#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lwt s PHE 2 N 0.00 2.60 0.49 0.00 0.40 0.61 -2.71 117.98 119.36 1lwt s PHE 2 Ca 0.00 -0.23 -0.22 0.00 -0.60 0.00 0.00 56.93 55.88 1lwt s PHE 2 Cb 0.00 -1.40 -0.07 0.00 0.51 0.00 0.00 43.02 42.07 1lwt s PHE 2 CO 0.00 0.37 1.22 0.00 0.70 0.00 0.00 175.22 177.50 1lwt s ALA 3 N -1.11 2.91 -0.04 5.36 0.00 0.10 0.13 121.76 129.11 1lwt s ALA 3 Ca 0.18 1.04 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 1lwt s ALA 3 Cb -0.11 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 1lwt s ALA 3 CO 0.10 -0.87 1.78 0.21 0.00 0.00 0.00 175.76 176.98 1lwt s LYS 4 N -2.79 4.11 0.00 0.00 2.20 -1.26 -3.00 119.74 119.00 1lwt s LYS 4 Ca 0.66 2.30 0.00 0.00 -0.36 0.00 0.00 55.97 58.57 1lwt s LYS 4 Cb -0.32 -4.06 0.00 0.00 -1.51 0.00 0.00 37.83 31.94 1lwt s LYS 4 CO 0.38 -0.95 0.00 0.41 -0.36 0.00 0.00 175.35 174.83 1lwt n GLY 5 N 4.36 4.66 3.46 5.54 0.00 -1.26 -5.09 105.19 116.86 1lwt n GLY 5 Ca 0.19 -0.79 -0.58 0.00 0.00 0.00 0.00 46.02 44.83 1lwt n GLY 5 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1lwt n THR 6 N 0.00 0.11 -2.96 2.61 -1.04 -1.16 -4.71 114.28 107.12 1lwt n THR 6 Ca 0.00 -0.08 -0.40 0.00 -2.04 0.00 0.00 64.05 61.53 1lwt n THR 6 Cb 0.00 -0.93 -0.05 0.00 -1.82 0.00 0.00 70.33 67.52 1lwt n THR 6 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1lwt s ASN 7 N 5.42 7.31 0.11 8.00 0.01 -1.26 -2.29 114.94 132.24 1lwt s ASN 7 Ca 1.11 1.55 0.05 0.00 -0.71 0.00 0.00 52.86 54.86 1lwt s ASN 7 Cb -1.25 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 37.88 1lwt s ASN 7 CO 0.64 0.09 0.04 -0.69 -1.51 0.00 0.00 177.10 175.67 1lwt s VAL 8 N -0.49 4.19 0.45 1.60 1.01 -0.50 -2.06 120.40 124.60 1lwt s VAL 8 Ca 0.38 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1lwt s VAL 8 Cb -0.22 -3.04 0.09 0.00 0.00 0.00 0.00 36.38 33.21 1lwt s VAL 8 CO 0.25 0.05 0.62 -0.11 0.00 0.00 0.00 175.10 175.91 1lwt n LEU 9 N 0.28 0.00 -0.05 3.92 7.94 -1.12 -2.49 117.00 125.49 1lwt n LEU 9 Ca -0.10 -1.38 -0.10 0.00 -1.11 0.00 0.00 56.01 53.32 1lwt n LEU 9 Cb 0.53 -0.39 -0.15 0.00 0.53 0.00 0.00 43.42 43.94 1lwt n LEU 9 CO 0.41 -0.79 -0.76 0.00 -1.11 0.00 0.00 177.39 175.14 1lwt n ALA 11 N -2.89 1.45 1.94 1.96 0.00 0.55 -4.62 120.51 118.89 1lwt n ALA 11 Ca -0.10 -0.93 0.09 0.00 0.00 0.00 0.00 53.44 52.49 1lwt n ALA 11 Cb 0.38 -0.61 0.53 0.00 0.00 0.00 0.00 19.45 19.74 1lwt n ALA 11 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1lwt n ASP 12 N -3.00 0.00 0.00 0.00 5.75 -1.26 -4.86 116.55 113.18 1lwt n ASP 12 Ca -0.24 -1.38 0.00 0.00 -0.01 0.00 0.00 54.79 53.16 1lwt n ASP 12 Cb 1.08 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.17 1lwt n ASP 12 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1lwt n GLY 13 N 0.74 0.78 2.39 6.12 0.00 -1.26 -5.01 105.19 108.94 1lwt n GLY 13 Ca 0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 1lwt n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1lwt n SER 14 N -0.03 -0.51 -3.96 1.61 3.41 -1.26 -4.95 113.62 107.94 1lwt n SER 14 Ca 0.00 -1.18 -0.26 0.00 -0.26 0.00 0.00 58.87 57.17 1lwt n SER 14 Cb 0.01 -0.65 -0.17 0.00 -0.26 0.00 0.00 64.21 63.15 1lwt n SER 14 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1lwt s ILE 15 N -2.66 1.07 0.00 -1.33 1.01 -1.26 -4.57 121.20 113.46 1lwt s ILE 15 Ca 0.47 -0.38 0.08 0.00 0.00 0.00 0.00 60.65 60.82 1lwt s ILE 15 Cb -0.02 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.39 1lwt s ILE 15 CO 0.34 0.36 -0.24 -0.70 0.00 0.00 0.00 174.94 174.70 1lwt s GLU 16 N 1.20 1.85 0.29 2.79 2.12 -1.04 -4.95 118.70 120.96 1lwt s GLU 16 Ca -0.04 -0.92 -0.29 0.00 0.36 0.00 0.00 54.97 54.07 1lwt s GLU 16 Cb -0.14 -1.86 -0.10 0.00 0.26 0.00 0.00 34.13 32.29 1lwt s GLU 16 CO -0.03 0.50 1.20 0.00 -0.54 0.00 0.00 175.26 176.39 1lwt h ILE 18 N 3.12 0.55 0.00 0.00 6.09 -1.74 -0.79 117.51 124.74 1lwt h ILE 18 Ca -0.47 -0.09 -0.00 0.00 -1.37 0.00 0.00 64.86 62.92 1lwt h ILE 18 Cb 1.22 0.25 -0.00 0.00 0.47 0.00 0.00 36.82 38.75 1lwt h ILE 18 CO 0.67 0.05 -0.02 -0.33 -3.07 0.00 0.00 178.15 175.45 1lwt h GLU 19 N 0.27 0.00 -0.02 2.19 3.07 -1.91 -2.50 114.58 115.69 1lwt h GLU 19 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1lwt h GLU 19 Cb 0.65 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1lwt h GLU 19 CO -0.48 0.02 -0.22 0.09 -1.40 0.00 0.00 179.01 177.02 1lwt n ASN 20 N -3.29 2.42 -4.67 1.42 3.02 -0.32 -4.91 115.26 108.91 1lwt n ASN 20 Ca -0.02 -1.71 -0.43 0.00 -0.03 0.00 0.00 54.58 52.39 1lwt n ASN 20 Cb 0.14 0.24 -0.02 0.00 -0.61 0.00 0.00 39.78 39.52 1lwt n ASN 20 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1lwt s ILE 21 N -2.11 4.42 0.67 2.41 1.01 -0.94 -4.96 121.20 121.69 1lwt s ILE 21 Ca 0.22 1.72 0.03 0.00 0.00 0.00 0.00 60.65 62.61 1lwt s ILE 21 Cb 0.18 -4.11 0.13 0.00 0.01 0.00 0.00 42.46 38.67 1lwt s ILE 21 CO 0.41 -0.09 0.92 -0.62 0.00 0.00 0.00 174.94 175.56 1lwt n GLU 22 N 5.92 0.11 -2.96 2.79 1.02 -1.26 -5.02 120.64 121.25 1lwt n GLU 22 Ca 0.12 -2.75 -0.40 0.00 -0.02 0.00 0.00 57.16 54.10 1lwt n GLU 22 Cb 0.46 -0.53 -0.04 0.00 -0.02 0.00 0.00 31.44 31.31 1lwt n GLU 22 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1lwt s VAL 23 N -2.85 4.99 0.00 2.62 1.01 -1.26 -3.70 120.40 121.21 1lwt s VAL 23 Ca 0.63 1.59 0.00 0.00 0.00 0.00 0.00 61.98 64.20 1lwt s VAL 23 Cb -0.04 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.23 1lwt s VAL 23 CO 0.41 0.20 0.00 0.61 0.00 0.00 0.00 175.10 176.32 1lwt n GLY 24 N 3.13 1.67 3.83 4.51 0.00 -1.04 -5.02 105.19 112.27 1lwt n GLY 24 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1lwt n GLY 24 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lwt s ASN 25 N -1.77 4.49 -0.23 1.61 0.01 -1.24 -4.79 114.94 113.01 1lwt s ASN 25 Ca 0.00 1.10 0.01 0.00 -0.71 0.00 0.00 52.86 53.26 1lwt s ASN 25 Cb 0.00 -1.77 0.06 0.00 0.41 0.00 0.00 41.25 39.94 1lwt s ASN 25 CO 0.00 -1.95 -0.08 -0.54 -1.51 0.00 0.00 177.10 173.02 1lwt s LYS 26 N -5.30 1.87 0.00 -0.60 -0.14 -1.26 -2.70 119.74 111.61 1lwt s LYS 26 Ca 0.61 -1.04 0.00 0.00 -1.36 0.00 0.00 55.97 54.18 1lwt s LYS 26 Cb -0.13 -2.62 0.00 0.00 -1.68 0.00 0.00 37.83 33.40 1lwt s LYS 26 CO 0.53 -0.55 0.00 1.33 -0.76 0.00 0.00 175.35 175.90 1lwt n VAL 27 N 4.62 0.00 -3.70 3.17 0.24 -0.37 0.21 118.33 122.48 1lwt n VAL 27 Ca -0.13 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.04 1lwt n VAL 27 Cb 0.44 -0.10 -0.07 0.00 -1.47 0.00 0.00 33.84 32.64 1lwt n VAL 27 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1lwt s GLY 29 N 0.00 -0.23 0.63 7.63 0.00 0.33 -0.51 107.32 115.17 1lwt s GLY 29 Ca 0.00 0.31 0.35 0.00 0.00 0.00 0.00 44.72 45.39 1lwt s GLY 29 CO 0.00 0.07 2.21 0.07 0.00 0.00 0.00 173.10 175.45 1lwt h LYS 30 N 3.30 0.00 -0.02 2.90 2.10 -1.83 0.30 116.57 123.32 1lwt h LYS 30 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 1lwt h LYS 30 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1lwt h LYS 30 CO 0.43 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.48 1lwt n ASP 31 N -3.37 0.48 0.00 7.07 5.68 -1.26 -4.81 116.55 120.33 1lwt n ASP 31 Ca -0.02 -1.25 0.00 0.00 -0.50 0.00 0.00 54.79 53.02 1lwt n ASP 31 Cb 0.19 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.16 1lwt n ASP 31 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lwt n GLY 32 N 1.01 2.77 3.88 6.12 0.00 0.11 -4.83 105.19 114.25 1lwt n GLY 32 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1lwt n GLY 32 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1lwt s ARG 33 N -0.53 3.71 0.45 1.61 3.52 -1.26 -4.49 118.95 121.96 1lwt s ARG 33 Ca 0.00 0.46 -0.24 0.00 -0.13 0.00 0.00 55.73 55.82 1lwt s ARG 33 Cb 0.00 -2.34 -0.07 0.00 -1.56 0.00 0.00 34.95 30.98 1lwt s ARG 33 CO 0.00 -0.15 1.25 -1.25 -0.81 0.00 0.00 175.30 174.34 1lwt s PRO 34 N -4.23 3.75 -0.31 5.12 0.04 -1.26 -0.51 135.00 137.59 1lwt s PRO 34 Ca 0.51 2.01 0.02 0.00 0.04 0.00 0.00 61.00 63.58 1lwt s PRO 34 Cb -0.10 -2.54 0.09 0.00 0.04 0.00 0.00 34.50 31.99 1lwt s PRO 34 CO 0.37 -0.63 0.04 1.03 0.04 0.00 0.00 177.00 177.86 1lwt s ARG 35 N -2.52 1.29 0.66 4.56 1.81 0.33 -4.77 118.95 120.30 1lwt s ARG 35 Ca 0.62 -1.46 -0.17 0.00 -1.72 0.00 0.00 55.73 53.00 1lwt s ARG 35 Cb -0.34 -2.71 -0.00 0.00 -0.45 0.00 0.00 34.95 31.44 1lwt s ARG 35 CO 0.43 -0.89 1.23 -2.00 -0.68 0.00 0.00 175.30 173.40 1lwt s GLU 36 N 1.21 2.56 -0.05 3.54 2.12 -1.26 -1.24 118.70 125.58 1lwt s GLU 36 Ca 0.07 1.88 -0.00 0.00 0.36 0.00 0.00 54.97 57.28 1lwt s GLU 36 Cb -0.18 -1.87 -0.03 0.00 0.26 0.00 0.00 34.13 32.30 1lwt s GLU 36 CO -0.13 -1.54 -0.00 0.08 -0.54 0.00 0.00 175.26 173.12 1lwt s VAL 37 N -1.67 4.21 0.00 3.70 1.01 -1.10 -3.18 120.40 123.38 1lwt s VAL 37 Ca 0.78 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.34 1lwt s VAL 37 Cb -0.32 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1lwt s VAL 37 CO 0.39 0.50 0.09 2.30 0.00 0.00 0.00 175.10 178.38 1lwt n ILE 38 N 1.80 0.00 -3.70 2.22 -5.35 0.17 -2.50 119.36 111.99 1lwt n ILE 38 Ca -0.17 -0.15 -0.13 0.00 -0.27 0.00 0.00 62.75 62.04 1lwt n ILE 38 Cb 0.53 1.42 -0.09 0.00 -1.74 0.00 0.00 39.64 39.76 1lwt n ILE 38 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1lwt s LYS 39 N -0.12 0.55 -0.69 6.28 1.02 -1.16 -4.97 119.74 120.66 1lwt s LYS 39 Ca 0.00 0.72 0.02 0.00 0.02 0.00 0.00 55.97 56.73 1lwt s LYS 39 Cb 0.00 0.23 0.37 0.00 -0.52 0.00 0.00 37.83 37.91 1lwt s LYS 39 CO 0.00 -0.08 1.49 1.28 -0.92 0.00 0.00 175.35 177.12 1lwt n LEU 40 N 3.07 6.01 -4.63 3.17 4.77 -1.26 0.51 117.00 128.64 1lwt n LEU 40 Ca -0.15 -5.21 -0.61 0.00 -0.03 0.00 0.00 56.01 50.01 1lwt n LEU 40 Cb 0.57 -0.79 -0.09 0.00 -2.33 0.00 0.00 43.42 40.78 1lwt n LEU 40 CO 0.10 2.08 1.37 -2.65 -1.33 0.00 0.00 177.39 176.95 1lwt n PRO 41 N -0.39 0.53 -4.70 3.23 -0.02 -1.02 -4.62 135.00 128.02 1lwt n PRO 41 Ca 0.44 0.19 -0.31 0.00 -2.02 0.00 0.00 63.50 61.79 1lwt n PRO 41 Cb 0.41 -1.82 -0.09 0.00 -0.02 0.00 0.00 33.50 31.99 1lwt n PRO 41 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1lwt s ARG 42 N 3.97 2.12 0.00 -0.52 0.52 -1.26 -0.43 118.95 123.35 1lwt s ARG 42 Ca 1.05 -2.30 0.00 0.00 -0.52 0.00 0.00 55.73 53.96 1lwt s ARG 42 Cb -1.28 -1.58 0.00 0.00 0.52 0.00 0.00 34.95 32.61 1lwt s ARG 42 CO 0.71 -0.27 0.00 0.41 0.02 0.00 0.00 175.30 176.17 1lwt n GLY 43 N -1.18 -0.25 3.11 -3.53 0.00 -0.90 -4.95 105.19 97.49 1lwt n GLY 43 Ca -0.14 -1.54 -0.20 0.00 0.00 0.00 0.00 46.02 44.14 1lwt n GLY 43 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1lwt s ARG 44 N -2.00 0.90 0.01 1.61 3.52 -1.26 0.19 118.95 121.91 1lwt s ARG 44 Ca 0.00 -0.64 -0.01 0.00 -0.13 0.00 0.00 55.73 54.96 1lwt s ARG 44 Cb 0.00 -0.88 0.00 0.00 -1.56 0.00 0.00 34.95 32.52 1lwt s ARG 44 CO 0.00 0.22 0.03 0.39 -0.81 0.00 0.00 175.30 175.13 1lwt n GLU 45 N 2.18 0.02 -1.57 5.12 1.02 -0.97 -4.92 120.64 121.51 1lwt n GLU 45 Ca -0.17 -0.04 -0.12 0.00 -0.02 0.00 0.00 57.16 56.81 1lwt n GLU 45 Cb 0.55 0.05 0.07 0.00 -0.02 0.00 0.00 31.44 32.09 1lwt n GLU 45 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1lwt n THR 46 N -0.02 0.00 -3.59 2.62 -1.04 -1.26 0.51 114.28 111.50 1lwt n THR 46 Ca -0.00 -0.79 -0.11 0.00 -2.04 0.00 0.00 64.05 61.11 1lwt n THR 46 Cb 0.01 -1.18 -0.06 0.00 -1.82 0.00 0.00 70.33 67.29 1lwt n THR 46 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1lwt s TYR 48 N -1.57 -0.41 -0.10 -1.42 1.51 0.63 0.70 117.35 116.69 1lwt s TYR 48 Ca 0.35 0.80 -0.03 0.00 -1.01 0.00 0.00 57.07 57.18 1lwt s TYR 48 Cb -0.02 0.42 -0.03 0.00 -0.11 0.00 0.00 41.96 42.22 1lwt s TYR 48 CO 0.23 -0.33 0.01 0.45 -1.11 0.00 0.00 175.55 174.81 1lwt s SER 49 N -0.77 5.33 0.20 2.29 0.15 0.25 -0.94 113.70 120.21 1lwt s SER 49 Ca -0.01 0.15 0.10 0.00 0.70 0.00 0.00 55.95 56.89 1lwt s SER 49 Cb -0.02 -1.58 -0.04 0.00 -1.71 0.00 0.00 66.02 62.67 1lwt s SER 49 CO 0.00 0.35 -0.16 -0.69 1.20 0.00 0.00 173.24 173.95 1lwt s VAL 50 N -0.73 2.82 -0.30 4.45 1.01 0.87 -1.22 120.40 127.29 1lwt s VAL 50 Ca 0.12 -1.87 -0.17 0.00 0.00 0.00 0.00 61.98 60.06 1lwt s VAL 50 Cb -0.12 -2.39 0.18 0.00 0.00 0.00 0.00 36.38 34.05 1lwt s VAL 50 CO 0.02 -0.14 1.14 0.54 0.00 0.00 0.00 175.10 176.66 1lwt s VAL 51 N -1.77 -0.28 0.88 