0.17 0.09 117.35 130.50 1p6s s TYR 38 Ca 0.06 -0.47 0.18 0.00 0.64 0.00 0.00 57.07 57.48 1p6s s TYR 38 Cb -0.15 -1.93 0.94 0.00 0.42 0.00 0.00 41.96 41.24 1p6s s TYR 38 CO 0.01 -0.14 1.89 0.87 0.64 0.00 0.00 175.55 178.82 1p6s h LYS 39 N 6.83 0.00 0.00 4.97 1.57 -1.93 0.21 116.57 128.21 1p6s h LYS 39 Ca -0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1p6s h LYS 39 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1p6s h LYS 39 CO 0.60 0.28 0.00 -1.91 -0.57 0.00 0.00 179.45 177.85 1p6s n GLU 40 N -3.86 0.00 -3.06 3.15 0.00 -1.26 -4.68 120.64 110.93 1p6s n GLU 40 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 57.16 56.75 1p6s n GLU 40 Cb 0.37 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 31.75 1p6s n GLU 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1p6s s ARG 41 N 1.43 4.46 0.54 5.31 0.52 -1.26 -4.47 118.95 125.47 1p6s s ARG 41 Ca 0.00 1.02 -0.19 0.00 -0.52 0.00 0.00 55.73 56.04 1p6s s ARG 41 Cb 0.00 -3.28 -0.06 0.00 0.52 0.00 0.00 34.95 32.13 1p6s s ARG 41 CO 0.00 0.52 1.10 -1.25 0.02 0.00 0.00 175.30 175.70 1p6s s PRO 42 N -0.89 3.39 0.26 3.54 0.04 -1.26 -4.95 135.00 135.13 1p6s s PRO 42 Ca 0.34 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.90 1p6s s PRO 42 Cb -0.22 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.30 1p6s s PRO 42 CO 0.24 -0.80 0.00 -1.91 0.04 0.00 0.00 177.00 174.57 1p6s n GLU 43 N -1.37 0.00 -1.11 4.56 2.13 -1.26 -5.09 120.64 118.50 1p6s n GLU 43 Ca 0.11 0.00 0.14 0.00 0.66 0.00 0.00 57.16 58.07 1p6s n GLU 43 Cb 0.51 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.16 1p6s n GLU 43 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1p6s n ALA 44 N -3.27 -2.91 -0.04 4.31 0.00 -1.26 -4.63 120.51 112.72 1p6s n ALA 44 Ca 0.00 0.60 -0.15 0.00 0.00 0.00 0.00 53.44 53.89 1p6s n ALA 44 Cb 0.00 -1.15 -0.08 0.00 0.00 0.00 0.00 19.45 18.22 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 -1.08 0.40 0.00 0.00 0.13 -2.02 -3.44 132.00 125.99 1p6s h PRO 45 Ca -0.10 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1p6s h PRO 45 Cb 1.05 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1p6s h PRO 45 CO 0.04 0.92 0.00 -0.25 -0.23 0.00 0.00 178.00 178.49 1p6s n ASP 46 N -4.39 0.43 -2.15 1.44 9.92 -1.26 -5.01 116.55 115.53 1p6s n ASP 46 Ca -0.08 0.14 -0.02 0.00 -0.53 0.00 0.00 54.79 54.30 1p6s n ASP 46 Cb 0.50 -0.08 0.07 0.00 -0.64 0.00 0.00 41.12 40.98 1p6s n ASP 46 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 1p6s