2.92 0.11 -1.14 -3.29 120.40 117.84 1lwt s VAL 51 Ca 0.24 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.16 1lwt s VAL 51 Cb -0.08 -1.00 0.06 0.00 -1.53 0.00 0.00 36.38 33.83 1lwt s VAL 51 CO 0.13 0.00 0.76 1.67 -3.33 0.00 0.00 175.10 174.33 1lwt n GLN 52 N 4.76 -0.14 -3.56 1.54 7.27 -0.65 0.00 117.38 126.61 1lwt n GLN 52 Ca -0.08 0.02 -0.21 0.00 0.07 0.00 0.00 57.00 56.80 1lwt n GLN 52 Cb 0.54 -2.10 -0.03 0.00 2.41 0.00 0.00 30.24 31.07 1lwt n GLN 52 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1lwt s LYS 53 N -3.83 2.53 0.00 3.69 1.02 0.38 -4.71 119.74 118.82 1lwt s LYS 53 Ca 0.64 -1.55 0.00 0.00 0.02 0.00 0.00 55.97 55.08 1lwt s LYS 53 Cb -0.25 -2.38 0.00 0.00 -0.52 0.00 0.00 37.83 34.68 1lwt s LYS 53 CO 0.60 -0.21 0.00 -1.13 -0.92 0.00 0.00 175.35 173.69 1lwt n SER 54 N -1.57 0.00 0.00 2.83 3.41 -1.26 -4.77 113.62 112.26 1lwt n SER 54 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1lwt n SER 54 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1lwt n SER 54 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lwt n GLN 55 N -0.11 0.00 -1.49 4.33 3.00 -1.26 -4.77 117.38 117.08 1lwt n GLN 55 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 1lwt n GLN 55 Cb 0.00 -1.36 0.09 0.00 0.00 0.00 0.00 30.24 28.97 1lwt n GLN 55 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 1lwt s HIS 56 N -1.88 2.05 0.00 1.08 3.76 -1.26 -4.97 115.29 114.06 1lwt s HIS 56 Ca 0.00 1.58 0.00 0.00 -0.15 0.00 0.00 55.06 56.49 1lwt s HIS 56 Cb 0.00 -3.52 0.00 0.00 1.11 0.00 0.00 32.58 30.17 1lwt s HIS 56 CO 0.00 -2.68 0.00 2.89 -0.85 0.00 0.00 174.74 174.10 1lwt n ARG 57 N -2.56 0.00 0.00 1.40 1.85 -1.26 -5.05 116.66 111.05 1lwt n ARG 57 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 1lwt n ARG 57 Cb 0.50 -0.13 0.00 0.00 -1.05 0.00 0.00 32.46 31.78 1lwt n ARG 57 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1lwt n ALA 58 N -0.65 0.00 -3.33 2.89 0.00 -1.26 -4.85 120.51 113.31 1lwt n ALA 58 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1lwt n ALA 58 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1lwt n ALA 58 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1lwt s HIS 59 N 0.00 0.25 0.00 0.00 -3.43 -1.26 -4.57 115.29 106.28 1lwt s HIS 59 Ca 0.00 -0.64 0.00 0.00 -0.80 0.00 0.00 55.06 53.62 1lwt s HIS 59 Cb 0.00 0.31 0.00 0.00 -1.43 0.00 0.00 32.58 31.46 1lwt s HIS 59 CO 0.00 -1.06 0.00 1.63 -2.00 0.00 0.00 174.74 173.31 1lwt n LYS 60 N -0.40 0.00 0.00 -0.38 4.01 -1.26 -5.28 118.16 114.85 1lwt n LYS 60 Ca -0.02 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.78 1lwt n LYS 60 Cb 0.61 -0.86 0.00 0.00 -0.51 0.00 0.00 35.03 34.27 1lwt n LYS 60 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1lwt n SER 63 N 0.49 0.00 -0.65 4.39 3.41 -1.26 -5.34 113.62 114.66 1lwt n SER 63 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1lwt n SER 63 Cb 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1lwt n SER 63 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1lwt n SER 64 N 0.00 1.23 -4.35 4.04 2.88 -1.26 -4.78 113.62 111.38 1lwt n SER 64 Ca 0.00 -1.56 -0.58 0.00 -1.33 0.00 0.00 58.87 55.40 1lwt n SER 64 Cb 0.00 -0.39 -0.10 0.00 -0.75 0.00 0.00 64.21 62.97 1lwt n SER 64 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1lwt n ARG 65 N 0.26 0.31 -0.85 -1.46 1.74 -1.26 -4.55 116.66 110.84 1lwt n ARG 65 Ca 0.00 0.09 -0.28 0.00 -0.77 0.00 0.00 57.85 56.88 1lwt n ARG 65 Cb 0.25 -1.76 -0.01 0.00 -1.02 0.00 0.00 32.46 29.92 1lwt n ARG 65 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1lwt n GLU 66 N 7.34 0.00 -2.77 5.56 0.28 -1.26 -4.87 120.64 124.92 1lwt n GLU 66 Ca 0.49 0.00 -0.40 0.00 -0.16 0.00 0.00 57.16 57.09 1lwt n GLU 66 Cb 0.03 -0.63 -0.05 0.00 1.43 0.00 0.00 31.44 32.22 1lwt n GLU 66 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 1lwt s VAL 67 N -0.84 4.28 1.03 3.84 -7.23 -1.26 -5.02 120.40 115.20 1lwt s VAL 67 Ca 0.39 2.03 -0.22 0.00 -1.81 0.00 0.00 61.98 62.37 1lwt s VAL 67 Cb -0.50 -4.30 -0.08 0.00 0.56 0.00 0.00 36.38 32.06 1lwt s VAL 67 CO 0.37 0.43 -0.81 -2.65 -0.31 0.00 0.00 175.10 172.13 1lwt n PRO 68 N 2.04 -0.50 -0.53 4.82 -0.02 -1.26 -4.84 135.00 134.71 1lwt n PRO 68 Ca -0.01 -0.14 -0.05 0.00 -2.02 0.00 0.00 63.50 61.29 1lwt n PRO 68 Cb 0.48 -1.28 0.14 0.00 -0.02 0.00 0.00 33.50 32.82 1lwt n PRO 68 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1lwt n GLU 69 N 0.79 2.22 -1.53 -0.52 0.00 -1.26 -4.98 120.64 115.36 1lwt n GLU 69 Ca -0.00 -1.50 -0.54 0.00 0.00 0.00 0.00 57.16 55.11 1lwt n GLU 69 Cb 0.67 -1.72 -0.06 0.00 0.00 0.00 0.00 31.44 30.33 1lwt n GLU 69 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1lwt n LEU 70 N -0.02 0.65 -4.77 -1.84 4.77 -1.26 -4.86 117.00 109.68 1lwt n LEU 70 Ca 0.22 1.14 -0.41 0.00 -0.03 0.00 0.00 56.01 56.93 1lwt n LEU 70 Cb 0.91 -1.06 -0.01 0.00 -2.33 0.00 0.00 43.42 40.93 1lwt n LEU 70 CO 0.23 -1.63 1.17 -0.76 -1.33 0.00 0.00 177.39 175.07 1lwt s LEU 71 N 0.52 4.34 0.22 2.23 1.43 -1.26 -4.82 118.68 121.34 1lwt s LEU 71 Ca 0.84 2.98 -0.22 0.00 -1.03 0.00 0.00 54.13 56.69 1lwt s LEU 71 Cb -1.07 -3.65 0.05 0.00 0.03 0.00 0.00 46.19 41.55 1lwt s LEU 71 CO 0.53 -0.87 0.87 -1.59 0.23 0.00 0.00 176.35 175.52 1lwt s LYS 72 N -1.34 1.52 0.00 1.70 -2.85 -1.26 -1.64 119.74 115.87 1lwt s LYS 72 Ca 0.57 -0.87 0.00 0.00 -1.00 0.00 0.00 55.97 54.67 1lwt s LYS 72 Cb -0.47 0.50 0.00 0.00 -2.06 0.00 0.00 37.83 35.80 1lwt s LYS 72 CO 0.55 -0.70 0.00 1.97 0.10 0.00 0.00 175.35 177.27 1lwt n PHE 73 N -0.50 0.00 -3.77 1.78 -1.74 -1.21 -4.99 117.46 107.03 1lwt n PHE 73 Ca -0.05 0.00 -0.19 0.00 -0.56 0.00 0.00 57.45 56.65 1lwt n PHE 73 Cb 0.60 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.43 1lwt n PHE 73 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 1lwt s THR 74 N -2.00 0.06 0.40 1.97 -4.23 -1.26 -0.09 115.64 110.49 1lwt s THR 74 Ca 0.00 0.25 0.06 0.00 -1.18 0.00 0.00 61.69 60.82 1lwt s THR 74 Cb 0.00 -0.24 -0.07 0.00 1.34 0.00 0.00 72.50 73.53 1lwt s THR 74 CO 0.00 0.17 0.02 0.00 -0.54 0.00 0.00 174.62 174.27 1lwt s ASN 76 N -3.68 2.61 0.56 0.00 4.22 -1.10 0.23 114.94 117.78 1lwt s ASN 76 Ca 0.33 0.63 0.33 0.00 -2.14 0.00 0.00 52.86 52.01 1lwt s ASN 76 Cb 0.09 -0.93 1.63 0.00 1.28 0.00 0.00 41.25 43.32 1lwt s ASN 76 CO 0.16 -3.08 2.10 0.00 -2.04 0.00 0.00 177.10 174.25 1lwt h ALA 77 N -1.87 1.10 -0.41 3.54 0.00 -0.09 -3.04 119.26 118.49 1lwt h ALA 77 Ca -0.47 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 1lwt h ALA 77 Cb 1.29 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1lwt h ALA 77 CO 0.46 0.07 0.03 0.25 0.00 0.00 0.00 179.25 180.07 1lwt n THR 78 N -3.31 2.52 -2.75 0.00 -2.24 -1.26 -1.64 114.28 105.60 1lwt n THR 78 Ca -0.01 -1.81 -0.40 0.00 -2.27 0.00 0.00 64.05 59.55 1lwt n THR 78 Cb 0.23 -0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.13 1lwt n THR 78 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1lwt s HIS 79 N -2.88 3.92 -0.31 4.78 2.46 -1.15 -4.85 115.29 117.26 1lwt s HIS 79 Ca 0.47 1.86 -0.27 0.00 0.47 0.00 0.00 55.06 57.59 1lwt s HIS 79 Cb 0.38 -3.00 0.01 0.00 -0.13 0.00 0.00 32.58 29.84 1lwt s HIS 79 CO 0.10 0.37 0.97 -1.21 -2.47 0.00 0.00 174.74 172.50 1lwt s GLU 80 N -0.74 4.03 -0.31 2.88 2.02 -1.26 -2.67 118.70 122.64 1lwt s GLU 80 Ca 0.43 0.89 -0.26 0.00 0.02 0.00 0.00 54.97 56.05 1lwt s GLU 80 Cb -0.25 -3.73 0.01 0.00 0.10 0.00 0.00 34.13 30.26 1lwt s GLU 80 CO 0.31 -0.82 0.92 -0.51 0.02 0.00 0.00 175.26 175.18 1lwt s LEU 81 N 3.38 4.03 -0.50 1.80 1.43 0.11 -3.84 118.68 125.08 1lwt s LEU 81 Ca 0.41 0.85 -0.28 0.00 -1.03 0.00 0.00 54.13 54.07 1lwt s LEU 81 Cb -0.13 -3.29 0.00 0.00 0.03 0.00 0.00 46.19 42.81 1lwt s LEU 81 CO 0.14 -0.73 1.51 -0.69 0.23 0.00 0.00 176.35 176.81 1lwt s VAL 82 N 3.26 3.73 0.52 -1.59 1.01 -1.26 -2.56 120.40 123.50 1lwt s VAL 82 Ca 0.38 0.65 0.02 0.00 0.00 0.00 0.00 61.98 63.03 1lwt s VAL 82 Cb -0.13 -4.23 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 1lwt s VAL 82 CO 0.13 -0.95 0.07 0.68 0.00 0.00 0.00 175.10 175.03 1lwt s VAL 83 N 6.36 1.22 -0.03 2.92 -7.23 -0.32 -4.28 120.40 119.05 1lwt s VAL 83 Ca 0.59 -1.91 -0.11 0.00 -1.81 0.00 0.00 61.98 58.74 1lwt s VAL 83 Cb -0.13 -2.14 0.02 0.00 0.56 0.00 0.00 36.38 34.69 1lwt s VAL 83 CO 0.27 0.00 0.25 -0.13 -0.31 0.00 0.00 175.10 175.18 1lwt s ARG 84 N -3.95 0.54 -0.11 4.82 0.52 -0.66 -2.98 118.95 117.14 1lwt s ARG 84 Ca 0.10 -0.15 -0.07 0.00 -0.52 0.00 0.00 55.73 55.08 1lwt s ARG 84 Cb 0.01 0.24 0.04 0.00 0.52 0.00 0.00 34.95 35.76 1lwt s ARG 84 CO 0.06 -0.13 0.28 0.99 0.02 0.00 0.00 175.30 176.51 1lwt s THR 85 N -1.07 -0.02 0.83 0.02 2.01 -0.64 -2.57 115.64 114.19 1lwt s THR 85 Ca -0.11 0.09 -0.12 0.00 0.31 0.00 0.00 61.69 61.86 1lwt s THR 85 Cb -0.05 -0.41 0.10 0.00 0.01 0.00 0.00 72.50 72.14 1lwt s THR 85 CO 0.03 0.04 1.15 -2.84 -0.69 0.00 0.00 174.62 172.30 1lwt s PRO 86 N 0.87 1.60 -0.18 4.92 0.02 -1.26 0.22 135.00 141.19 1lwt s PRO 86 Ca -0.06 1.53 -0.14 0.00 0.02 0.00 0.00 61.00 62.35 1lwt s PRO 86 Cb -0.07 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.61 1lwt s PRO 86 CO -0.06 -2.20 0.30 1.03 -0.33 0.00 0.00 177.00 175.75 1lwt s ARG 87 N -4.49 4.21 -0.00 5.54 0.52 0.93 -4.59 118.95 121.07 1lwt s ARG 87 Ca 0.68 0.07 0.00 0.00 -0.52 0.00 0.00 55.73 55.95 1lwt s ARG 87 Cb -0.23 -3.47 0.00 0.00 0.52 0.00 0.00 34.95 31.76 1lwt s ARG 87 CO 0.54 0.13 -0.00 -1.54 0.02 0.00 0.00 175.30 174.45 1lwt s SER 88 N 0.72 0.03 -0.10 0.23 1.04 -1.26 -4.91 113.70 109.45 1lwt s SER 88 Ca 0.16 -0.00 -0.03 0.00 0.48 0.00 0.00 55.95 56.56 1lwt s SER 88 Cb -0.13 -0.01 0.04 0.00 0.10 0.00 0.00 66.02 66.02 1lwt s SER 88 CO 0.05 -0.00 0.06 0.54 0.98 0.00 0.00 173.24 174.86 1lwt s VAL 89 N 0.03 0.04 0.12 5.02 0.11 -1.26 -1.39 120.40 123.07 1lwt s VAL 89 Ca -0.00 0.11 0.09 0.00 -2.93 0.00 0.00 61.98 59.25 1lwt s VAL 89 Cb -0.00 -0.42 -0.04 0.00 -1.53 0.00 0.00 36.38 34.38 1lwt s VAL 89 CO -0.00 0.02 -0.21 0.00 -3.33 0.00 0.00 175.10 171.58 1lwt s ARG 90 N 2.10 1.69 0.22 1.54 1.70 -0.65 -5.01 118.95 120.53 1lwt s ARG 90 Ca 0.04 -1.22 0.05 0.00 -0.47 0.00 0.00 55.73 54.13 1lwt s ARG 90 Cb -0.14 -2.06 -0.03 0.00 -0.57 0.00 0.00 34.95 32.15 1lwt s ARG 90 CO -0.06 0.47 0.26 1.03 -1.08 0.00 0.00 175.30 175.93 1lwt s ARG 91 N -2.09 3.18 -0.13 3.89 0.52 -1.26 -2.05 118.95 121.01 1lwt s ARG 91 Ca 0.17 -0.86 -0.29 0.00 -0.52 0.00 0.00 55.73 54.23 1lwt s ARG 91 Cb -0.10 -2.75 0.08 0.00 0.52 0.00 0.00 34.95 32.69 1lwt s ARG 91 CO 0.09 0.44 0.74 -1.17 0.02 0.00 0.00 175.30 175.42 1lwt s LEU 92 N -3.69 -0.65 -0.20 2.53 2.96 -0.86 -4.94 118.68 113.83 1lwt s LEU 92 Ca 0.33 0.88 0.02 0.00 -0.22 0.00 0.00 54.13 55.14 1lwt s LEU 92 Cb -0.09 2.43 0.03 0.00 0.50 0.00 0.00 46.19 49.06 1lwt s LEU 92 CO 0.27 -0.47 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.12 1lwt s SER 93 N -0.72 3.54 0.23 3.68 0.15 -1.26 0.14 113.70 119.47 1lwt s SER 93 Ca -0.07 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 55.69 1lwt s SER 93 Cb -0.02 -1.46 -0.05 0.00 -1.71 0.00 0.00 66.02 62.79 1lwt s SER 93 CO 0.06 -0.08 0.10 0.00 1.20 0.00 0.00 173.24 174.53 1lwt s ARG 94 N 1.25 1.32 -0.01 5.44 1.70 -1.12 -5.00 118.95 122.53 1lwt s ARG 94 Ca 0.00 -1.70 0.02 0.00 -0.47 0.00 0.00 55.73 53.58 1lwt s ARG 94 Cb -0.15 -0.08 0.00 0.00 -0.57 0.00 0.00 34.95 34.14 1lwt s ARG 94 CO -0.10 -0.32 -0.06 0.99 -1.08 0.00 0.00 175.30 174.73 1lwt s THR 95 N -3.89 0.53 -0.06 4.99 2.01 -1.26 -0.62 115.64 117.35 1lwt s THR 95 Ca 0.37 -0.25 -0.23 0.00 0.31 0.00 0.00 61.69 61.89 1lwt s THR 95 Cb 0.07 -0.47 0.05 0.00 0.01 0.00 0.00 72.50 72.16 1lwt s THR 95 CO 0.12 0.17 0.51 0.27 -0.69 0.00 0.00 174.62 175.01 1lwt s ILE 96 N 0.08 0.02 -1.68 1.82 -5.25 -0.81 -4.90 121.20 110.49 1lwt s ILE 96 Ca -0.01 -0.19 0.00 0.00 -0.99 0.00 0.00 60.65 59.47 1lwt s ILE 96 Cb -0.05 -0.81 0.00 0.00 2.95 0.00 0.00 42.46 44.54 1lwt s ILE 96 CO -0.00 -0.10 0.00 1.17 -1.79 0.00 0.00 174.94 174.22 1lwt n LYS 97 N 1.33 -1.74 0.00 0.37 4.81 -1.26 -2.26 118.16 119.42 1lwt n LYS 97 Ca -0.19 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1lwt n LYS 97 Cb 0.56 -5.53 0.00 0.00 0.02 0.00 0.00 35.03 30.09 1lwt n LYS 97 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lwt n GLY 98 N -0.82 2.15 3.75 3.14 0.00 -1.26 -5.00 105.19 107.14 1lwt n GLY 98 Ca -0.21 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1lwt n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lwt s VAL 99 N 0.00 3.26 -0.06 1.61 0.11 -0.96 -4.99 120.40 119.37 1lwt s VAL 99 Ca 0.00 1.13 -0.04 0.00 -2.93 0.00 0.00 61.98 60.14 1lwt s VAL 99 Cb 0.00 -3.72 -0.04 0.00 -1.53 0.00 0.00 36.38 31.09 1lwt s VAL 99 CO 0.00 0.21 0.14 -1.83 -3.33 0.00 0.00 175.10 170.29 1lwt s GLU 100 N -0.75 3.35 0.08 1.54 -1.05 -1.26 -1.91 118.70 118.69 1lwt s GLU 100 Ca 0.52 -0.27 0.01 0.00 -0.15 0.00 0.00 54.97 55.08 1lwt s GLU 100 Cb -0.35 -3.08 -0.00 0.00 -0.44 0.00 0.00 34.13 30.25 1lwt s GLU 100 CO 0.41 0.72 0.05 0.66 0.95 0.00 0.00 175.26 178.05 1lwt n TYR 101 N 1.52 -0.07 -4.33 4.83 4.02 0.21 -1.79 117.16 121.56 1lwt n TYR 101 Ca -0.16 -0.58 -0.32 0.00 -0.01 0.00 0.00 57.90 56.83 1lwt n TYR 101 Cb 0.54 0.03 -0.09 0.00 -0.02 0.00 0.00 39.34 39.79 1lwt n TYR 101 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1lwt s PHE 102 N -2.07 2.97 0.19 -0.72 0.08 0.42 -2.79 117.98 116.05 1lwt s PHE 102 Ca 0.06 0.01 0.08 0.00 0.12 0.00 0.00 56.93 57.21 1lwt s PHE 102 Cb 0.00 -1.61 -0.04 0.00 -0.57 0.00 0.00 43.02 40.79 1lwt s PHE 102 CO 0.05 0.43 -0.17 -2.00 -0.10 0.00 0.00 175.22 173.42 1lwt s GLU 103 N -1.64 1.31 -0.44 0.44 2.12 0.38 -3.18 118.70 117.69 1lwt s GLU 103 Ca 0.20 -1.49 0.05 0.00 0.36 0.00 0.00 54.97 54.09 1lwt s GLU 103 Cb -0.11 -1.28 0.20 0.00 0.26 0.00 0.00 34.13 33.20 1lwt s GLU 103 CO 0.10 0.24 0.42 0.28 -0.54 0.00 0.00 175.26 175.77 1lwt n VAL 104 N 0.00 -0.68 -2.11 3.70 0.31 -0.75 -2.03 118.33 116.76 1lwt n VAL 104 Ca -0.11 -3.79 -0.41 0.00 -0.01 0.00 0.00 64.34 60.02 1lwt n VAL 104 Cb 0.58 -1.80 -0.03 0.00 -0.91 0.00 0.00 33.84 31.68 1lwt n VAL 104 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1lwt s ILE 105 N -0.53 2.95 0.00 2.52 1.09 -0.87 -3.52 121.20 122.84 1lwt s ILE 105 Ca 0.33 0.77 -0.20 0.00 -1.10 0.00 0.00 60.65 60.46 1lwt s ILE 105 Cb 0.07 -3.49 0.04 0.00 -1.06 0.00 0.00 42.46 38.02 1lwt s ILE 105 CO -0.16 0.11 0.43 0.42 -0.10 0.00 0.00 174.94 175.64 1lwt s THR 106 N 0.21 0.04 -0.21 2.92 -4.23 0.16 -1.63 115.64 112.91 1lwt s THR 106 Ca 0.59 -0.36 -0.16 0.00 -1.18 0.00 0.00 61.69 60.58 1lwt s THR 106 Cb -0.39 -0.83 -0.04 0.00 1.34 0.00 0.00 72.50 72.58 1lwt s THR 106 CO 0.39 -0.20 0.41 -0.36 -0.54 0.00 0.00 174.62 174.32 1lwt s PHE 107 N -1.75 3.37 0.00 3.99 0.40 -0.48 0.10 117.98 123.61 1lwt s PHE 107 Ca -0.10 0.61 0.00 0.00 -0.60 0.00 0.00 56.93 56.85 1lwt s PHE 107 Cb -0.02 -2.54 0.00 0.00 0.51 0.00 0.00 43.02 40.97 1lwt s PHE 107 CO 0.03 -0.03 0.00 0.39 0.70 0.00 0.00 175.22 176.31 1lwt n GLU 108 N 4.54 0.00 0.00 0.44 1.02 -0.15 -4.54 120.64 121.95 1lwt n GLU 108 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1lwt n GLU 108 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 1lwt n GLU 108 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lwt n GLY 110 N 0.00 -0.73 3.36 0.62 0.00 0.37 0.18 105.19 108.99 1lwt n GLY 110 Ca 0.00 0.15 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 1lwt n GLY 110 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lwt s GLN 111 N -0.14 1.35 -0.22 1.61 -0.21 -1.26 -2.31 119.66 118.48 1lwt s GLN 111 Ca 0.00 -1.48 -0.27 0.00 0.02 0.00 0.00 55.36 53.63 1lwt s GLN 111 Cb 0.00 0.35 0.11 0.00 1.00 0.00 0.00 33.01 34.48 1lwt s GLN 111 CO 0.00 -0.50 0.95 0.21 -2.12 0.00 0.00 175.29 173.83 1lwt s LYS 112 N -4.09 0.63 -0.24 2.91 2.20 -0.82 -4.84 119.74 115.48 1lwt s LYS 112 Ca 0.32 0.46 -0.22 0.00 -0.36 0.00 0.00 55.97 56.17 1lwt s LYS 112 Cb 0.04 0.30 -0.01 0.00 -1.51 0.00 0.00 37.83 36.65 1lwt s LYS 112 CO 0.11 -0.13 0.71 0.15 -0.36 0.00 0.00 175.35 175.82 1lwt s LYS 113 N -0.35 4.15 0.36 4.03 -0.14 -1.26 -2.69 119.74 123.84 1lwt s LYS 113 Ca -0.00 0.71 -0.26 0.00 -1.36 0.00 0.00 55.97 55.05 1lwt s LYS 113 Cb -0.03 -3.64 -0.09 0.00 -1.68 0.00 0.00 37.83 32.39 1lwt s LYS 113 CO -0.01 -0.44 1.14 0.00 -0.76 0.00 0.00 175.35 175.29 1lwt s ALA 114 N 2.57 3.24 0.46 5.17 0.00 -1.06 -4.88 121.76 127.27 1lwt s ALA 114 Ca 0.30 0.93 0.25 0.00 0.00 0.00 0.00 51.96 53.44 1lwt s ALA 114 Cb -0.15 -3.36 1.28 0.00 0.00 0.00 0.00 23.12 20.89 1lwt s ALA 114 CO 0.08 -0.39 1.82 -1.35 0.00 0.00 0.00 175.76 175.93 1lwt h PRO 115 N 2.99 0.22 0.00 0.00 0.11 -1.96 0.81 132.00 134.17 1lwt h PRO 115 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1lwt h PRO 115 Cb 1.22 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1lwt h PRO 115 CO 0.64 0.14 0.00 -0.40 -0.21 0.00 0.00 178.00 178.17 1lwt n ASP 116 N -4.43 0.00 0.00 -2.05 5.75 -1.26 -4.86 116.55 109.70 1lwt n ASP 116 Ca 0.23 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 54.06 1lwt n ASP 116 Cb 0.95 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.04 1lwt n ASP 116 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1lwt n GLY 117 N 0.17 2.93 3.27 6.12 0.00 0.28 -5.05 105.19 112.91 1lwt n GLY 117 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1lwt n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lwt n ARG 118 N -0.54 -0.30 -3.64 1.61 1.74 -1.25 -4.61 116.66 109.67 1lwt n ARG 118 Ca 0.00 -0.06 -0.39 0.00 -0.77 0.00 0.00 57.85 56.63 1lwt n ARG 118 Cb 0.00 -1.57 -0.10 0.00 -1.02 0.00 0.00 32.46 29.78 1lwt n ARG 118 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1lwt s ILE 119 N -2.26 3.86 -0.20 0.55 1.01 -1.26 -2.56 121.20 120.34 1lwt s ILE 119 Ca 0.51 -1.92 -0.08 0.00 0.00 0.00 0.00 60.65 59.16 1lwt s ILE 119 Cb -0.18 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 1lwt s ILE 119 CO 0.72 -0.75 0.07 0.68 0.00 0.00 0.00 174.94 175.66 1lwt s VAL 120 N 1.24 4.73 -0.41 2.92 -7.23 -1.09 -4.98 120.40 115.57 1lwt s VAL 120 Ca 0.07 -0.05 -0.26 0.00 -1.81 0.00 0.00 61.98 59.94 1lwt s VAL 120 Cb -0.25 -3.15 0.02 0.00 0.56 0.00 0.00 36.38 33.56 1lwt s VAL 120 CO -0.02 0.42 0.93 -1.61 -0.31 0.00 0.00 175.10 174.50 1lwt s GLU 121 N 0.72 3.71 0.00 4.82 2.02 -1.26 -1.95 118.70 126.76 1lwt s GLU 121 Ca 0.04 0.40 0.00 0.00 0.02 0.00 0.00 54.97 55.43 1lwt s GLU 121 Cb -0.13 -3.85 0.00 0.00 0.10 0.00 0.00 34.13 30.24 1lwt s GLU 121 CO 0.02 -1.06 0.00 1.47 0.02 0.00 0.00 175.26 175.71 1lwt n LEU 122 N 6.94 0.00 -4.80 1.80 -0.00 -0.98 -4.93 117.00 115.04 1lwt n LEU 122 Ca 0.07 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.71 1lwt n LEU 122 Cb 0.48 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.84 1lwt n LEU 122 CO 0.61 0.00 -0.05 -0.69 -0.00 0.00 0.00 177.39 177.25 1lwt s VAL 123 N -2.09 5.32 0.10 1.47 1.01 -1.26 0.14 120.40 125.08 1lwt s VAL 123 Ca 0.00 0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.49 1lwt s VAL 123 Cb 0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1lwt s VAL 123 CO 0.00 0.50 -0.10 -0.54 0.00 0.00 0.00 175.10 174.96 1lwt s LYS 124 N -0.32 0.89 -0.31 2.72 -0.14 0.13 -4.72 119.74 117.99 1lwt s LYS 124 Ca 0.17 -1.20 -0.20 0.00 -1.36 0.00 0.00 55.97 53.38 1lwt s LYS 124 Cb -0.13 -0.57 -0.01 0.00 -1.68 0.00 0.00 37.83 35.43 1lwt s LYS 124 CO 0.05 0.09 0.60 -2.00 -0.76 0.00 0.00 175.35 173.33 1lwt s GLU 125 N -2.89 3.87 0.01 1.68 2.12 -1.26 -0.98 118.70 121.25 1lwt s GLU 125 Ca 0.07 0.22 0.06 0.00 0.36 0.00 0.00 54.97 55.68 1lwt s GLU 125 Cb -0.02 -3.73 -0.03 0.00 0.26 0.00 0.00 34.13 30.60 1lwt s GLU 125 CO 0.00 -0.56 -0.16 0.08 -0.54 0.00 0.00 175.26 174.08 1lwt s VAL 126 N 2.54 2.92 -0.01 3.70 1.01 0.28 -4.90 120.40 125.94 1lwt s VAL 126 Ca 0.24 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1lwt s VAL 126 Cb -0.15 -2.19 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 1lwt s VAL 126 CO 0.12 0.44 -0.09 -0.94 0.00 0.00 0.00 175.10 174.62 1lwt s SER 127 N -1.17 1.12 -0.03 3.32 1.04 -1.26 0.36 113.70 117.07 1lwt s SER 127 Ca 0.14 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.44 1lwt s SER 127 Cb -0.11 -0.13 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 1lwt s SER 127 CO 0.04 0.11 -0.16 -0.54 0.98 0.00 0.00 173.24 173.67 1lwt s LYS 128 N -0.20 1.58 -0.05 4.02 -0.14 -1.23 -4.95 119.74 118.77 1lwt s LYS 128 Ca 0.03 -0.58 -0.19 0.00 -1.36 0.00 0.00 55.97 53.87 1lwt s LYS 128 Cb -0.04 -1.42 0.04 0.00 -1.68 0.00 0.00 37.83 34.73 1lwt s LYS 128 CO -0.00 0.27 0.43 -1.54 -0.76 0.00 0.00 175.35 173.74 1lwt s SER 129 N -0.08 -0.36 0.04 2.83 1.04 -1.26 -1.82 113.70 114.10 1lwt s SER 129 Ca -0.01 0.38 -0.04 0.00 0.48 0.00 0.00 55.95 56.76 1lwt s SER 129 Cb -0.10 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.47 1lwt s SER 129 CO 0.01 -0.45 0.07 -0.72 0.98 0.00 0.00 173.24 173.13 1lwt s TYR 130 N -1.06 0.25 0.45 5.02 -0.85 -1.19 -4.98 117.35 115.00 1lwt s TYR 130 Ca -0.11 -0.60 -0.25 0.00 -0.52 0.00 0.00 57.07 55.59 1lwt s TYR 130 Cb -0.04 -0.18 -0.08 0.00 0.38 0.00 0.00 41.96 42.04 1lwt s TYR 130 CO 0.05 -0.36 1.38 -2.30 -1.52 0.00 0.00 175.55 172.80 1lwt n PRO 131 N 0.71 2.10 -0.12 -3.49 -0.02 -1.26 -0.44 135.00 132.48 1lwt n PRO 131 Ca -0.19 0.75 0.27 0.00 -2.02 0.00 0.00 63.50 62.32 1lwt n PRO 131 Cb 0.59 -2.56 0.71 0.00 -0.02 0.00 0.00 33.50 32.22 1lwt n PRO 131 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1lwt h ILE 132 N 2.13 0.40 -0.86 4.25 2.04 -1.62 -2.51 117.51 121.34 1lwt h ILE 132 Ca -0.50 0.00 0.19 0.00 1.00 0.00 0.00 64.86 65.55 1lwt h ILE 132 Cb 1.28 0.50 -0.16 0.00 -0.74 0.00 0.00 36.82 37.70 1lwt h ILE 132 CO 0.60 0.00 -0.12 0.28 0.00 0.00 0.00 178.15 178.92 1lwt h SER 133 N 0.00 -0.63 -0.43 1.72 0.02 -1.90 -0.25 113.55 112.07 1lwt h SER 133 Ca 0.38 0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 61.54 1lwt h SER 133 Cb 1.73 0.48 -0.02 0.00 0.14 0.00 0.00 62.40 64.73 1lwt h SER 133 CO -0.00 -0.27 0.15 -0.33 -1.14 0.00 0.00 176.83 175.24 1lwt h GLU 134 N 0.03 0.73 0.00 3.45 5.08 -1.82 -3.49 114.58 118.55 1lwt h GLU 134 Ca 0.45 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1lwt h GLU 134 Cb 0.77 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1lwt h GLU 134 CO -0.84 0.63 0.00 0.41 -1.00 0.00 0.00 179.01 178.21 1lwt n GLY 135 N -1.01 2.64 0.00 -3.84 0.00 -0.11 -4.79 105.19 98.09 1lwt n GLY 135 Ca 0.04 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1lwt n GLY 135 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1lwt n PRO 136 N 1.74 0.00 0.42 1.61 -0.04 -1.26 -3.17 135.00 134.29 1lwt n PRO 136 Ca 0.00 0.04 -0.19 0.00 -0.04 0.00 0.00 63.50 63.31 1lwt n PRO 136 Cb 0.00 -1.59 -0.09 0.00 -0.04 0.00 0.00 33.50 31.78 1lwt n PRO 136 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1lwt h GLU 137 N 0.00 -1.05 -0.72 0.54 4.11 -1.98 -1.68 114.58 113.81 1lwt h GLU 137 Ca 0.00 0.07 0.15 0.00 0.07 0.00 0.00 59.36 59.65 1lwt h GLU 137 Cb 0.18 0.24 -0.11 0.00 0.50 0.00 0.00 28.75 29.56 1lwt h GLU 137 CO 0.00 -0.70 0.17 0.00 0.07 0.00 0.00 179.01 178.55 1lwt h ARG 138 N -1.09 0.26 0.43 1.06 3.08 -1.91 -2.43 114.38 113.79 1lwt h ARG 138 Ca -0.10 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1lwt h ARG 138 Cb 0.86 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1lwt h ARG 138 CO 0.14 0.18 -0.24 0.00 -1.07 0.00 0.00 179.97 178.97 1lwt h ALA 139 N 1.59 -1.12 -0.32 0.04 0.00 -1.79 -2.56 119.26 115.09 1lwt h ALA 139 Ca 0.40 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.27 1lwt h ALA 139 Cb 0.66 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1lwt h ALA 139 CO -0.49 -1.09 0.88 -0.91 0.00 0.00 0.00 179.25 177.63 1lwt h ASN 140 N -0.62 0.00 0.13 0.00 2.35 -0.98 -0.34 115.58 116.12 1lwt h ASN 140 Ca -0.06 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1lwt h ASN 140 Cb 0.48 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.85 1lwt h ASN 140 CO 0.08 0.00 -0.06 -0.08 -1.65 0.00 0.00 177.43 175.72 1lwt h GLU 141 N 0.00 -0.16 -0.29 0.81 4.22 -1.02 -3.32 114.58 114.82 1lwt h GLU 141 Ca 0.15 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.61 1lwt h GLU 141 Cb 1.90 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 31.18 1lwt h GLU 141 CO -0.00 0.30 0.19 -0.07 -2.18 0.00 0.00 179.01 177.25 1lwt h LEU 142 N -0.86 0.32 -1.08 1.64 3.38 -0.99 -0.18 115.31 117.54 1lwt