n GLN 47 N -3.07 0.89 -2.91 -1.24 -0.06 -1.26 -5.01 117.38 104.73 1p6s n GLN 47 Ca 0.00 -0.93 -0.22 0.00 -2.00 0.00 0.00 57.00 53.85 1p6s n GLN 47 Cb 0.00 0.37 -0.02 0.00 -4.06 0.00 0.00 30.24 26.53 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 -1.01 1.73 -1.87 1.69 5.66 -1.26 -5.07 114.28 114.15 1p6s n THR 48 Ca -0.16 -4.88 -0.43 0.00 -3.05 0.00 0.00 64.05 55.54 1p6s n THR 48 Cb 0.77 -0.79 -0.03 0.00 -1.55 0.00 0.00 70.33 68.73 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 -3.13 3.90 0.19 1.09 0.05 -1.26 -4.82 118.68 114.70 1p6s s LEU 49 Ca 0.43 1.93 -0.30 0.00 0.05 0.00 0.00 54.13 56.25 1p6s s LEU 49 Cb 0.34 -3.53 -0.08 0.00 -2.05 0.00 0.00 46.19 40.88 1p6s s LEU 49 CO -0.11 -1.40 1.07 -2.16 -0.55 0.00 0.00 176.35 173.20 1p6s s PRO 50 N 5.08 4.64 -0.22 1.48 0.04 -1.26 -4.99 135.00 139.77 1p6s s PRO 50 Ca 0.83 1.68 -0.29 0.00 0.04 0.00 0.00 61.00 63.26 1p6s s PRO 50 Cb -0.31 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 30.94 1p6s s PRO 50 CO 0.34 0.16 1.35 -1.25 0.04 0.00 0.00 177.00 177.63 1p6s s PRO 51 N -0.59 4.05 0.06 0.56 0.04 -1.26 -4.94 135.00 132.91 1p6s s PRO 51 Ca 0.47 1.53 -0.34 0.00 0.04 0.00 0.00 61.00 62.71 1p6s s PRO 51 Cb -0.29 -3.86 -0.19 0.00 0.04 0.00 0.00 34.50 30.20 1p6s s PRO 51 CO 0.35 -0.96 1.55 1.25 0.04 0.00 0.00 177.00 179.24 1p6s h LEU 52 N 10.47 -0.87 -9.13 -3.56 6.46 -1.94 -3.42 115.31 113.32 1p6s h LEU 52 Ca -0.28 0.02 -0.67 0.00 -0.12 0.00 0.00 57.88 56.83 1p6s h LEU 52 Cb 1.11 0.22 -0.18 0.00 -0.73 0.00 0.00 40.66 41.09 1p6s h LEU 52 CO 1.00 -0.60 -0.66 0.21 -0.62 0.00 0.00 178.44 177.77 1p6s s ASN 53 N -4.31 4.92 -0.20 1.25 3.84 0.11 -4.99 114.94 115.56 1p6s s ASN 53 Ca -0.18 0.03 0.01 0.00 0.21 0.00 0.00 52.86 52.93 1p6s s ASN 53 Cb 0.03 -1.41 0.04 0.00 -0.55 0.00 0.00 41.25 39.35 1p6s s ASN 53 CO 0.60 0.33 -0.14 0.21 -2.79 0.00 0.00 177.10 175.31 1p6s s ASN 54 N -0.61 3.42 0.10 -4.21 2.47 -1.26 0.52 114.94 115.38 1p6s s ASN 54 Ca 0.10 -0.86 0.01 0.00 0.42 0.00 0.00 52.86 52.52 1p6s s ASN 54 Cb -0.12 -1.35 -0.04 0.00 -1.45 0.00 0.00 41.25 38.29 1p6s s ASN 54 CO 0.02 -0.10 0.25 -0.36 -3.72 0.00 0.00 177.10 173.19 1p6s s PHE 55 N 1.33 3.50 -0.05 0.43 0.08 0.23 -4.97 117.98 118.53 1p6s s PHE 55 Ca -0.00 0.20 0.06 0.00 0.12 0.00 0.00 56.93 57.31 1p6s s PHE 55 Cb -0.16 -1.73 -0.01 0.00 -0.57 0.00 0.00 43.02 40.56 1p6s s PHE 55 CO -0.09 0.55 -0.22 -1.12 -0.10 0.00 0.00 175.22 174.23 1p6s s SER 56 N -2.84 2.71 -0.39 1.36 0.01 -1.26 -0.85 113.70 112.43 1p6s s SER 56 Ca 0.35 -0.44 0.11 0.00 1.31 0.00 0.00 55.95 57.27 1p6s s SER 56 Cb -0.12 -0.67 0.35 0.00 0.21 0.00 0.00 66.02 65.79 1p6s s SER 56 CO 0.28 0.22 0.86 0.55 0.41 0.00 0.00 173.24 175.57 1p6s n VAL 57 N 2.94 -0.05 0.03 3.43 3.14 -0.13 -4.88 118.33 122.81 1p6s n VAL 57 Ca -0.17 -3.59 -0.22 0.00 -2.96 0.00 0.00 64.34 57.40 1p6s n VAL 57 Cb 0.52 0.30 -0.14 0.00 -1.06 0.00 0.00 33.84 33.46 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 2.98 0.32 0.00 1.55 0.00 -1.87 -3.40 119.26 118.85 1p6s h ALA 58 Ca 0.02 -1.29 -0.02 0.00 0.00 0.00 0.00 54.91 53.62 1p6s h ALA 58 Cb 1.03 0.59 -0.05 0.00 0.00 0.00 0.00 17.79 19.36 1p6s h ALA 58 CO 0.39 1.20 -0.37 -0.85 0.00 0.00 0.00 179.25 179.61 1p6s n GLU 59 N -3.52 0.98 -3.75 0.00 -0.00 -1.26 -4.80 120.64 108.30 1p6s n GLU 59 Ca -0.28 -2.45 -0.20 0.00 -0.00 0.00 0.00 57.16 54.22 1p6s n GLU 59 Cb 1.06 -1.17 -0.02 0.00 -0.00 0.00 0.00 31.44 31.32 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 -4.05 2.99 -0.11 0.00 -2.07 -1.25 -5.02 119.66 110.14 1p6s s GLN 61 Ca 0.39 -0.77 -0.02 0.00 -1.82 0.00 0.00 55.36 53.15 1p6s s GLN 61 Cb -0.09 -2.43 -0.03 0.00 -1.09 0.00 0.00 33.01 29.37 1p6s s GLN 61 CO 0.29 0.32 -0.05 -0.51 -1.32 0.00 0.00 175.29 174.03 1p6s s LEU 62 N 0.04 3.24 0.05 2.60 1.43 -1.26 -2.14 118.68 122.64 1p6s s LEU 62 Ca -0.07 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.00 1p6s s LEU 62 Cb -0.15 -1.75 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 1p6s s LEU 62 CO 0.05 0.26 -0.09 0.00 0.23 0.00 0.00 176.35 176.80 1p6s s MET 63 N -0.21 0.59 0.36 1.70 0.23 0.34 -4.98 119.30 117.33 1p6s s MET 63 Ca 0.04 -0.79 -0.04 0.00 -1.03 0.00 0.00 55.69 53.87 1p6s s MET 63 Cb -0.13 -0.40 -0.04 0.00 -1.53 0.00 0.00 34.83 32.73 1p6s s MET 63 CO 0.02 0.08 0.63 -1.59 -2.03 0.00 0.00 175.02 172.13 1p6s s LYS 64 N -1.59 3.58 0.31 3.16 -2.85 -1.26 -0.10 119.74 120.99 1p6s s LYS 64 Ca -0.08 0.00 -0.11 0.00 -1.00 0.00 0.00 55.97 54.78 1p6s s LYS 64 Cb -0.10 -2.56 0.01 0.00 -2.06 0.00 0.00 37.83 33.12 1p6s s LYS 64 CO 0.01 0.08 0.55 -0.08 0.10 0.00 0.00 175.35 176.01 1p6s s THR 65 N -2.33 0.00 -0.21 3.79 -1.32 0.16 -4.86 115.64 110.87 1p6s s THR 65 Ca 0.44 -1.36 0.14 0.00 -1.21 0.00 0.00 61.69 59.71 1p6s s THR 65 Cb -0.10 -2.45 0.31 0.00 -1.51 0.00 0.00 72.50 68.75 1p6s s THR 65 CO 0.35 0.00 1.22 -1.84 -2.21 0.00 0.00 174.62 172.14 1p6s n GLU 66 N -0.47 2.22 -4.85 7.08 0.28 -1.26 -0.88 120.64 122.76 1p6s n GLU 