h LEU 142 Ca -0.02 -0.01 0.39 0.00 0.09 0.00 0.00 57.88 58.34 1lwt h LEU 142 Cb 0.54 -0.08 -0.16 0.00 0.09 0.00 0.00 40.66 41.05 1lwt h LEU 142 CO 0.03 0.23 0.61 0.58 0.09 0.00 0.00 178.44 179.99 1lwt h VAL 143 N 0.38 0.12 0.09 1.22 2.07 -1.60 0.98 116.25 119.50 1lwt h VAL 143 Ca 0.11 -0.04 -0.34 0.00 0.82 0.00 0.00 66.70 67.24 1lwt h VAL 143 Cb -0.04 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.69 1lwt h VAL 143 CO -0.03 0.02 -1.91 -0.62 0.02 0.00 0.00 177.57 175.05 1lwt n GLU 144 N -5.08 0.72 0.00 1.57 4.71 -1.06 -1.79 120.64 119.71 1lwt n GLU 144 Ca 0.36 0.27 0.00 0.00 -0.01 0.00 0.00 57.16 57.78 1lwt n GLU 144 Cb 1.22 -1.74 0.00 0.00 -1.01 0.00 0.00 31.44 29.92 1lwt n GLU 144 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1lwt n SER 145 N -3.35 0.00 0.02 1.62 2.88 0.30 0.18 113.62 115.27 1lwt n SER 145 Ca -0.27 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.26 1lwt n SER 145 Cb 1.05 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.51 1lwt n SER 145 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1lwt n TYR 146 N -0.91 0.00 -0.42 0.66 9.36 0.10 -4.42 117.16 121.54 1lwt n TYR 146 Ca 0.00 0.00 0.34 0.00 3.32 0.00 0.00 57.90 61.56 1lwt n TYR 146 Cb 0.00 -0.05 0.62 0.00 -0.63 0.00 0.00 39.34 39.28 1lwt n TYR 146 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1lwt h ARG 147 N -0.10 0.15 -2.34 2.98 3.08 -0.48 1.53 114.38 119.19 1lwt h ARG 147 Ca 0.00 -0.01 -0.75 0.00 0.07 0.00 0.00 59.98 59.30 1lwt h ARG 147 Cb 0.10 -0.03 -0.32 0.00 0.08 0.00 0.00 29.97 29.80 1lwt h ARG 147 CO 0.00 0.10 0.51 1.17 -1.07 0.00 0.00 179.97 180.68 1lwt n LYS 148 N -4.66 4.64 0.00 0.04 4.81 0.49 -4.50 118.16 118.98 1lwt n LYS 148 Ca 0.34 -4.70 0.00 0.00 -0.87 0.00 0.00 58.31 53.08 1lwt n LYS 148 Cb 1.31 -2.41 0.00 0.00 0.02 0.00 0.00 35.03 33.95 1lwt n LYS 148 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1lwt n ALA 149 N 0.12 2.26 -3.14 3.14 0.00 0.52 -4.70 120.51 118.72 1lwt n ALA 149 Ca 0.39 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.71 1lwt n ALA 149 Cb 0.31 0.36 -0.10 0.00 0.00 0.00 0.00 19.45 20.01 1lwt n ALA 149 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1lwt s SER 150 N -4.04 -0.11 0.05 0.00 0.15 -1.26 -5.08 113.70 103.41 1lwt s SER 150 Ca 0.00 0.08 -0.27 0.00 0.70 0.00 0.00 55.95 56.47 1lwt s SER 150 Cb 0.00 0.32 -0.17 0.00 -1.71 0.00 0.00 66.02 64.46 1lwt s SER 150 CO 0.00 -0.29 1.50 0.78 1.20 0.00 0.00 173.24 176.43 1lwt h ASN 151 N 4.68 -0.31 -3.92 5.45 2.35 -1.97 -3.44 115.58 118.42 1lwt h ASN 151 Ca -0.29 -0.10 -0.53 0.00 -0.55 0.00 0.00 56.30 54.84 1lwt h ASN 151 Cb 1.19 0.08 0.08 0.00 0.05 0.00 0.00 38.32 39.72 1lwt h ASN 151 CO 0.39 -0.09 0.64 -0.54 -1.65 0.00 0.00 177.43 176.18 1lwt s LYS 152 N -5.47 4.11 0.00 0.81 1.02 -1.26 -4.89 119.74 114.06 1lwt s LYS 152 Ca -0.15 2.22 0.20 0.00 0.02 0.00 0.00 55.97 58.26 1lwt s LYS 152 Cb 0.04 -2.88 1.10 0.00 -0.52 0.00 0.00 37.83 35.56 1lwt s LYS 152 CO 0.61 -0.40 1.72 0.00 -0.92 0.00 0.00 175.35 176.37 1lwt n ALA 153 N 0.39 2.60 -2.65 5.17 0.00 -1.26 -4.83 120.51 119.92 1lwt n ALA 153 Ca 0.02 -0.19 -0.09 0.00 0.00 0.00 0.00 53.44 53.18 1lwt n ALA 153 Cb 0.42 -1.28 -0.07 0.00 0.00 0.00 0.00 19.45 18.53 1lwt n ALA 153 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1lwt s TYR 154 N -1.97 0.09 0.20 0.00 -0.85 -1.26 -0.05 117.35 113.52 1lwt s TYR 154 Ca 0.30 -0.48 -0.10 0.00 -0.52 0.00 0.00 57.07 56.27 1lwt s TYR 154 Cb 0.14 -0.01 -0.07 0.00 0.38 0.00 0.00 41.96 42.40 1lwt s TYR 154 CO 0.23 -0.55 0.54 -0.06 -1.52 0.00 0.00 175.55 174.19 1lwt s PHE 155 N -3.70 3.47 -0.57 -3.49 0.08 0.58 -4.85 117.98 109.50 1lwt s PHE 155 Ca 0.03 0.90 0.04 0.00 0.12 0.00 0.00 56.93 58.02 1lwt s PHE 155 Cb 0.04 -2.27 0.15 0.00 -0.57 0.00 0.00 43.02 40.37 1lwt s PHE 155 CO -0.10 0.32 0.35 -2.00 -0.10 0.00 0.00 175.22 173.68 1lwt s GLU 156 N -2.61 1.96 0.37 0.44 2.12 -1.26 -1.63 118.70 118.09 1lwt s GLU 156 Ca 0.45 -2.75 0.01 0.00 0.36 0.00 0.00 54.97 53.03 1lwt s GLU 156 Cb -0.12 -3.04 -0.00 0.00 0.26 0.00 0.00 34.13 31.23 1lwt s GLU 156 CO 0.21 -1.21 0.02 -2.67 -0.54 0.00 0.00 175.26 171.07 1lwt n TRP 157 N 2.74 0.75 -4.63 5.30 2.14 -1.16 -4.99 117.44 117.59 1lwt n TRP 157 Ca 0.13 -1.92 -0.26 0.00 2.07 0.00 0.00 57.50 57.52 1lwt n TRP 157 Cb 0.35 -0.21 -0.14 0.00 -0.81 0.00 0.00 31.31 30.50 1lwt n TRP 157 CO 0.00 0.00 0.00 0.95 2.07 0.00 0.00 177.69 180.71 1lwt s THR 158 N -2.45 1.68 -0.11 -1.67 -4.23 -1.26 -1.18 115.64 106.42 1lwt s THR 158 Ca 0.03 -1.22 -0.11 0.00 -1.18 0.00 0.00 61.69 59.21 1lwt s THR 158 Cb 0.00 -1.46 0.03 0.00 1.34 0.00 0.00 72.50 72.41 1lwt s THR 158 CO 0.02 0.20 0.31 -0.51 -0.54 0.00 0.00 174.62 174.10 1lwt s ILE 159 N -0.82 0.00 0.16 2.99 2.07 -1.06 -4.92 121.20 119.62 1lwt s ILE 159 Ca 0.07 -0.04 -0.30 0.00 -1.41 0.00 0.00 60.65 58.98 1lwt s ILE 159 Cb -0.09 -0.46 -0.07 0.00 0.13 0.00 0.00 42.46 41.98 1lwt s ILE 159 CO 0.02 -0.02 0.99 -1.61 -1.91 0.00 0.00 174.94 172.41 1lwt s GLU 160 N 0.06 4.71 0.19 3.50 2.02 -1.26 0.06 118.70 127.99 1lwt s GLU 160 Ca -0.01 1.52 -0.13 0.00 0.02 0.00 0.00 54.97 56.37 1lwt s GLU 160 Cb -0.02 -3.33 0.22 0.00 0.10 0.00 0.00 34.13 31.10 1lwt s GLU 160 CO 0.01 0.25 1.27 0.00 0.02 0.00 0.00 175.26 176.81 1lwt n ALA 161 N 2.38 -0.06 0.20 5.21 0.00 -1.09 0.14 120.51 127.29 1lwt n ALA 161 Ca 0.01 0.83 0.12 0.00 0.00 0.00 0.00 53.44 54.40 1lwt n ALA 161 Cb 0.48 -0.39 0.64 0.00 0.00 0.00 0.00 19.45 20.18 1lwt n ALA 161 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1lwt h ARG 162 N 0.00 0.00 0.00 0.00 0.11 -1.63 0.42 114.38 113.28 1lwt h ARG 162 Ca 0.30 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.38 1lwt h ARG 162 Cb 0.51 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.59 1lwt h ARG 162 CO -0.82 0.00 -1.14 -0.25 0.10 0.00 0.00 179.97 177.86 1lwt n ASP 163 N -2.36 0.79 -0.32 0.08 8.00 0.36 -4.59 116.55 118.52 1lwt n ASP 163 Ca -0.02 -0.76 0.25 0.00 0.71 0.00 0.00 54.79 54.98 1lwt n ASP 163 Cb 0.11 1.12 0.56 0.00 -0.02 0.00 0.00 41.12 42.89 1lwt n ASP 163 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1lwt h LEU 164 N 0.00 0.34 -1.33 0.64 5.85 -0.58 0.17 115.31 120.41 1lwt h LEU 164 Ca 0.00 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 1lwt h LEU 164 Cb 0.59 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1lwt h LEU 164 CO 0.00 0.06 -0.33 -1.28 -0.34 0.00 0.00 178.44 176.55 1lwt h SER 165 N 0.30 0.00 -0.46 1.25 0.87 -1.81 0.04 113.55 113.75 1lwt h SER 165 Ca 0.58 -0.00 0.13 0.00 -1.23 0.00 0.00 61.79 61.28 1lwt h SER 165 Cb 1.66 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.60 1lwt h SER 165 CO -0.23 0.34 0.51 -0.07 -0.53 0.00 0.00 176.83 176.85 1lwt h LEU 166 N 0.00 0.00 -9.82 2.23 4.07 -0.97 -3.41 115.31 107.41 1lwt h LEU 166 Ca -0.00 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.44 1lwt h LEU 166 Cb 0.59 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.36 1lwt h LEU 166 CO 0.04 0.00 0.54 -0.76 -1.08 0.00 0.00 178.44 177.18 1lwt s LEU 167 N -7.30 4.50 0.96 1.67 1.43 -0.00 -5.00 118.68 114.94 1lwt s LEU 167 Ca -0.04 2.42 -0.12 0.00 -1.03 0.00 0.00 54.13 55.36 1lwt s LEU 167 Cb 0.15 -3.63 0.17 0.00 0.03 0.00 0.00 46.19 42.91 1lwt s LEU 167 CO 0.53 -0.30 1.09 -0.83 0.23 0.00 0.00 176.35 177.07 1lwt s GLY 168 N -0.65 1.59 0.03 -3.19 0.00 -1.26 -4.68 107.32 99.16 1lwt s GLY 168 Ca 0.47 -0.18 -0.11 0.00 0.00 0.00 0.00 44.72 44.90 1lwt s GLY 168 CO 0.45 0.38 1.18 1.76 0.00 0.00 0.00 173.10 176.86 1lwt h SER 169 N -1.80 -0.47 -0.67 1.64 0.02 -1.94 0.38 113.55 110.71 1lwt h SER 169 Ca -0.53 0.04 0.14 0.00 -0.84 0.00 0.00 61.79 60.61 1lwt h SER 169 Cb 1.31 0.16 -0.11 0.00 0.14 0.00 0.00 62.40 63.90 1lwt h SER 169 CO 0.55 -0.20 0.04 0.45 -1.14 0.00 0.00 176.83 176.53 1lwt h HIS 170 N -0.28 0.02 -0.10 3.45 3.86 -2.00 -1.02 115.15 119.06 1lwt h HIS 170 Ca -0.01 0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1lwt h HIS 170 Cb 0.26 0.10 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 1lwt h HIS 170 CO -0.22 -0.17 0.05 0.28 0.86 0.00 0.00 177.93 178.73 1lwt h VAL 171 N 0.14 1.13 -0.09 2.45 2.07 -1.91 -2.23 116.25 117.82 1lwt h VAL 171 Ca 0.36 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1lwt h VAL 171 Cb 0.60 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.51 1lwt h VAL 171 CO -0.56 0.12 -0.47 -0.09 0.02 0.00 0.00 177.57 176.59 1lwt h ARG 172 N 0.03 -0.53 -0.65 1.57 9.65 0.34 -1.28 114.38 123.50 1lwt h ARG 172 Ca 0.04 0.04 0.09 0.00 -1.10 0.00 0.00 59.98 59.04 1lwt h ARG 172 Cb 0.15 0.12 -0.07 0.00 -1.39 0.00 0.00 29.97 28.78 1lwt h ARG 172 CO -0.00 -0.36 0.28 -0.22 2.80 0.00 0.00 179.97 182.47 1lwt h LYS 173 N -0.55 0.48 -1.13 0.20 3.64 -1.31 0.07 116.57 117.97 1lwt h LYS 173 Ca 0.05 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1lwt h LYS 173 Cb 0.66 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1lwt h LYS 173 CO -0.39 0.32 0.00 0.00 -2.27 0.00 0.00 179.45 177.11 1lwt n ALA 174 N -2.43 2.38 -3.42 5.00 0.00 -0.51 -4.75 120.51 116.78 1lwt n ALA 174 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.27 1lwt n ALA 174 Cb 0.26 -1.00 -0.17 0.00 0.00 0.00 0.00 19.45 18.55 1lwt n ALA 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1lwt s THR 175 N 0.12 1.32 0.31 0.00 2.01 0.01 -4.08 115.64 115.32 1lwt s THR 175 Ca 0.00 -0.58 0.03 0.00 0.31 0.00 0.00 61.69 61.44 1lwt s THR 175 Cb 0.00 -1.18 -0.05 0.00 0.01 0.00 0.00 72.50 71.28 1lwt s THR 175 CO 0.00 0.40 0.10 -0.72 -0.69 0.00 0.00 174.62 173.70 1lwt s TYR 176 N 0.61 1.72 0.42 4.92 1.13 -1.06 -4.56 117.35 120.53 1lwt s TYR 176 Ca -0.15 -1.15 0.07 0.00 -1.41 0.00 0.00 57.07 54.43 1lwt s TYR 176 Cb -0.16 -1.05 -0.06 0.00 -1.10 0.00 0.00 41.96 39.58 1lwt s TYR 176 CO 0.05 -0.25 0.08 -0.65 -2.51 0.00 0.00 175.55 172.27 1lwt s GLN 177 N -3.91 2.08 0.15 -3.49 -0.21 -0.30 -1.65 119.66 112.33 1lwt s GLN 177 Ca 0.35 -2.02 0.01 0.00 0.02 0.00 0.00 55.36 53.73 1lwt s GLN 177 Cb 0.07 -1.78 -0.04 0.00 1.00 0.00 0.00 33.01 32.26 1lwt s GLN 177 CO 0.15 -0.10 0.00 0.95 -2.12 0.00 0.00 175.29 174.17 1lwt s THR 178 N -2.68 0.57 0.22 -0.19 -4.23 -1.26 0.38 115.64 108.45 1lwt s THR 178 Ca 0.36 -1.96 0.09 0.00 -1.18 0.00 0.00 61.69 59.00 1lwt s THR 178 Cb 0.07 -2.03 -0.05 0.00 1.34 0.00 0.00 72.50 71.83 1lwt s THR 178 CO 0.19 -0.54 -0.16 -0.72 -0.54 0.00 0.00 174.62 172.85 1lwt s TYR 179 N -3.73 1.85 0.17 3.99 -0.85 0.28 0.08 117.35 119.15 1lwt s TYR 179 Ca 0.22 -0.51 0.09 0.00 -0.52 0.00 0.00 57.07 56.35 1lwt s TYR 179 Cb 0.06 -0.85 -0.04 0.00 0.38 0.00 0.00 41.96 41.51 1lwt s TYR 179 CO 0.02 0.43 -0.19 0.00 -1.52 0.00 0.00 175.55 174.29 1lwt s ALA 180 N -2.75 2.13 0.55 9.51 0.00 -0.18 -1.64 121.76 129.39 1lwt s ALA 180 Ca 0.23 -1.53 -0.18 0.00 0.00 0.00 0.00 51.96 50.48 1lwt s ALA 180 Cb -0.02 -0.21 -0.05 0.00 0.00 0.00 0.00 23.12 22.83 1lwt s ALA 180 CO 0.09 0.27 1.09 -1.25 0.00 0.00 0.00 175.76 175.96 1lwt s PRO 181 N -2.80 3.39 -1.06 0.00 0.04 -1.26 -4.85 135.00 128.46 1lwt s PRO 181 Ca 0.17 1.45 -0.23 0.00 0.04 0.00 0.00 61.00 62.43 1lwt s PRO 181 Cb -0.06 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1lwt s PRO 181 CO 0.07 -0.79 1.83 0.42 0.04 0.00 0.00 177.00 178.57 1lwt s ILE 182 N -2.02 3.65 -0.05 0.56 -1.09 0.12 -4.75 121.20 117.62 1lwt s ILE 182 Ca 0.69 -0.80 0.20 0.00 -2.23 0.00 0.00 60.65 58.51 1lwt s ILE 182 Cb -0.20 -4.51 0.18 0.00 -1.58 0.00 0.00 42.46 36.34 1lwt s ILE 182 CO 0.29 -1.28 1.65 -0.07 -1.23 0.00 0.00 174.94 174.30 1lwt h LEU 183 N 16.23 0.00 -9.93 2.97 3.38 -1.87 -3.45 115.31 122.64 1lwt h LEU 183 Ca 0.20 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.69 1lwt h LEU 183 Cb 0.97 0.00 0.22 0.00 0.09 0.00 0.00 40.66 41.94 1lwt h LEU 183 CO 1.29 0.31 -0.44 0.00 0.09 0.00 0.00 178.44 179.68 1lwt n TYR 184 N -3.29 -1.04 -3.34 1.13 9.36 -1.26 -4.94 117.16 113.78 1lwt n TYR 184 Ca 0.01 0.10 -0.09 0.00 3.32 0.00 0.00 57.90 61.25 1lwt n TYR 184 Cb 0.56 -1.72 -0.08 0.00 -0.63 0.00 0.00 39.34 37.48 1lwt n TYR 184 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1lwt s GLU 185 N -3.97 0.35 0.00 2.98 2.02 -1.25 -4.70 118.70 114.13 1lwt s GLU 185 Ca 0.62 0.55 0.00 0.00 0.02 0.00 0.00 54.97 56.16 1lwt s GLU 185 Cb -0.20 -0.45 0.00 0.00 0.10 0.00 0.00 34.13 33.58 1lwt s GLU 185 CO 0.65 -0.64 0.00 0.09 0.02 0.00 0.00 175.26 175.38 1lwt n ASN 186 N 5.37 0.00 -0.69 -0.19 4.13 -0.05 -4.82 115.26 119.01 1lwt n ASN 186 Ca -0.04 -0.88 -0.00 0.00 1.68 0.00 0.00 54.58 55.34 1lwt n ASN 186 Cb 0.50 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.74 1lwt n ASN 186 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1lwt n ASP 187 N -2.65 0.04 -0.31 6.41 2.03 -1.26 -3.03 116.55 117.77 1lwt n ASP 187 Ca 0.00 -1.68 0.17 0.00 0.52 0.00 0.00 54.79 53.79 1lwt n ASP 187 Cb 0.00 -0.10 0.34 0.00 -0.72 0.00 0.00 41.12 40.64 1lwt n ASP 187 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 1lwt h HIS 188 N 0.14 0.34 0.28 -0.67 -0.00 -1.95 0.68 115.15 113.97 1lwt h HIS 188 Ca -0.09 0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.34 1lwt h HIS 188 Cb 1.34 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.73 1lwt h HIS 188 CO -0.04 -0.30 -0.30 0.35 -0.00 0.00 0.00 177.93 177.64 1lwt h PHE 189 N 0.13 -0.80 0.33 5.26 3.57 -1.95 0.97 116.94 124.45 1lwt h PHE 189 Ca 0.61 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 62.11 1lwt h PHE 189 Cb 1.33 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 40.38 1lwt h PHE 189 CO -0.28 -0.43 -0.21 0.35 -2.23 0.00 0.00 178.31 175.52 1lwt h PHE 190 N -0.62 -0.54 -0.84 0.41 3.04 -0.25 -2.75 116.94 115.39 1lwt h PHE 190 Ca -0.01 -0.01 0.08 0.00 3.98 0.00 0.00 57.97 62.02 1lwt h PHE 190 Cb 0.57 0.19 -0.07 0.00 2.56 0.00 0.00 35.95 39.21 1lwt h PHE 190 CO -0.19 -0.32 0.50 -0.44 -2.02 0.00 0.00 178.31 175.83 1lwt h ASP 191 N -0.51 0.75 0.00 0.41 3.32 -0.29 -0.42 116.42 119.68 1lwt h ASP 191 Ca -0.03 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1lwt h ASP 191 Cb 0.43 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1lwt h ASP 191 CO 0.03 0.45 0.00 0.00 -1.72 0.00 0.00 179.24 178.00 1lwt n TYR 192 N -4.69 0.00 0.00 4.55 9.36 0.33 0.09 117.16 126.79 1lwt n TYR 192 Ca 0.13 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.35 1lwt n TYR 192 Cb 0.23 -0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.94 1lwt n TYR 192 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1lwt n GLN 194 N 0.40 0.00 0.00 2.98 1.13 -0.17 -2.84 117.38 118.89 1lwt n GLN 194 Ca 0.00 0.00 0.02 0.00 -1.94 0.00 0.00 57.00 55.08 1lwt n GLN 194 Cb 0.00 0.00 0.10 0.00 0.11 0.00 0.00 30.24 30.45 1lwt n GLN 194 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1lwt n LYS 195 N 0.00 0.14 -4.51 -1.09 4.81 0.11 -4.78 118.16 112.84 1lwt n LYS 195 Ca 0.00 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.18 1lwt n LYS 195 Cb 0.00 -1.37 -0.10 0.00 0.02 0.00 0.00 35.03 33.58 1lwt n LYS 195 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1lwt s SER 196 N -1.96 3.86 0.09 3.14 0.01 -1.13 -5.06 113.70 112.65 1lwt s SER 196 Ca 0.05 -1.19 -0.30 0.00 1.31 0.00 0.00 55.95 55.82 1lwt s SER 196 Cb 0.02 -0.39 -0.13 0.00 0.21 0.00 0.00 66.02 65.73 1lwt s SER 196 CO 0.04 -0.27 1.48 0.07 0.41 0.00 0.00 173.24 174.98 1lwt h LYS 197 N 1.92 -0.64 -6.42 12.44 2.10 -1.95 -3.42 116.57 120.60 1lwt h LYS 197 Ca -0.43 0.04 -0.61 0.00 -2.00 0.00 0.00 60.65 57.66 1lwt h LYS 197 Cb 1.25 0.15 0.12 0.00 -0.90 0.00 0.00 32.23 32.84 1lwt h LYS 197 CO 0.72 -0.43 -0.02 1.19 -2.00 0.00 0.00 179.45 178.91 1lwt n PHE 198 N -5.09 0.80 -3.60 0.07 3.01 -1.26 -4.96 117.46 106.44 1lwt n PHE 198 Ca -0.07 0.70 -0.29 0.00 1.01 0.00 0.00 57.45 58.80 1lwt n PHE 198 Cb 0.36 -2.18 -0.15 0.00 -0.01 0.00 0.00 39.48 37.50 1lwt n PHE 198 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 1lwt s HIS 199 N -1.14 0.65 0.08 1.38 3.76 -1.26 -4.93 115.29 113.83 1lwt s HIS 199 Ca 0.60 -1.04 0.01 0.00 -0.15 0.00 0.00 55.06 54.49 1lwt s HIS 199 Cb -0.69 -1.08 0.01 0.00 1.11 0.00 0.00 32.58 31.93 1lwt s HIS 199 CO 0.59 -0.81 0.09 1.28 -0.85 0.00 0.00 174.74 175.04 1lwt n LEU 200 N 5.15 0.00 0.00 0.89 4.77 -1.26 -5.13 117.00 121.42 1lwt n LEU 200 Ca -0.05 -0.35 -0.14 0.00 -0.03 0.00 0.00 56.01 55.43 1lwt n LEU 200 Cb 0.43 -0.04 0.11 0.00 -2.33 0.00 0.00 43.42 41.58 1lwt n LEU 200 CO 0.06 -0.45 0.38 0.35 -1.33 0.00 0.00 177.39 176.40 1lwt n THR 201 N -1.01 0.00 0.14 -5.08 -2.24 -1.26 -4.91 114.28 99.92 1lwt n THR 201 Ca 0.01 -0.39 -0.09 0.00 -2.27 0.00 0.00 64.05 61.31 1lwt n THR 201 Cb 0.08 -1.56 0.07 0.00 -2.10 0.00 0.00 70.33 66.82 1lwt n THR 201 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1lwt n ILE 202 N -3.12 1.85 0.15 2.28 2.08 -1.26 -2.82 119.36 118.51 1lwt n ILE 202 Ca 0.08 -0.74 0.02 0.00 0.56 0.00 0.00 62.75 62.67 1lwt n ILE 202 Cb 0.28 -0.82 0.01 0.00 -0.75 0.00 0.00 39.64 38.36 1lwt n ILE 202 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1lwt n GLU 203 N -0.09 0.26 0.00 0.38 1.02 -1.26 -4.79 120.64 116.17 1lwt n GLU 203 Ca 0.22 -0.63 0.00 0.00 -0.02 0.00 0.00 57.16 56.73 1lwt n GLU 203 Cb 0.92 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 31.32 1lwt n GLU 203 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lwt n GLY 204 N 0.31 -2.70 0.44 0.62 0.00 -1.13 0.50 105.19 103.23 1lwt n GLY 204 Ca 0.02 0.07 0.37 0.00 0.00 0.00 0.00 46.02 46.48 1lwt n GLY 204 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1lwt n PRO 205 N -1.54 -0.03 0.02 1.61 -0.02 -1.26 0.16 135.00 133.93 1lwt n PRO 205 Ca 0.00 1.13 -0.01 0.00 -2.02 0.00 0.00 63.50 62.60 1lwt n PRO 205 Cb 0.00 -2.25 -0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1lwt n PRO 205 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1lwt h LYS 206 N 0.00 -0.05 -0.34 -0.52 3.64 -1.81 -2.40 116.57 115.09 1lwt h LYS 206 Ca 0.80 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 60.22 1lwt h LYS 206 Cb 2.62 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 34.42 1lwt h LYS 206 CO -0.41 -0.04 0.14 -0.39 -2.27 0.00 0.00 179.45 176.49 1lwt h VAL 207 N -0.14 0.94 -0.09 2.00 -1.51 0.20 0.26 116.25 117.91 1lwt h VAL 207 Ca -0.01 -0.10 0.04 0.00 -1.23 0.00 0.00 66.70 65.40 1lwt h VAL 207 Cb 0.04 0.61 -0.05 0.00 -2.13 0.00 0.00 31.29 29.76 1lwt h VAL 207 CO 0.01 0.06 -0.20 0.25 -1.23 0.00 0.00 177.57 176.46 1lwt h LEU 208 N 0.31 -0.61 -0.49 4.19 5.85 0.13 0.23 115.31 124.92 1lwt h LEU 208 Ca 0.15 0.10 0.10 0.00 0.84 0.00 0.00 57.88 59.06 1lwt h LEU 208 Cb 0.10 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.31 1lwt h LEU 208 CO -0.13 -0.25 -0.03 0.00 -0.34 0.00 0.00 178.44 177.69 1lwt h ALA 209 N 0.69 0.43 -0.82 1.25 0.00 -0.82 0.41 119.26 120.41 1lwt h ALA 209 Ca 0.09 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1lwt h ALA 209 Cb 0.40 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1lwt h ALA 209 CO -0.25 -0.40 0.53 -0.92 0.00 0.00 0.00 179.25 178.21 1lwt h TYR 210 N 0.09 1.05 -0.49 0.00 3.20 0.50 -2.11 116.97 119.20 1lwt h TYR 210 Ca 0.25 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 62.00 1lwt h TYR 210 Cb 0.37 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 1lwt h TYR 210 CO -0.33 0.68 -0.20 -0.07 -1.64 0.00 0.00 178.16 176.60 1lwt h LEU 211 N 1.12 1.03 -1.93 2.82 -0.00 0.75 -1.88 115.31 117.22 1lwt h LEU 211 Ca 0.30 -0.39 -0.00 0.00 -0.00 0.00 0.00 57.88 57.79 1lwt h LEU 211 Cb -0.10 -0.28 -0.00 0.00 -0.00 0.00 0.00 40.66 40.28 1lwt h LEU 211 CO -0.06 1.19 0.00 -0.07 -0.00 0.00 0.00 178.44 179.50 1lwt h LEU 212 N 0.86 0.04 -0.11 1.67 3.38 -0.73 0.15 115.31 120.56 1lwt h LEU 212 Ca 0.12 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1lwt h LEU 212 Cb 0.78 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1lwt h LEU 212 CO 0.06 0.05 -0.05 1.23 0.09 0.00 0.00 178.44 179.82 1lwt h GLY 213 N 0.10 0.25 1.07 0.83 0.00 -0.75 -1.93 103.07 102.64 1lwt h GLY 213 Ca 0.01 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.02 1lwt h GLY 213 CO -0.00 0.20 -0.02 -2.00 0.00 0.00 0.00 176.54 174.73 1lwt h LEU 214 N -0.12 1.02 -0.02 3.11 7.12 -0.53 -2.47 115.31 123.42 1lwt h LEU 214 Ca 0.03 -0.31 0.00 0.00 0.13 0.00 0.00 57.88 57.72 1lwt h LEU 214 Cb 0.50 -0.27 -0.00 0.00 -0.53 0.00 0.00 40.66 40.36 1lwt h LEU 214 CO 0.02 1.08 0.01 -0.25 -0.13 0.00 0.00 178.44 179.17 1lwt h TRP 215 N 0.92 0.02 -0.82 1.25 7.01 -0.73 0.52 115.95 124.12 1lwt h TRP 215 Ca 0.16 0.00 0.16 0.00 2.11 0.00 0.00 58.89 61.33 1lwt h TRP 215 Cb 0.57 -0.01 -0.10 0.00 -2.10 0.00 0.00 29.16 27.52 1lwt h TRP 215 CO 0.04 0.03 0.36 0.82 -2.79 0.00 0.00 178.44 176.90 1lwt h ILE 216 N 0.01 0.63 0.05 2.65 1.08 -1.25 0.79 117.51 121.47 1lwt h ILE 216 Ca 0.01 -0.17 -0.00 0.00 -0.39 0.00 0.00 64.86 64.31 1lwt h ILE 216 Cb 0.01 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 33.86 1lwt h ILE 216 CO -0.00 0.09 -0.03 1.23 -0.69 0.00 0.00 178.15 178.75 1lwt h GLY 217 N 0.49 -0.08 -1.50 5.37 0.00 -1.05 -3.40 103.07 102.90 1lwt h GLY 217 Ca 0.47 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1lwt h GLY 217 CO -0.43 -0.03 0.00 1.22 0.00 0.00 0.00 176.54 177.31 1lwt n ASP 218 N -3.06 2.72 -3.73 0.19 8.00 0.17 -4.81 116.55 116.03 1lwt n ASP 218 Ca -0.01 -1.80 -0.30 0.00 0.71 0.00 0.00 54.79 53.40 1lwt n ASP 218 Cb 0.03 -0.13 0.27 0.00 -0.02 0.00 0.00 41.12 41.27 1lwt n ASP 218 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1lwt s GLY 219 N -1.21 1.46 0.03 0.44 0.00 0.28 -1.90 107.32 106.42 1lwt s GLY 219 Ca 0.24 -0.69 0.05 0.00 0.00 0.00 0.00 44.72 44.32 1lwt s GLY 219 CO 0.21 0.24 -0.10 1.08 0.00 0.00 0.00 173.10 174.53 1lwt s LEU 220 N -7.58 3.00 -0.02 0.66 1.43 0.04 -4.82 118.68 111.40 1lwt s LEU 220 Ca 0.69 -0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 1lwt s LEU 220 Cb -0.15 -1.75 0.10 0.00 0.03 0.00 0.00 46.19 44.42 1lwt s LEU 220 CO 0.59 0.26 0.85 -1.54 0.23 0.00 0.00 176.35 176.74 1lwt n SER 221 N 1.40 1.17 0.00 2.29 3.41 -1.26 -3.74 113.62 116.88 1lwt n SER 221 Ca -0.15 -2.07 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 1lwt n SER 221 Cb 0.52 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1lwt n SER 221 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1lwt n ASP 222 N -0.04 0.00 -3.68 4.04 5.75 -1.26 -4.99 116.55 116.37 1lwt n ASP 222 Ca 0.04 -1.00 -0.15 0.00 -0.01 0.00 0.00 54.79 53.67 1lwt n ASP 222 Cb 0.25 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.26 1lwt n ASP 222 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1lwt s ARG 223 N 0.00 0.75 -0.94 0.11 0.52 -1.25 -5.04 118.95 113.11 1lwt s ARG 223 Ca 0.00 0.19 -0.08 0.00 -0.52 0.00 0.00 55.73 55.32 1lwt s ARG 223 Cb 0.00 0.35 -0.16 0.00 0.52 0.00 0.00 34.95 35.66 1lwt s ARG 223 CO 0.00 -0.19 3.14 0.00 0.02 0.00 0.00 175.30 178.27 1lwt n ALA 224 N 1.64 6.87 -2.28 2.13 0.00 -1.26 -4.12 120.51 123.48 1lwt n ALA 224 Ca -0.18 -2.74 -0.08 0.00 0.00 0.00 0.00 53.44 50.44 1lwt n ALA 224 Cb 0.56 -2.93 -0.10 0.00 0.00 0.00 0.00 19.45 16.98 1lwt n ALA 224 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1lwt s THR 225 N 1.80 0.29 0.21 0.00 -1.32 -1.26 -3.11 115.64 112.25 1lwt s THR 225 Ca 0.66 -1.65 -0.21 0.00 -1.21 0.00 0.00 61.69 59.28 1lwt s THR 225 Cb 0.23 -1.29 0.04 0.00 -1.51 0.00 0.00 72.50 69.97 1lwt s THR 225 CO -0.03 -0.87 0.63 0.72 -2.21 0.00 0.00 174.62 172.86 1lwt s PHE 226 N -3.35 -0.34 0.70 9.09 -0.12 -1.19 -0.78 117.98 121.98 1lwt s PHE 226 Ca 0.03 0.02 -0.07 0.00 -0.05 0.00 0.00 56.93 56.86 1lwt s PHE 226 Cb 0.04 0.59 0.05 0.00 -0.63 0.00 0.00 43.02 43.07 1lwt s PHE 226 CO -0.07 -1.01 1.02 -1.12 -0.05 0.00 0.00 175.22 173.99 1lwt s SER 227 N -2.83 4.93 0.19 1.98 0.01 -0.80 -2.14 113.70 115.05 1lwt s SER 227 Ca 0.06 0.56 -0.22 0.00 1.31 0.00 0.00 55.95 57.66 1lwt s SER 227 Cb -0.03 -1.25 0.05 0.00 0.21 0.00 0.00 66.02 65.00 1lwt s SER 227 CO -0.04 -1.53 0.61 -0.69 0.41 0.00 0.00 173.24 172.00 1lwt s VAL 228 N -3.25 0.01 -0.64 3.43 1.01 0.47 -4.86 120.40 116.56 1lwt s VAL 228 Ca 0.59 -0.35 -0.21 0.00 0.00 0.00 0.00 61.98 62.01 1lwt s VAL 228 Cb -0.11 -1.31 0.09 0.00 0.00 0.00 0.00 36.38 35.05 1lwt s VAL 228 CO 0.46 -0.03 0.87 -0.62 0.00 0.00 0.00 175.10 175.78 1lwt s ASP 229 N -2.81 6.19 0.52 3.32 -1.08 -1.26 -2.13 116.67 119.42 1lwt s ASP 229 Ca 0.04 -1.20 0.00 0.00 -0.52 0.00 0.00 52.55 50.87 1lwt s ASP 229 Cb -0.02 -2.37 0.00 0.00 -1.46 0.00 0.00 42.92 