66 Ca -0.02 -2.42 -0.26 0.00 -0.16 0.00 0.00 57.16 54.30 1p6s n GLU 66 Cb 0.61 -1.49 -0.16 0.00 1.43 0.00 0.00 31.44 31.83 1p6s n GLU 66 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1p6s s ARG 67 N -2.35 1.68 0.15 3.44 3.52 -1.26 -3.56 118.95 120.57 1p6s s ARG 67 Ca 0.29 -0.62 -0.04 0.00 -0.13 0.00 0.00 55.73 55.22 1p6s s ARG 67 Cb 0.23 -1.51 -0.01 0.00 -1.56 0.00 0.00 34.95 32.11 1p6s s ARG 67 CO 0.06 0.29 1.39 -1.00 -0.81 0.00 0.00 175.30 175.23 1p6s h PRO 68 N 6.06 0.48 -6.26 5.12 0.13 -2.01 -3.48 132.00 132.05 1p6s h PRO 68 Ca -0.34 -0.41 -0.46 0.00 -0.87 0.00 0.00 66.00 63.92 1p6s h PRO 68 Cb 1.16 0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1p6s h PRO 68 CO 0.48 1.05 -0.40 1.03 -0.23 0.00 0.00 178.00 179.93 1p6s s ARG 69 N -3.58 3.10 0.77 0.86 0.52 -1.23 -5.10 118.95 114.29 1p6s s ARG 69 Ca -0.07 -1.01 -0.11 0.00 -0.52 0.00 0.00 55.73 54.03 1p6s s ARG 69 Cb 0.10 -2.75 0.06 0.00 0.52 0.00 0.00 34.95 32.88 1p6s s ARG 69 CO 0.86 0.18 1.09 -1.25 0.02 0.00 0.00 175.30 176.20 1p6s s PRO 70 N -4.06 2.24 -1.09 3.54 0.04 -1.24 -4.10 135.00 130.34 1p6s s PRO 70 Ca 0.41 1.19 -0.08 0.00 0.04 0.00 0.00 61.00 62.55 1p6s s PRO 70 Cb -0.09 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 1p6s s PRO 70 CO 0.29 -1.66 0.89 0.09 0.04 0.00 0.00 177.00 176.66 1p6s n ASN 71 N -3.50 -5.90 -4.45 6.66 3.02 -1.23 -4.85 115.26 105.01 1p6s n ASN 71 Ca 0.09 -0.77 -0.26 0.00 -0.03 0.00 0.00 54.58 53.61 1p6s n ASN 71 Cb 0.53 -4.83 -0.11 0.00 -0.61 0.00 0.00 39.78 34.76 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 -3.41 2.47 -0.05 3.41 2.01 -0.06 -3.11 115.64 116.91 1p6s s THR 72 Ca 0.42 -2.04 0.06 0.00 0.31 0.00 0.00 61.69 60.43 1p6s s THR 72 Cb -0.07 -2.21 -0.01 0.00 0.01 0.00 0.00 72.50 70.22 1p6s s THR 72 CO 0.76 -0.16 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.96 1p6s s PHE 73 N -1.79 2.13 -0.02 4.92 0.08 0.11 0.38 117.98 123.78 1p6s s PHE 73 Ca 0.23 -0.59 0.02 0.00 0.12 0.00 0.00 56.93 56.71 1p6s s PHE 73 Cb -0.08 -1.40 0.01 0.00 -0.57 0.00 0.00 43.02 40.98 1p6s s PHE 73 CO 0.11 -0.17 -0.06 0.08 -0.10 0.00 0.00 175.22 175.09 1p6s s VAL 74 N -0.17 0.54 -0.11 -0.44 1.01 0.86 -0.18 120.40 121.90 1p6s s VAL 74 Ca -0.01 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.77 1p6s s VAL 74 Cb -0.12 -0.50 -0.01 0.00 0.00 0.00 0.00 36.38 35.75 1p6s s VAL 74 CO 0.02 0.19 -0.18 -0.51 0.00 0.00 0.00 175.10 174.61 1p6s s ILE 75 N 0.32 2.57 -0.11 2.22 2.07 0.56 -0.50 121.20 