39.07 1lwt s ASP 229 CO -0.07 -1.30 0.85 -1.54 0.52 0.00 0.00 175.17 173.63 1lwt n SER 230 N 7.13 0.00 0.00 -0.34 3.41 -1.26 0.06 113.62 122.62 1lwt n SER 230 Ca -0.05 0.39 -0.17 0.00 -0.26 0.00 0.00 58.87 58.79 1lwt n SER 230 Cb 0.44 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.25 1lwt n SER 230 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1lwt h ARG 231 N 0.00 0.18 -6.49 4.33 1.12 -2.02 -3.44 114.38 108.07 1lwt h ARG 231 Ca 0.00 -0.31 -0.55 0.00 -1.11 0.00 0.00 59.98 58.01 1lwt h ARG 231 Cb 1.70 0.12 -0.07 0.00 -0.01 0.00 0.00 29.97 31.71 1lwt h ARG 231 CO 0.00 0.98 1.02 0.34 -3.11 0.00 0.00 179.97 179.20 1lwt s ASP 232 N -6.73 6.31 0.03 -3.80 -1.08 0.11 -4.83 116.67 106.67 1lwt s ASP 232 Ca -0.16 -0.02 -0.18 0.00 -0.52 0.00 0.00 52.55 51.68 1lwt s ASP 232 Cb 0.07 -2.55 -0.23 0.00 -1.46 0.00 0.00 42.92 38.75 1lwt s ASP 232 CO 0.80 -1.63 1.13 0.74 0.52 0.00 0.00 175.17 176.73 1lwt h THR 233 N 6.16 1.38 -0.74 1.71 2.02 -1.84 -3.28 112.91 118.33 1lwt h THR 233 Ca -0.26 -2.11 0.14 0.00 0.77 0.00 0.00 66.41 64.95 1lwt h THR 233 Cb 1.06 2.51 -0.09 0.00 -1.74 0.00 0.00 68.15 69.89 1lwt h THR 233 CO 1.21 0.63 0.29 0.28 0.37 0.00 0.00 175.52 178.30 1lwt h SER 234 N 0.05 0.28 0.00 4.18 0.02 -1.88 -1.08 113.55 115.12 1lwt h SER 234 Ca -0.09 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1lwt h SER 234 Cb 1.41 0.08 0.00 0.00 0.14 0.00 0.00 62.40 64.03 1lwt h SER 234 CO 0.14 0.11 0.00 -0.11 -1.14 0.00 0.00 176.83 175.83 1lwt n LEU 235 N -5.00 0.14 0.00 5.07 7.94 -1.24 -2.14 117.00 121.78 1lwt n LEU 235 Ca 0.14 -0.07 0.00 0.00 -1.11 0.00 0.00 56.01 54.97 1lwt n LEU 235 Cb 0.40 -0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.31 1lwt n LEU 235 CO 0.19 0.03 0.00 -0.62 -1.11 0.00 0.00 177.39 175.87 1lwt n GLU 237 N 0.75 0.00 -0.32 1.96 1.02 -0.41 -1.37 120.64 122.26 1lwt n GLU 237 Ca 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.16 1lwt n GLU 237 Cb 0.03 0.00 0.09 0.00 -0.02 0.00 0.00 31.44 31.53 1lwt n GLU 237 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1lwt h ARG 238 N 0.00 -0.02 -0.01 3.49 9.65 -1.70 0.35 114.38 126.14 1lwt h ARG 238 Ca 0.00 0.00 0.01 0.00 -1.10 0.00 0.00 59.98 58.89 1lwt h ARG 238 Cb 0.00 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.56 1lwt h ARG 238 CO 0.00 -0.01 -0.23 0.28 2.80 0.00 0.00 179.97 182.81 1lwt h VAL 239 N -0.02 0.00 -0.26 0.20 2.07 -1.51 0.34 116.25 117.07 1lwt h VAL 239 Ca 0.39 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.95 1lwt h VAL 239 Cb 0.63 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.34 1lwt h VAL 239 CO -0.92 0.00 -0.47 0.74 0.02 0.00 0.00 177.57 176.94 1lwt h THR 240 N -0.29 0.00 -0.28 2.57 2.02 -1.10 0.23 112.91 116.05 1lwt h THR 240 Ca 0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.22 1lwt h THR 240 Cb 0.31 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.67 1lwt h THR 240 CO -0.16 0.00 -0.35 -0.08 0.37 0.00 0.00 175.52 175.30 1lwt h GLU 241 N -0.40 -0.22 -0.45 6.66 4.81 -0.10 0.77 114.58 125.65 1lwt h GLU 241 Ca 0.05 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1lwt h GLU 241 Cb 0.54 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.92 1lwt h GLU 241 CO -0.46 -0.15 0.18 1.88 -0.73 0.00 0.00 179.01 179.73 1lwt h TYR 242 N -0.23 0.31 -0.76 0.92 -1.99 -0.17 -0.40 116.97 114.66 1lwt h TYR 242 Ca 0.05 0.02 0.09 0.00 2.00 0.00 0.00 58.73 60.89 1lwt h TYR 242 Cb 0.36 -0.07 -0.07 0.00 2.00 0.00 0.00 36.73 38.95 1lwt h TYR 242 CO -0.70 0.13 0.42 0.00 -0.00 0.00 0.00 178.16 178.00 1lwt h ALA 243 N 1.28 1.06 -0.53 3.88 0.00 0.41 -1.57 119.26 123.79 1lwt h ALA 243 Ca 0.21 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1lwt h ALA 243 Cb 0.19 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1lwt h ALA 243 CO -0.20 0.05 0.26 1.49 0.00 0.00 0.00 179.25 180.85 1lwt h GLU 244 N 0.72 0.77 0.00 0.00 4.57 0.15 -1.96 114.58 118.82 1lwt h GLU 244 Ca 0.36 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.41 1lwt h GLU 244 Cb 0.32 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1lwt h GLU 244 CO -0.24 0.63 -0.10 0.87 -1.18 0.00 0.00 179.01 178.99 1lwt h LYS 245 N 0.71 0.00 -0.00 1.92 1.57 -0.14 0.79 116.57 121.42 1lwt h LYS 245 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1lwt h LYS 245 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1lwt h LYS 245 CO -0.02 0.10 -0.02 1.28 -0.57 0.00 0.00 179.45 180.22 1lwt n LEU 246 N -4.28 0.09 -2.21 2.94 4.77 -0.87 -4.69 117.00 112.74 1lwt n LEU 246 Ca -0.03 0.20 -0.05 0.00 -0.03 0.00 0.00 56.01 56.10 1lwt n LEU 246 Cb 0.18 -0.23 0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1lwt n LEU 246 CO 0.34 0.02 0.03 -3.20 -1.33 0.00 0.00 177.39 173.25 1lwt n ASN 247 N -1.19 -4.01 -3.15 -1.43 5.15 0.27 -4.92 115.26 105.98 1lwt n ASN 247 Ca 0.15 -0.25 -0.17 0.00 -0.60 0.00 0.00 54.58 53.71 1lwt n ASN 247 Cb 0.23 -2.51 -0.05 0.00 -0.53 0.00 0.00 39.78 36.92 1lwt n ASN 247 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1lwt n LEU 248 N -2.07 0.00 -4.56 1.20 4.77 -0.77 -4.45 117.00 111.13 1lwt n LEU 248 Ca -0.02 -3.06 -0.30 0.00 -0.03 0.00 0.00 56.01 52.60 1lwt n LEU 248 Cb 0.54 2.22 -0.10 0.00 -2.33 0.00 0.00 43.42 43.75 1lwt n LEU 248 CO 0.24 -0.61 -0.44 0.00 -1.33 0.00 0.00 177.39 175.25 1lwt s ALA 250 N -1.20 3.27 -1.17 0.00 0.00 -1.26 -1.78 121.76 119.61 1lwt s ALA 250 Ca 0.21 -1.89 -0.05 0.00 0.00 0.00 0.00 51.96 50.23 1lwt s ALA 250 Cb -0.11 -2.60 0.24 0.00 0.00 0.00 0.00 23.12 20.65 1lwt s ALA 250 CO 0.13 -1.49 1.87 -1.91 0.00 0.00 0.00 175.76 174.36 1lwt n GLU 251 N 4.96 4.54 -1.64 0.00 4.07 -0.40 -4.91 120.64 127.26 1lwt n GLU 251 Ca -0.11 -4.09 -0.51 0.00 -0.06 0.00 0.00 57.16 52.39 1lwt n GLU 251 Cb 0.45 -2.63 -0.06 0.00 -0.06 0.00 0.00 31.44 29.14 1lwt n GLU 251 CO 0.00 0.00 0.00 2.48 -0.06 0.00 0.00 177.13 179.55 1lwt n TYR 252 N 1.68 1.86 -3.33 4.31 4.11 -1.26 -3.93 117.16 120.61 1lwt n TYR 252 Ca 0.43 0.47 -0.12 0.00 -0.00 0.00 0.00 57.90 58.67 1lwt n TYR 252 Cb 0.30 -2.44 -0.07 0.00 -0.00 0.00 0.00 39.34 37.14 1lwt n TYR 252 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1lwt s LYS 253 N 1.38 0.47 0.10 -3.48 2.36 -0.40 -4.97 119.74 115.19 1lwt s LYS 253 Ca 0.86 -0.18 0.25 0.00 -2.55 0.00 0.00 55.97 54.34 1lwt s LYS 253 Cb -0.88 -0.46 0.45 0.00 -1.05 0.00 0.00 37.83 35.90 1lwt s LYS 253 CO 0.48 -1.08 1.40 -3.47 1.55 0.00 0.00 175.35 174.22 1lwt n ASP 254 N 5.04 0.63 -0.82 1.43 2.03 -1.26 -0.85 116.55 122.75 1lwt n ASP 254 Ca 0.03 0.10 -0.09 0.00 0.52 0.00 0.00 54.79 55.35 1lwt n ASP 254 Cb 0.48 0.08 -0.03 0.00 -0.72 0.00 0.00 41.12 40.94 1lwt n ASP 254 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1lwt n ARG 255 N -1.97 0.00 -3.32 -0.67 3.00 -1.26 -4.54 116.66 107.89 1lwt n ARG 255 Ca 0.04 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.57 1lwt n ARG 255 Cb 0.41 -0.28 0.03 0.00 0.00 0.00 0.00 32.46 32.62 1lwt n ARG 255 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1lwt n LYS 256 N 1.51 -1.61 0.00 -0.14 4.76 -1.26 -5.05 118.16 116.37 1lwt n LYS 256 Ca 0.11 1.10 0.00 0.00 -2.87 0.00 0.00 58.31 56.65 1lwt n LYS 256 Cb 0.00 -1.80 0.00 0.00 -1.84 0.00 0.00 35.03 31.39 1lwt n LYS 256 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1lwt n ALA 261 N -0.72 -1.74 -2.27 7.82 0.00 -1.26 -5.06 120.51 117.29 1lwt n ALA 261 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.89 1lwt n ALA 261 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 1lwt n ALA 261 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1lwt s LYS 262 N 0.00 4.51 -0.10 0.00 2.47 -0.91 -4.72 119.74 120.99 1lwt s LYS 262 Ca 0.00 1.73 0.03 0.00 -1.56 0.00 0.00 55.97 56.17 1lwt s LYS 262 Cb 0.00 -3.32 0.01 0.00 -1.46 0.00 0.00 37.83 33.06 1lwt s LYS 262 CO 0.00 -0.09 -0.21 -0.08 0.16 0.00 0.00 175.35 175.13 1lwt s THR 263 N 0.44 1.85 0.44 3.43 -1.32 -0.03 -0.40 115.64 120.06 1lwt s THR 263 Ca 0.54 -0.88 0.06 0.00 -1.21 0.00 0.00 61.69 60.19 1lwt s THR 263 Cb -0.29 -1.63 -0.04 0.00 -1.51 0.00 0.00 72.50 69.03 1lwt s THR 263 CO 0.32 0.51 0.12 -0.69 -2.21 0.00 0.00 174.62 172.67 1lwt s VAL 264 N 0.56 1.94 -0.16 5.08 1.01 -0.91 -1.28 120.40 126.65 1lwt s VAL 264 Ca -0.14 -1.82 -0.10 0.00 0.00 0.00 0.00 61.98 59.92 1lwt s VAL 264 Cb -0.17 -2.76 0.05 0.00 0.00 0.00 0.00 36.38 33.51 1lwt s VAL 264 CO 0.05 0.00 0.39 0.20 0.00 0.00 0.00 175.10 175.73 1lwt s ASN 265 N -3.88 -0.46 -0.73 3.32 0.01 -1.25 -3.15 114.94 108.80 1lwt s ASN 265 Ca 0.32 0.82 -0.16 0.00 -0.71 0.00 0.00 52.86 53.13 1lwt s ASN 265 Cb 0.05 0.73 0.16 0.00 0.41 0.00 0.00 41.25 42.60 1lwt s ASN 265 CO 0.17 -0.18 0.75 -0.76 -1.51 0.00 0.00 177.10 175.58 1lwt s LEU 266 N 1.08 6.07 0.13 0.60 1.43 -1.18 -1.27 118.68 125.54 1lwt s LEU 266 Ca -0.07 -2.11 -0.22 0.00 -1.03 0.00 0.00 54.13 50.70 1lwt s LEU 266 Cb -0.07 -2.26 -0.07 0.00 0.03 0.00 0.00 46.19 43.81 1lwt s LEU 266 CO -0.09 -0.83 0.68 -0.31 0.23 0.00 0.00 176.35 176.03 1lwt s TYR 267 N 1.43 3.84 0.59 0.29 2.02 -0.74 -4.62 117.35 120.17 1lwt s TYR 267 Ca 0.15 1.46 -0.17 0.00 -0.37 0.00 0.00 57.07 58.14 1lwt s TYR 267 Cb -0.17 -2.64 -0.04 0.00 -0.40 0.00 0.00 41.96 38.72 1lwt s TYR 267 CO -0.03 0.53 1.09 -1.54 -1.57 0.00 0.00 175.55 174.03 1lwt s SER 268 N -1.18 5.66 -0.13 2.29 1.04 -0.83 -0.13 113.70 120.42 1lwt s SER 268 Ca 0.33 1.96 0.06 0.00 0.48 0.00 0.00 55.95 58.79 1lwt s SER 268 Cb -0.21 -2.55 0.39 0.00 0.10 0.00 0.00 66.02 63.75 1lwt s SER 268 CO 0.23 -1.26 1.17 1.17 0.98 0.00 0.00 173.24 175.53 1lwt n LYS 269 N -1.83 2.72 0.00 4.02 0.00 -1.26 -4.67 118.16 117.14 1lwt n LYS 269 Ca 0.10 -1.55 0.00 0.00 0.00 0.00 0.00 58.31 56.86 1lwt n LYS 269 Cb 0.52 -1.83 0.00 0.00 0.00 0.00 0.00 35.03 33.72 1lwt n LYS 269 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1lwt n VAL 270 N 0.21 0.00 -1.80 3.15 0.31 -1.26 -4.92 118.33 114.02 1lwt n VAL 270 Ca 0.16 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.17 1lwt n VAL 270 Cb 0.78 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.75 1lwt n VAL 270 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1lwt s VAL 271 N 0.00 3.51 -0.39 2.52 1.01 -1.26 -4.96 120.40 120.83 1lwt s VAL 271 Ca 0.00 0.67 0.23 0.00 0.00 0.00 0.00 61.98 62.88 1lwt s VAL 271 Cb 0.00 -3.20 0.02 0.00 0.00 0.00 0.00 36.38 33.19 1lwt s VAL 271 CO 0.00 -0.47 1.14 0.08 0.00 0.00 0.00 175.10 175.86 1lwt h ARG 272 N 0.01 0.00 0.00 2.72 -0.00 -1.91 -3.41 114.38 111.78 1lwt h ARG 272 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.52 1lwt h ARG 272 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.20 1lwt h ARG 272 CO 0.55 0.00 0.00 0.41 -0.00 0.00 0.00 179.97 180.93 1lwt n GLY 273 N 1.24 -1.85 0.27 0.08 0.00 -1.26 -2.80 105.19 100.87 1lwt n GLY 273 Ca 0.01 -2.17 0.02 0.00 0.00 0.00 0.00 46.02 43.88 1lwt n GLY 273 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1lwt h ASN 274 N 0.00 0.48 0.00 1.61 -0.73 -1.97 -3.45 115.58 111.52 1lwt h ASN 274 Ca 0.00 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.23 1lwt h ASN 274 Cb 0.00 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.57 1lwt h ASN 274 CO 0.00 0.27 0.00 0.61 -0.37 0.00 0.00 177.43 177.94 1lwt n GLY 275 N -1.30 4.81 3.36 1.57 0.00 -1.26 -5.08 105.19 107.28 1lwt n GLY 275 Ca 0.11 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.96 1lwt n GLY 275 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1lwt s ILE 276 N 2.37 4.26 -0.40 -0.61 1.10 -1.26 -4.71 121.20 121.95 1lwt s ILE 276 Ca 0.00 -0.79 0.06 0.00 -0.51 0.00 0.00 60.65 59.41 1lwt s ILE 276 Cb 0.00 -3.30 0.31 0.00 0.15 0.00 0.00 42.46 39.63 1lwt s ILE 276 CO 0.00 -0.08 1.23 -2.11 -2.11 0.00 0.00 174.94 171.86 1lwt n ARG 277 N 4.92 0.72 -0.74 3.50 0.00 -1.24 -5.10 116.66 118.73 1lwt n ARG 277 Ca -0.13 -1.47 -0.32 0.00 -0.00 0.00 0.00 57.85 55.93 1lwt n ARG 277 Cb 0.47 -0.60 0.13 0.00 -0.00 0.00 0.00 32.46 32.46 1lwt n ARG 277 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1lwt n ASN 278 N 0.25 -2.61 -4.81 2.89 3.02 -1.12 -4.51 115.26 108.36 1lwt n ASN 278 Ca -0.01 -0.13 -0.29 0.00 -0.03 0.00 0.00 54.58 54.12 1lwt n ASN 278 Cb 0.73 -0.80 -0.06 0.00 -0.61 0.00 0.00 39.78 39.05 1lwt n ASN 278 