128.32 1p6s s ILE 75 Ca -0.04 -0.84 0.00 0.00 -1.41 0.00 0.00 60.65 58.36 1p6s s ILE 75 Cb -0.08 -2.03 0.02 0.00 0.13 0.00 0.00 42.46 40.50 1p6s s ILE 75 CO -0.00 0.54 -0.10 -0.13 -1.91 0.00 0.00 174.94 173.35 1p6s s ARG 76 N 0.31 1.72 0.00 3.50 0.52 -0.91 -4.74 118.95 119.36 1p6s s ARG 76 Ca -0.14 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 54.73 1p6s s ARG 76 Cb -0.17 -1.68 0.00 0.00 0.52 0.00 0.00 34.95 33.62 1p6s s ARG 76 CO 0.07 -0.22 0.00 0.00 0.02 0.00 0.00 175.30 175.17 1p6s n LEU 78 N 0.00 0.86 0.00 0.00 -0.00 -1.26 -5.04 117.00 111.56 1p6s n LEU 78 Ca 0.00 0.24 0.00 0.00 -0.00 0.00 0.00 56.01 56.25 1p6s n LEU 78 Cb 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 43.42 43.11 1p6s n LEU 78 CO 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 177.39 177.08 1p6s n GLN 79 N -1.60 0.00 0.12 1.96 6.02 -1.26 -4.98 117.38 117.65 1p6s n GLN 79 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1p6s n GLN 79 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1p6s n GLN 79 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.06 177.92 1p6s n TRP 80 N -1.37 -3.57 -3.42 1.08 -0.00 -1.26 -5.06 117.44 103.84 1p6s n TRP 80 Ca 0.00 0.86 -0.28 0.00 -0.00 0.00 0.00 57.50 58.08 1p6s n TRP 80 Cb 0.00 2.35 -0.11 0.00 -0.00 0.00 0.00 31.31 33.55 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 0.25 -0.02 5.87 2.01 -1.26 -5.11 115.64 115.38 1p6s s THR 81 Ca 0.00 -2.25 -0.09 0.00 0.31 0.00 0.00 61.69 59.67 1p6s s THR 81 Cb 0.00 -1.19 0.01 0.00 0.01 0.00 0.00 72.50 71.33 1p6s s THR 81 CO 0.00 -1.13 0.18 0.42 -0.69 0.00 0.00 174.62 173.40 1p6s s THR 82 N 0.49 0.06 -0.45 -0.82 -4.23 -1.26 -5.12 115.64 104.32 1p6s s THR 82 Ca 0.27 -0.52 -0.08 0.00 -1.18 0.00 0.00 61.69 60.17 1p6s s THR 82 Cb -0.07 -0.44 0.11 0.00 1.34 0.00 0.00 72.50 73.43 1p6s s THR 82 CO -0.11 -0.29 0.30 -0.69 -0.54 0.00 0.00 174.62 173.29 1p6s s VAL 83 N -1.11 4.08 -0.20 2.29 1.01 -1.26 -5.04 120.40 120.17 1p6s s VAL 83 Ca -0.12 -1.72 -0.15 0.00 0.00 0.00 0.00 61.98 59.99 1p6s s VAL 83 Cb -0.06 -3.65 0.06 0.00 0.00 0.00 0.00 36.38 32.73 1p6s s VAL 83 CO 0.02 -0.69 0.51 -0.51 0.00 0.00 0.00 175.10 174.43 1p6s s ILE 84 N 1.35 -0.01 -0.02 2.22 2.07 -1.26 -5.14 121.20 120.41 1p6s s ILE 84 Ca 0.05 0.03 -0.30 0.00 -1.41 0.00 0.00 60.65 59.02 1p6s s ILE 84 Cb -0.25 -0.73 -0.03 0.00 0.13 0.00 0.00 42.46 41.58 1p6s s ILE 84 CO -0.01 0.01 1.02 -0.70 -1.91 0.00 0.00 174.94 173.36 1p6s s GLU 85 N 0.84 4.50 -0.26 3.50 2.56 -1.26 -4.94 118.70 123.64 1p6s s GLU 85 Ca -0.05 1.46 0.09 0.00 0.00 0.00 0.00 54.97 56.48 1p6s s GLU 85 Cb -0.05 -3.47 0.45 0.00 2.00 0.00 0.00 34.13 33.05 1p6s s GLU 85 CO -0.07 -0.16 1.28 2.89 -0.56 0.00 0.00 175.26 178.65 1p6s n ARG 86 N 4.24 2.10 -4.21 4.30 0.00 -1.26 -5.02 116.66 116.82 1p6s n ARG 86 Ca 0.07 -3.47 -0.16 0.00 -0.00 0.00 0.00 57.85 54.28 1p6s n ARG 86 Cb 0.50 -1.82 -0.13 0.00 -0.00 0.00 0.00 32.46 31.00 1p6s n ARG 86 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 1p6s s THR 87 N -3.58 0.64 0.02 8.89 -1.32 -1.26 -0.32 115.64 118.71 1p6s s THR 87 Ca 0.43 -0.64 -0.13 0.00 -1.21 0.00 0.00 61.69 60.14 1p6s s THR 87 Cb 0.39 -0.60 0.02 0.00 -1.51 0.00 0.00 72.50 70.80 1p6s s THR 87 CO -0.03 -0.02 0.27 0.72 -2.21 0.00 0.00 174.62 173.34 1p6s s PHE 88 N -0.63 -0.09 0.11 9.09 -0.12 0.74 -4.59 117.98 122.50 1p6s s PHE 88 Ca -0.01 0.02 0.04 0.00 -0.05 0.00 0.00 56.93 56.93 1p6s s PHE 88 Cb -0.06 0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.35 1p6s s PHE 88 CO 0.00 -0.42 0.08 -1.01 -0.05 0.00 0.00 175.22 173.82 1p6s s HIS 89 N -1.97 3.13 0.14 3.49 3.76 0.20 0.08 115.29 124.12 1p6s s HIS 89 Ca -0.09 0.02 0.01 0.00 -0.15 0.00 0.00 55.06 54.85 1p6s s HIS 89 Cb -0.03 -1.57 -0.04 0.00 1.11 0.00 0.00 32.58 32.05 1p6s s HIS 89 CO -0.00 0.51 0.30 0.14 -0.85 0.00 0.00 174.74 174.84 1p6s s VAL 90 N -1.50 5.30 -0.08 -0.90 -7.23 -1.18 0.30 120.40 115.11 1p6s s VAL 90 Ca 0.29 -0.50 0.18 0.00 -1.81 0.00 0.00 61.98 60.15 1p6s s VAL 90 Cb -0.11 -3.71 0.14 0.00 0.56 0.00 0.00 36.38 33.26 1p6s s VAL 90 CO 0.22 -0.05 1.58 -0.78 -0.31 0.00 0.00 175.10 175.77 1p6s h ASP 91 N 2.38 0.00 -5.26 4.85 3.58 -1.93 -3.46 116.42 116.58 1p6s h ASP 91 Ca -0.47 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 56.86 1p6s h ASP 91 Cb 1.18 0.00 -0.14 0.00 1.72 0.00 0.00 39.33 42.09 1p6s h ASP 91 CO 0.70 0.38 -0.49 -0.94 -2.88 0.00 0.00 179.24 176.02 1p6s s SER 92 N -6.37 0.22 0.16 2.28 1.04 -1.26 -5.04 113.70 104.74 1p6s s SER 92 Ca 0.03 -0.90 -0.10 0.00 0.48 0.00 0.00 55.95 55.46 1p6s s SER 92 Cb 0.08 0.32 0.03 0.00 0.10 0.00 0.00 66.02 66.55 1p6s s SER 92 CO 0.71 -0.74 1.58 1.55 0.98 0.00 0.00 173.24 177.32 1p6s h PRO 93 N 2.82 1.01 -0.34 4.02 0.13 -1.98 -2.59 132.00 135.06 1p6s h PRO 93 Ca -0.34 -0.38 -0.03 0.00 -0.87 0.00 0.00 66.00 64.38 1p6s h PRO 93 Cb 1.19 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 1p6s h PRO 93 CO 0.57 1.06 0.06 0.22 -0.23 0.00 0.00 178.00 179.68 1p6s h