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1lwt s ASN 279 N -1.62 5.70 0.00 6.41 0.01 -1.26 -4.97 114.94 119.21 1lwt s ASN 279 Ca 0.47 0.01 0.00 0.00 -0.71 0.00 0.00 52.86 52.63 1lwt s ASN 279 Cb -0.05 -1.57 0.00 0.00 0.41 0.00 0.00 41.25 40.05 1lwt s ASN 279 CO 0.61 0.14 0.00 0.00 -1.51 0.00 0.00 177.10 176.33 1lwt n LEU 280 N 0.16 0.52 0.04 0.60 -0.00 -1.26 -1.96 117.00 115.10 1lwt n LEU 280 Ca -0.08 0.00 -0.04 0.00 -0.00 0.00 0.00 56.01 55.90 1lwt n LEU 280 Cb 0.52 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.85 1lwt n LEU 280 CO 0.45 0.06 -0.15 0.78 -0.00 0.00 0.00 177.39 178.53 1lwt h ASN 281 N 0.00 0.00 -3.76 1.45 2.35 -1.93 -3.42 115.58 110.27 1lwt h ASN 281 Ca 0.00 0.00 -0.49 0.00 -0.55 0.00 0.00 56.30 55.26 1lwt h ASN 281 Cb 0.19 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 1lwt h ASN 281 CO 0.00 0.77 0.22 -0.89 -1.65 0.00 0.00 177.43 175.88 1lwt s THR 282 N -2.79 4.44 -1.53 2.81 2.01 -1.26 -3.94 115.64 115.38 1lwt s THR 282 Ca -0.02 1.44 -0.06 0.00 0.31 0.00 0.00 61.69 63.37 1lwt s THR 282 Cb 0.09 -3.84 0.05 0.00 0.01 0.00 0.00 72.50 68.81 1lwt s THR 282 CO 0.81 0.06 0.47 -0.62 -0.69 0.00 0.00 174.62 174.65 1lwt n GLU 283 N 0.33 -2.87 -3.88 4.92 -0.58 -1.26 -4.61 120.64 112.69 1lwt n GLU 283 Ca 0.01 0.34 -0.27 0.00 -0.42 0.00 0.00 57.16 56.82 1lwt n GLU 283 Cb 0.51 -4.57 -0.17 0.00 -0.57 0.00 0.00 31.44 26.65 1lwt n GLU 283 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1lwt s ASN 284 N -4.03 2.54 0.24 1.62 3.84 -1.25 -4.74 114.94 113.15 1lwt s ASN 284 Ca 0.24 -0.52 -0.06 0.00 0.21 0.00 0.00 52.86 52.74 1lwt s ASN 284 Cb -0.13 -0.84 0.29 0.00 -0.55 0.00 0.00 41.25 40.02 1lwt s ASN 284 CO 0.92 -0.17 1.87 -0.65 -2.79 0.00 0.00 177.10 176.28 1lwt h PRO 285 N 8.16 1.03 0.00 0.43 0.11 -1.92 0.14 132.00 139.95 1lwt h PRO 285 Ca -0.25 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1lwt h PRO 285 Cb 1.12 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1lwt h PRO 285 CO 0.39 0.68 0.00 -0.11 -0.21 0.00 0.00 178.00 178.75 1lwt n LEU 286 N -4.56 0.00 -0.20 2.35 -0.00 -1.26 -0.49 117.00 112.84 1lwt n LEU 286 Ca 0.12 0.97 -0.02 0.00 -0.00 0.00 0.00 56.01 57.08 1lwt n LEU 286 Cb 0.12 -0.47 0.09 0.00 -0.00 0.00 0.00 43.42 43.15 1lwt n LEU 286 CO 0.33 -0.47 1.03 -0.25 -0.00 0.00 0.00 177.39 178.03 1lwt h TRP 287 N 0.00 0.51 -0.22 1.96 2.91 -1.82 0.61 115.95 119.89 1lwt h TRP 287 Ca 0.00 0.03 0.06 0.00 1.13 0.00 0.00 58.89 60.11 1lwt h TRP 287 Cb 0.00 -0.14 -0.01 0.00 -0.51 0.00 0.00 29.16 28.50 1lwt h TRP 287 CO -0.64 0.21 0.45 0.22 -1.03 0.00 0.00 178.44 177.65 1lwt h ASP 288 N 0.52 0.00 0.00 2.65 1.82 0.22 -2.34 116.42 119.29 1lwt h ASP 288 Ca 0.28 0.00 -0.22 0.00 -0.39 0.00 0.00 57.03 56.70 1lwt h ASP 288 Cb 0.25 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.23 1lwt h ASP 288 CO -0.22 0.00 -1.62 0.00 -1.61 0.00 0.00 179.24 175.79 1lwt n ALA 289 N -2.08 0.96 -0.22 -0.78 0.00 0.35 -1.87 120.51 116.87 1lwt n ALA 289 Ca 0.03 -0.86 0.22 0.00 0.00 0.00 0.00 53.44 52.83 1lwt n ALA 289 Cb 0.57 0.01 0.41 0.00 0.00 0.00 0.00 19.45 20.43 1lwt n ALA 289 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1lwt n ILE 290 N -4.39 -0.28 -0.05 0.00 5.41 -0.20 0.24 119.36 120.09 1lwt n ILE 290 Ca -0.32 1.38 -0.21 0.00 1.00 0.00 0.00 62.75 64.60 1lwt n ILE 290 Cb 0.66 -2.25 -0.13 0.00 -0.71 0.00 0.00 39.64 37.22 1lwt n ILE 290 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1lwt h VAL 291 N 0.00 0.96 -0.01 1.39 2.07 -1.62 0.30 116.25 119.34 1lwt h VAL 291 Ca 0.58 -2.28 0.01 0.00 0.82 0.00 0.00 66.70 65.83 1lwt h VAL 291 Cb 1.55 2.50 -0.02 0.00 -1.52 0.00 0.00 31.29 33.79 1lwt h VAL 291 CO -0.52 0.56 -0.23 1.23 0.02 0.00 0.00 177.57 178.62 1lwt h GLY 292 N -0.30 -1.30 1.52 2.17 0.00 0.38 -2.84 103.07 102.71 1lwt h GLY 292 Ca -0.33 0.64 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1lwt h GLY 292 CO -0.06 -0.41 0.00 1.04 0.00 0.00 0.00 176.54 177.11 1lwt n LEU 293 N -3.79 0.00 0.00 3.11 4.77 0.10 -4.91 117.00 116.29 1lwt n LEU 293 Ca -0.03 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1lwt n LEU 293 Cb 0.17 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1lwt n LEU 293 CO 0.05 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.65 1lwt n GLY 294 N 0.59 1.05 0.00 -0.72 0.00 -1.07 -4.83 105.19 100.21 1lwt n GLY 294 Ca 0.11 -0.50 0.15 0.00 0.00 0.00 0.00 46.02 45.79 1lwt n GLY 294 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1lwt n PHE 295 N -2.60 0.00 -3.26 1.61 3.01 0.10 -3.91 117.46 112.42 1lwt n PHE 295 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.21 1lwt n PHE 295 Cb 0.23 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.62 1lwt n PHE 295 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1lwt n LEU 296 N -0.97 0.71 -4.69 4.37 7.94 -1.01 -1.71 117.00 121.64 1lwt n LEU 296 Ca 0.23 -4.79 -0.42 0.00 -1.11 0.00 0.00 56.01 49.92 1lwt n LEU 296 Cb 0.10 0.41 -0.03 0.00 0.53 0.00 0.00 43.42 44.43 1lwt n LEU 296 CO 0.17 2.04 0.74 -1.59 -1.11 0.00 0.00 177.39 177.64 1lwt s LYS 297 N -1.27 4.42 -1.25 1.96 -2.85 -0.84 -4.22 119.74 115.70 1lwt s LYS 297 Ca 0.35 1.33 -0.22 0.00 -1.00 0.00 0.00 55.97 56.43 1lwt s LYS 297 Cb 0.15 -3.53 0.02 0.00 -2.06 0.00 0.00 37.83 32.41 1lwt s LYS 297 CO -0.10 -0.27 0.62 -0.25 0.10 0.00 0.00 175.35 175.45 1lwt n ASP 298 N 4.85 -3.55 0.00 0.03 9.92 -1.26 -1.84 116.55 124.70 1lwt n ASP 298 Ca 0.07 -1.16 0.00 0.00 -0.53 0.00 0.00 54.79 53.17 1lwt n ASP 298 Cb 0.49 -2.44 0.00 0.00 -0.64 0.00 0.00 41.12 38.53 1lwt n ASP 298 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1lwt n GLY 299 N -1.99 2.46 3.57 0.44 0.00 -1.26 -4.98 105.19 103.43 1lwt n GLY 299 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 1lwt n GLY 299 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lwt s VAL 300 N -0.79 3.27 1.35 1.61 1.01 -0.76 -5.05 120.40 121.04 1lwt s VAL 300 Ca 0.00 -1.43 -0.20 0.00 0.00 0.00 0.00 61.98 60.35 1lwt s VAL 300 Cb 0.00 -2.57 0.34 0.00 0.00 0.00 0.00 36.38 34.15 1lwt s VAL 300 CO 0.00 0.02 0.85 0.29 0.00 0.00 0.00 175.10 176.26 1lwt n LYS 301 N 0.44 -3.90 0.00 2.72 5.02 -1.26 -1.98 118.16 119.20 1lwt n LYS 301 Ca -0.13 -1.14 0.00 0.00 -2.02 0.00 0.00 58.31 55.02 1lwt n LYS 301 Cb 0.54 -1.96 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 1lwt n LYS 301 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1lwt n ASN 302 N -5.13 0.00 -4.47 4.39 5.15 -0.70 -4.54 115.26 109.97 1lwt n ASN 302 Ca 0.09 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.63 1lwt n ASN 302 Cb 0.57 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.75 1lwt n ASN 302 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1lwt s ILE 303 N -1.28 4.91 0.14 -1.44 1.01 -1.26 -4.35 121.20 118.93 1lwt s ILE 303 Ca 0.00 -0.33 -0.31 0.00 0.00 0.00 0.00 60.65 60.01 1lwt s ILE 303 Cb 0.00 -4.23 -0.11 0.00 0.01 0.00 0.00 42.46 38.14 1lwt s ILE 303 CO 0.00 -0.68 1.76 -2.16 0.00 0.00 0.00 174.94 173.86 1lwt s PRO 304 N 2.57 4.15 0.36 2.79 0.04 -1.26 -4.49 135.00 139.15 1lwt s PRO 304 Ca 0.16 2.55 0.10 0.00 0.04 0.00 0.00 61.00 63.86 1lwt s PRO 304 Cb -0.18 -3.43 0.86 0.00 0.04 0.00 0.00 34.50 31.80 1lwt s PRO 304 CO 0.14 -0.79 1.84 0.66 0.04 0.00 0.00 177.00 178.89 1lwt h SER 305 N 7.96 0.63 0.00 6.66 4.64 -1.94 -2.25 113.55 129.25 1lwt h SER 305 Ca -0.45 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1lwt h SER 305 Cb 1.21 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1lwt h SER 305 CO 0.95 0.28 0.31 2.19 -0.87 0.00 0.00 176.83 179.68 1lwt h PHE 306 N 0.64 0.00 0.00 4.77 -5.15 -1.96 0.51 116.94 115.75 1lwt h PHE 306 Ca 0.49 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 58.23 1lwt h PHE 306 Cb 0.88 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.05 1lwt h PHE 306 CO -0.00 0.00 -0.15 1.25 -2.00 0.00 0.00 178.31 177.41 1lwt h LEU 307 N 0.00 0.00 -1.05 2.10 5.85 -1.79 -2.81 115.31 117.61 1lwt h LEU 307 Ca 0.00 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 1lwt h LEU 307 Cb 0.62 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1lwt h LEU 307 CO 0.00 0.15 -0.47 0.28 -0.34 0.00 0.00 178.44 178.06 1lwt h SER 308 N 0.00 0.02 -0.33 1.25 0.02 -1.10 -3.15 113.55 110.26 1lwt h SER 308 Ca -0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1lwt h SER 308 Cb 0.66 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1lwt h SER 308 CO 0.02 0.49 0.00 0.35 -1.14 0.00 0.00 176.83 176.55 1lwt n THR 309 N -3.98 0.62 -0.63 -2.27 -2.24 -1.10 -4.82 114.28 99.86 1lwt n THR 309 Ca -0.02 -0.81 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1lwt n THR 309 Cb 0.49 0.82 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 1lwt n THR 309 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1lwt n ASP 310 N 0.97 0.00 -4.63 3.42 2.03 -1.08 -0.87 116.55 116.39 1lwt n ASP 310 Ca 0.14 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 55.03 1lwt n ASP 310 Cb 0.47 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.85 1lwt n ASP 310 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1lwt s ASN 311 N -1.00 6.35 0.23 1.67 3.84 -1.17 -4.10 114.94 120.76 1lwt s ASN 311 Ca 0.00 1.73 -0.16 0.00 0.21 0.00 0.00 52.86 54.63 1lwt s ASN 311 Cb 0.00 -2.53 0.25 0.00 -0.55 0.00 0.00 41.25 38.41 1lwt s ASN 311 CO 0.00 -1.26 1.57 0.40 -2.79 0.00 0.00 177.10 175.02 1lwt h ILE 312 N 6.13 0.07 -0.48 -5.21 2.04 -1.92 0.36 117.51 118.51 1lwt h ILE 312 Ca -0.35 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.59 1lwt h ILE 312 Cb 1.16 0.07 -0.10 0.00 -0.74 0.00 0.00 36.82 37.22 1lwt h ILE 312 CO 0.99 0.00 -0.39 1.23 0.00 0.00 0.00 178.15 179.98 1lwt h GLY 313 N -0.05 -0.38 0.98 5.37 0.00 -1.99 0.57 103.07 107.57 1lwt h GLY 313 Ca 0.33 0.50 0.01 0.00 0.00 0.00 0.00 47.33 48.18 1lwt h GLY 313 CO -0.89 -0.19 0.32 -0.84 0.00 0.00 0.00 176.54 174.95 1lwt h THR 314 N -0.26 1.11 -0.81 4.70 2.02 -1.28 0.87 112.91 119.26 1lwt h THR 314 Ca 0.17 -0.22 0.14 0.00 0.77 0.00 0.00 66.41 67.27 1lwt h THR 314 Cb 0.56 0.40 -0.09 0.00 -1.74 0.00 0.00 68.15 67.29 1lwt h THR 314 CO -0.62 0.12 0.40 0.03 0.37 0.00 0.00 175.52 175.83 1lwt h ARG 315 N 0.65 0.58 0.00 6.66 3.08 0.20 -0.35 114.38 125.20 1lwt h ARG 315 Ca 0.18 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1lwt h ARG 315 Cb -0.05 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.86 1lwt h ARG 315 CO -0.05 0.38 0.00 0.39 -1.07 0.00 0.00 179.97 179.62 1lwt n GLU 316 N -4.89 0.00 -0.32 0.04 1.02 0.18 -2.91 120.64 113.77 1lwt n GLU 316 Ca 0.16 0.49 0.11 0.00 -0.02 0.00 0.00 57.16 57.90 1lwt n GLU 316 Cb 0.40 -1.45 0.23 0.00 -0.02 0.00 0.00 31.44 30.60 1lwt n GLU 316 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1lwt n THR 317 N -1.97 -0.38 -0.15 2.62 -1.04 0.17 -0.12 114.28 113.42 1lwt n THR 317 Ca 0.00 2.02 -0.04 0.00 -2.04 0.00 0.00 64.05 63.99 1lwt n THR 317 Cb 0.00 -2.90 0.05 0.00 -1.82 0.00 0.00 70.33 65.66 1lwt n THR 317 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 1lwt h PHE 318 N 0.00 0.27 -0.67 -1.42 3.57 -1.01 -0.47 116.94 117.21 1lwt h PHE 318 Ca 0.52 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 62.00 1lwt h PHE 318 Cb 0.99 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.65 1lwt h PHE 318 CO -0.53 0.08 0.26 1.25 -2.23 0.00 0.00 178.31 177.14 1lwt h LEU 319 N 0.32 0.93 -0.83 0.59 6.46 -0.39 -0.52 115.31 121.86 1lwt h LEU 319 Ca 0.22 -0.18 0.13 0.00 -0.12 0.00 0.00 57.88 57.93 1lwt h LEU 319 Cb 0.23 -0.24 -0.14 0.00 -0.73 0.00 0.00 40.66 39.78 1lwt h LEU 319 CO -0.24 0.85 -0.38 0.00 -0.62 0.00 0.00 178.44 178.06 1lwt h ALA 320 N 1.11 0.04 0.63 1.25 0.00 0.21 0.88 119.26 123.39 1lwt h ALA 320 Ca 0.22 0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.33 1lwt h ALA 320 Cb 0.22 0.94 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1lwt h ALA 320 CO -0.02 -0.66 -0.32 0.78 0.00 0.00 0.00 179.25 179.03 1lwt h GLY 321 N -0.07 -0.91 -0.36 0.00 0.00 -0.20 0.38 103.07 101.91 1lwt h GLY 321 Ca 0.29 0.35 0.14 0.00 0.00 0.00 0.00 47.33 48.11 1lwt h GLY 321 CO -0.86 -0.33 -0.16 -2.00 0.00 0.00 0.00 176.54 173.18 1lwt h LEU 322 N -0.87 -0.62 0.30 3.11 6.46 0.74 -1.00 115.31 123.43 1lwt h LEU 322 Ca -0.08 