ASP 94 N 0.88 0.45 -0.19 1.44 3.58 -2.00 -2.35 116.42 118.24 1p6s h ASP 94 Ca 0.14 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 1p6s h ASP 94 Cb 0.68 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.61 1p6s h ASP 94 CO 0.05 0.48 0.02 -0.08 -2.88 0.00 0.00 179.24 176.83 1p6s h GLU 95 N 0.48 0.32 -0.96 0.28 4.57 -1.89 -2.04 114.58 115.35 1p6s h GLU 95 Ca 0.11 -0.09 0.07 0.00 -1.18 0.00 0.00 59.36 58.27 1p6s h GLU 95 Cb 0.22 -0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.71 1p6s h GLU 95 CO -0.00 0.50 0.62 -0.09 -1.18 0.00 0.00 179.01 178.85 1p6s h ARG 96 N 0.11 1.04 -0.17 1.92 1.12 -1.10 -0.63 114.38 116.67 1p6s h ARG 96 Ca 0.06 -0.06 -0.11 0.00 -1.11 0.00 0.00 59.98 58.76 1p6s h ARG 96 Cb 0.33 -0.24 -0.01 0.00 -0.01 0.00 0.00 29.97 30.05 1p6s h ARG 96 CO 0.01 0.69 -0.36 1.49 -3.11 0.00 0.00 179.97 178.69 1p6s h GLU 97 N 1.08 0.37 -0.19 0.20 4.57 -1.20 -2.52 114.58 116.88 1p6s h GLU 97 Ca 0.42 -0.17 -0.17 0.00 -1.18 0.00 0.00 59.36 58.27 1p6s h GLU 97 Cb 0.24 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1p6s h GLU 97 CO -0.17 0.68 -0.55 0.93 -1.18 0.00 0.00 179.01 178.72 1p6s h GLU 98 N 0.31 0.70 -0.45 1.92 5.08 -0.51 -2.49 114.58 119.15 1p6s h GLU 98 Ca 0.03 -0.50 0.01 0.00 -1.00 0.00 0.00 59.36 57.90 1p6s h GLU 98 Cb 0.79 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1p6s h GLU 98 CO 0.06 1.12 0.29 -1.49 -1.00 0.00 0.00 179.01 178.00 1p6s h TRP 99 N 0.40 0.55 -0.13 4.33 -0.00 -1.08 0.10 115.95 120.12 1p6s h TRP 99 Ca -0.02 0.01 -0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1p6s h TRP 99 Cb 1.17 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 30.14 1p6s h TRP 99 CO 0.09 0.34 0.08 1.98 -0.00 0.00 0.00 178.44 180.93 1p6s h MET 100 N 0.59 0.18 -0.79 0.49 4.05 -1.45 -0.12 114.93 117.88 1p6s h MET 100 Ca 0.17 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.54 1p6s h MET 100 Cb -0.05 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 30.68 1p6s h MET 100 CO -0.05 0.16 0.37 -0.09 0.23 0.00 0.00 176.91 177.53 1p6s h ARG 101 N 0.15 1.15 -0.64 0.39 9.65 -1.17 -2.30 114.38 121.60 1p6s h ARG 101 Ca 0.05 -0.18 -0.05 0.00 -1.10 0.00 0.00 59.98 58.70 1p6s h ARG 101 Cb 0.03 -0.20 -0.03 0.00 -1.39 0.00 0.00 29.97 28.38 1p6s h ARG 101 CO -0.01 0.89 0.21 0.00 2.80 0.00 0.00 179.97 183.86 1p6s h ALA 102 N 1.19 0.83 -0.53 2.80 0.00 -0.48 -1.44 119.26 121.63 1p6s h ALA 102 Ca 0.27 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1p6s h ALA 102 Cb 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1p6s h ALA 102 CO -0.03 0.50 0.31 0.82 0.00 0.00 0.00 179.25 180.85 1p6s h ILE 103 N 0.91 1.16 -0.41 0.00 2.04 -0.69 -2.34 117.51 118.18 1p6s h ILE 103 Ca 0.21 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.58 1p6s h ILE 103 Cb 0.28 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1p6s h ILE 103 CO -0.01 0.17 -0.16 1.56 0.00 0.00 0.00 178.15 179.71 1p6s h GLN 104 N 0.71 0.77 -0.47 2.37 1.08 -1.22 -1.69 115.11 116.66 1p6s h GLN 104 Ca 0.19 -0.28 -0.01 0.00 -1.45 0.00 0.00 58.65 57.10 1p6s h GLN 104 Cb 0.00 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 1p6s h GLN 104 CO -0.03 0.88 0.27 1.98 -0.95 0.00 0.00 178.83 180.97 1p6s h MET 105 N 0.68 0.65 -0.39 1.46 4.05 -0.92 -1.60 114.93 118.85 1p6s h MET 105 Ca 0.11 -0.07 -0.14 0.00 -0.28 0.00 0.00 59.70 59.32 1p6s h MET 105 Cb 0.65 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.31 1p6s h MET 105 CO 0.05 0.50 -0.30 0.28 0.23 0.00 0.00 176.91 177.67 1p6s h VAL 106 N 0.62 1.27 -0.31 -5.77 2.07 -1.33 -2.95 116.25 109.85 1p6s h VAL 106 Ca 0.17 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.22 1p6s h VAL 106 Cb 0.03 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1p6s h VAL 106 CO -0.03 0.49 0.13 0.00 0.02 0.00 0.00 177.57 178.18 1p6s h ALA 107 N 0.94 1.65 -0.72 1.67 0.00 -0.96 0.57 119.26 122.40 1p6s h ALA 107 Ca 0.08 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1p6s h ALA 107 Cb 0.85 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 1p6s h ALA 107 CO 0.07 0.29 0.43 -0.91 0.00 0.00 0.00 179.25 179.13 1p6s h ASN 108 N 0.44 0.65 1.06 0.00 2.35 -1.12 -0.33 115.58 118.63 1p6s h ASN 108 Ca 0.11 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1p6s h ASN 108 Cb 0.08 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 1p6s h ASN 108 CO -0.01 0.42 -0.95 0.28 -1.65 0.00 0.00 177.43 175.52 1p6s h SER 109 N 0.79 0.00 -0.05 5.81 0.02 -1.55 -3.36 113.55 115.21 1p6s h SER 109 Ca 0.32 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.21 1p6s h SER 109 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1p6s h SER 109 CO -0.17 0.03 -0.20 -0.07 -1.14 0.00 0.00 176.83 175.29 1p6s h LEU 110 N 0.00 0.26 0.00 5.07 4.07 -0.29 -3.52 115.31 120.90 1p6s h LEU 110 Ca -0.01 -0.64 0.00 0.00 0.08 0.00 0.00 57.88 57.31 1p6s h LEU 110 Cb 1.03 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.70 1p6s h LEU 110 CO 0.00 0.85 0.00 2.29 -1.08 0.00 0.00 178.44 180.50