0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.86 1lwt h LEU 322 Cb 0.68 0.42 0.00 0.00 -0.73 0.00 0.00 40.66 41.03 1lwt h LEU 322 CO 0.13 -0.22 -0.15 0.40 -0.62 0.00 0.00 178.44 177.98 1lwt h ILE 323 N 0.00 0.73 0.00 4.05 2.04 0.86 -2.23 117.51 122.97 1lwt h ILE 323 Ca 0.33 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1lwt h ILE 323 Cb 0.50 0.93 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1lwt h ILE 323 CO -0.70 0.08 0.69 0.44 0.00 0.00 0.00 178.15 178.65 1lwt h ASP 324 N -0.61 0.00 0.00 1.72 3.32 0.12 -1.75 116.42 119.22 1lwt h ASP 324 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1lwt h ASP 324 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1lwt h ASP 324 CO 0.07 0.00 -0.28 -0.24 -1.72 0.00 0.00 179.24 177.06 1lwt n SER 325 N -2.23 0.75 -3.15 6.45 2.88 -1.03 -4.77 113.62 112.52 1lwt n SER 325 Ca -0.00 0.12 -0.37 0.00 -1.33 0.00 0.00 58.87 57.29 1lwt n SER 325 Cb 0.70 -0.44 0.01 0.00 -0.75 0.00 0.00 64.21 63.74 1lwt n SER 325 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1lwt n ASP 326 N -3.23 6.61 -3.60 -3.46 8.00 -0.87 -4.93 116.55 115.07 1lwt n ASP 326 Ca -0.04 -3.74 -0.18 0.00 0.71 0.00 0.00 54.79 51.54 1lwt n ASP 326 Cb 0.15 -0.95 -0.15 0.00 -0.02 0.00 0.00 41.12 40.16 1lwt n ASP 326 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1lwt s GLY 327 N -1.90 0.06 -0.24 0.44 0.00 -0.66 -4.01 107.32 101.01 1lwt s GLY 327 Ca 0.46 0.38 -0.12 0.00 0.00 0.00 0.00 44.72 45.44 1lwt s GLY 327 CO -0.23 1.87 0.23 -0.47 0.00 0.00 0.00 173.10 174.50 1lwt s TYR 328 N 2.30 3.31 0.04 1.90 5.04 -1.04 -4.77 117.35 124.13 1lwt s TYR 328 Ca 0.04 0.31 0.07 0.00 -2.44 0.00 0.00 57.07 55.05 1lwt s TYR 328 Cb -0.14 -2.35 -0.03 0.00 0.35 0.00 0.00 41.96 39.79 1lwt s TYR 328 CO -0.09 0.01 -0.17 0.08 -1.34 0.00 0.00 175.55 174.04 1lwt s VAL 329 N 1.24 2.84 0.28 3.14 1.01 -1.26 -1.00 120.40 126.65 1lwt s VAL 329 Ca 0.10 -1.18 0.02 0.00 0.00 0.00 0.00 61.98 60.93 1lwt s VAL 329 Cb -0.14 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1lwt s VAL 329 CO 0.06 0.33 0.15 0.42 0.00 0.00 0.00 175.10 176.06 1lwt s THR 330 N -0.94 0.28 0.00 3.92 -4.23 -0.98 -4.96 115.64 108.73 1lwt s THR 330 Ca 0.15 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 1lwt s THR 330 Cb -0.11 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1lwt s THR 330 CO 0.06 0.00 0.00 -0.67 -0.54 0.00 0.00 174.62 173.47 1lwt n ASP 331 N -0.75 0.00 -0.30 3.99 -0.08 -1.26 -2.82 116.55 115.33 1lwt n ASP 331 Ca 0.01 -0.04 0.12 0.00 -1.51 0.00 0.00 54.79 53.38 1lwt n ASP 331 Cb 0.65 0.00 0.27 0.00 2.34 0.00 0.00 41.12 44.38 1lwt n ASP 331 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1lwt h GLU 332 N 0.00 0.12 0.00 -0.67 4.39 -1.99 -2.75 114.58 113.68 1lwt h GLU 332 Ca 0.00 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 1lwt h GLU 332 Cb 0.02 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.61 1lwt h GLU 332 CO 0.00 0.08 -0.30 0.72 -1.16 0.00 0.00 179.01 178.35 1lwt n HIS 333 N -5.32 0.00 0.00 4.33 8.25 -1.26 -5.06 115.22 116.16 1lwt n HIS 333 Ca 0.20 -0.90 0.00 0.00 -0.26 0.00 0.00 57.72 56.77 1lwt n HIS 333 Cb 0.67 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.62 1lwt n HIS 333 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lwt n GLY 334 N -0.94 4.74 3.73 -1.41 0.00 -1.04 -5.07 105.19 105.19 1lwt n GLY 334 Ca 0.13 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 1lwt n GLY 334 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1lwt s ILE 335 N -1.82 3.07 -0.06 -0.61 1.10 -1.26 -4.19 121.20 117.43 1lwt s ILE 335 Ca 0.00 0.81 -0.17 0.00 -0.51 0.00 0.00 60.65 60.78 1lwt s ILE 335 Cb 0.00 -3.52 0.03 0.00 0.15 0.00 0.00 42.46 39.13 1lwt s ILE 335 CO 0.00 0.09 0.39 -0.54 -2.11 0.00 0.00 174.94 172.77 1lwt s LYS 336 N 0.59 0.68 0.01 3.50 -0.14 -1.13 -3.98 119.74 119.26 1lwt s LYS 336 Ca 0.63 0.08 0.01 0.00 -1.36 0.00 0.00 55.97 55.33 1lwt s LYS 336 Cb -0.39 0.31 -0.01 0.00 -1.68 0.00 0.00 37.83 36.06 1lwt s LYS 336 CO 0.34 -0.17 -0.05 0.00 -0.76 0.00 0.00 175.35 174.71 1lwt s ALA 337 N -0.89 0.37 -0.24 5.17 0.00 -1.26 -2.32 121.76 122.59 1lwt s ALA 337 Ca -0.10 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.51 1lwt s ALA 337 Cb -0.04 -0.04 0.07 0.00 0.00 0.00 0.00 23.12 23.12 1lwt s ALA 337 CO 0.04 0.04 0.02 0.99 0.00 0.00 0.00 175.76 176.85 1lwt s THR 338 N -0.51 1.04 0.00 0.00 2.01 -0.17 -4.65 115.64 113.37 1lwt s THR 338 Ca -0.03 -1.08 -0.17 0.00 0.31 0.00 0.00 61.69 60.73 1lwt s THR 338 Cb -0.04 -1.53 -0.06 0.00 0.01 0.00 0.00 72.50 70.88 1lwt s THR 338 CO -0.00 -0.30 0.49 -0.63 -0.69 0.00 0.00 174.62 173.49 1lwt s ILE 339 N 1.59 4.95 -0.04 1.82 1.09 -1.03 -2.51 121.20 127.07 1lwt s ILE 339 Ca 0.00 1.02 0.05 0.00 -1.10 0.00 0.00 60.65 60.63 1lwt s ILE 339 Cb -0.18 -3.81 -0.02 0.00 -1.06 0.00 0.00 42.46 37.39 1lwt s ILE 339 CO -0.12 0.51 -0.19 -0.75 -0.10 0.00 0.00 174.94 174.30 1lwt s LYS 340 N -0.72 2.43 0.33 2.79 2.20 -1.26 -2.18 119.74 123.33 1lwt s LYS 340 Ca 0.26 -0.78 -0.04 0.00 -0.36 0.00 0.00 55.97 55.05 1lwt s LYS 340 Cb -0.18 -2.27 0.00 0.00 -1.51 0.00 0.00 37.83 33.88 1lwt s LYS 340 CO 0.15 0.57 0.49 -0.08 -0.36 0.00 0.00 175.35 176.11 1lwt s THR 341 N -0.60 0.00 0.00 3.43 -1.32 -0.33 -5.00 115.64 111.81 1lwt s THR 341 Ca 0.09 -1.55 0.00 0.00 -1.21 0.00 0.00 61.69 59.02 1lwt s THR 341 Cb -0.11 -2.61 0.00 0.00 -1.51 0.00 0.00 72.50 68.27 1lwt s THR 341 CO 0.01 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.42 1lwt n ILE 342 N -0.54 0.00 -3.34 5.08 3.06 -1.26 -0.43 119.36 121.92 1lwt n ILE 342 Ca 0.00 -0.06 -0.38 0.00 -2.50 0.00 0.00 62.75 59.80 1lwt n ILE 342 Cb 0.62 0.63 -0.07 0.00 0.54 0.00 0.00 39.64 41.36 1lwt n ILE 342 CO 0.00 0.00 0.00 -1.00 -2.50 0.00 0.00 176.55 173.05 1lwt s HIS 343 N -0.31 3.37 0.06 9.51 3.76 -1.26 -4.87 115.29 125.55 1lwt s HIS 343 Ca 0.00 0.66 -0.20 0.00 -0.15 0.00 0.00 55.06 55.37 1lwt s HIS 343 Cb 0.00 -2.57 -0.08 0.00 1.11 0.00 0.00 32.58 31.04 1lwt s HIS 343 CO 0.00 -0.04 1.32 1.15 -0.85 0.00 0.00 174.74 176.32 1lwt h THR 344 N 5.06 0.00 -0.99 1.30 2.02 -1.96 -0.75 112.91 117.59 1lwt h THR 344 Ca -0.35 0.00 0.27 0.00 0.77 0.00 0.00 66.41 67.10 1lwt h THR 344 Cb 1.16 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 67.39 1lwt h THR 344 CO 0.72 0.00 0.02 -1.54 0.37 0.00 0.00 175.52 175.09 1lwt n SER 345 N -4.19 -0.11 0.14 4.18 3.41 -1.26 0.61 113.62 116.39 1lwt n SER 345 Ca -0.05 1.68 -0.14 0.00 -0.26 0.00 0.00 58.87 60.10 1lwt n SER 345 Cb 0.23 -0.61 -0.08 0.00 -0.26 0.00 0.00 64.21 63.49 1lwt n SER 345 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1lwt h VAL 346 N 0.00 0.82 -0.00 -3.33 2.07 -1.59 -1.23 116.25 113.00 1lwt h VAL 346 Ca 0.60 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.99 1lwt h VAL 346 Cb 1.24 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1lwt h VAL 346 CO -0.93 0.03 -0.06 -0.09 0.02 0.00 0.00 177.57 176.54 1lwt h ARG 347 N -0.34 -0.08 0.00 1.57 1.12 0.16 -1.78 114.38 115.03 1lwt h ARG 347 Ca -0.03 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 1lwt h ARG 347 Cb 0.26 0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.24 1lwt h ARG 347 CO 0.05 -0.05 0.00 -0.25 -3.11 0.00 0.00 179.97 176.61 1lwt n ASP 348 N -2.87 0.00 -0.23 -3.80 8.00 0.18 -1.47 116.55 116.35 1lwt n ASP 348 Ca -0.01 0.44 0.20 0.00 0.71 0.00 0.00 54.79 56.14 1lwt n ASP 348 Cb 0.05 0.00 0.34 0.00 -0.02 0.00 0.00 41.12 41.49 1lwt n ASP 348 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lwt n GLY 349 N -0.83 -0.42 0.17 0.44 0.00 -0.47 0.17 105.19 104.25 1lwt n GLY 349 Ca 0.00 0.39 -0.18 0.00 0.00 0.00 0.00 46.02 46.23 1lwt n GLY 349 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lwt h LEU 350 N 0.00 0.70 -0.29 0.99 6.46 -0.33 -2.78 115.31 120.07 1lwt h LEU 350 Ca 0.45 -0.72 -0.02 0.00 -0.12 0.00 0.00 57.88 57.47 1lwt h LEU 350 Cb 1.42 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.12 1lwt h LEU 350 CO -0.26 1.32 0.12 0.58 -0.62 0.00 0.00 178.44 179.58 1lwt h VAL 351 N 0.14 1.17 -0.24 1.05 2.07 0.25 1.03 116.25 121.72 1lwt h VAL 351 Ca -0.08 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 1lwt h VAL 351 Cb 1.40 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1lwt h VAL 351 CO 0.14 0.18 0.05 0.77 0.02 0.00 0.00 177.57 178.74 1lwt h SER 352 N 0.32 0.31 0.00 0.57 4.64 -1.53 -1.44 113.55 116.42 1lwt h SER 352 Ca 0.10 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1lwt h SER 352 Cb 0.17 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1lwt h SER 352 CO -0.01 0.33 -0.00 0.25 -0.87 0.00 0.00 176.83 176.53 1lwt h LEU 353 N 0.34 -0.00 -0.82 5.97 5.85 -1.08 -2.98 115.31 122.59 1lwt h LEU 353 Ca 0.08 -0.89 0.16 0.00 0.84 0.00 0.00 57.88 58.08 1lwt h LEU 353 Cb 0.15 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.03 1lwt h LEU 353 CO -0.00 0.93 -0.22 0.00 -0.34 0.00 0.00 178.44 178.80 1lwt h ALA 354 N -0.05 0.49 -0.41 1.25 0.00 0.14 -0.52 119.26 120.16 1lwt h ALA 354 Ca -0.00 0.31 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 1lwt h ALA 354 Cb 0.89 0.66 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1lwt h ALA 354 CO 0.00 -0.43 -0.17 0.00 0.00 0.00 0.00 179.25 178.65 1lwt h ARG 355 N -0.01 0.84 -1.77 0.00 3.08 -1.39 -2.92 114.38 112.21 1lwt h ARG 355 Ca 0.38 -0.35 0.52 0.00 0.07 0.00 0.00 59.98 60.60 1lwt h ARG 355 Cb 0.60 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 30.54 1lwt h ARG 355 CO -0.85 0.99 1.26 0.66 -1.07 0.00 0.00 179.97 180.97 1lwt h SER 356 N 0.65 0.03 0.70 7.04 4.64 -0.92 1.10 113.55 126.78 1lwt h SER 356 Ca 0.09 0.01 -0.26 0.00 -0.47 0.00 0.00 61.79 61.17 1lwt h SER 356 Cb 0.72 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1lwt h SER 356 CO 0.05 -0.02 -1.22 -0.07 -0.87 0.00 0.00 176.83 174.71 1lwt h LEU 357 N 0.01 0.31 0.00 5.97 3.38 -1.45 0.34 115.31 123.88 1lwt h LEU 357 Ca 0.86 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 58.49 1lwt h LEU 357 Cb 3.38 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 44.03 1lwt h LEU 357 CO -0.05 1.27 0.00 0.61 0.09 0.00 0.00 178.44 180.36 1lwt n GLY 358 N 1.50 0.84 3.82 0.83 0.00 0.38 -4.79 105.19 107.77 1lwt n GLY 358 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1lwt n GLY 358 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lwt s LEU 359 N 0.00 3.45 -0.23 0.99 1.02 -1.22 -4.88 118.68 117.81 1lwt s LEU 359 Ca 0.00 1.69 -0.10 0.00 0.02 0.00 0.00 54.13 55.74 1lwt s LEU 359 Cb 0.00 -4.52 -0.05 0.00 0.02 0.00 0.00 46.19 41.65 1lwt s LEU 359 CO 0.00 -1.05 0.15 -0.69 0.02 0.00 0.00 176.35 174.78 1lwt s VAL 360 N -2.65 5.34 0.07 -1.59 1.01 0.15 -4.36 120.40 118.37 1lwt s VAL 360 Ca 0.61 0.17 0.08 0.00 0.00 0.00 0.00 61.98 62.84 1lwt s VAL 360 Cb -0.14 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 1lwt s VAL 360 CO 0.40 0.38 -0.21 -0.69 0.00 0.00 0.00 175.10 174.97 1lwt s VAL 361 N 0.83 1.74 -0.25 2.92 1.01 -1.26 -1.35 120.40 124.05 1lwt s VAL 361 Ca 0.07 -1.35 -0.13 0.00 0.00 0.00 0.00 61.98 60.58 1lwt s VAL 361 Cb -0.13 -1.54 0.08 0.00 0.00 0.00 0.00 36.38 34.80 1lwt s VAL 361 CO 0.02 0.12 0.59 -0.55 0.00 0.00 0.00 175.10 175.29 1lwt s SER 362 N -1.46 -0.81 0.28 3.32 0.15 0.02 -4.98 113.70 110.23 1lwt s SER 362 Ca 0.08 1.32 0.06 0.00 0.70 0.00 0.00 55.95 58.10 1lwt s SER 362 Cb -0.09 1.29 -0.02 0.00 -1.71 0.00 0.00 66.02 65.49 1lwt s SER 362 CO 0.03 -0.22 0.39 -0.69 1.20 0.00 0.00 173.24 173.94 1lwt s VAL 363 N 1.73 4.64 -0.26 4.45 1.01 -1.26 0.66 120.40 131.37 1lwt s VAL 363 Ca -0.09 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 60.83 1lwt s VAL 363 Cb -0.07 -3.61 0.12 0.00 0.00 0.00 0.00 36.38 32.81 1lwt s VAL 363 CO -0.17 -0.25 0.24 0.21 0.00 0.00 0.00 175.10 175.12 1lwt s ASN 364 N -4.05 1.92 0.63 3.32 3.84 -1.18 -4.93 114.94 114.50 1lwt s ASN 364 Ca 0.39 -0.68 -0.15 0.00 0.21 0.00 0.00 52.86 52.63 1lwt s ASN 364 Cb -0.09 0.32 -0.02 0.00 -0.55 0.00 0.00 41.25 40.91 1lwt s ASN 364 CO 0.29 -0.38 1.07 0.00 -2.79 0.00 0.00 177.10 175.30 1lwt s ALA 365 N 2.30 2.64 -0.16 1.71 0.00 -1.26 -1.84 121.76 125.15 1lwt s ALA 365 Ca 0.09 0.38 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 1lwt s ALA 365 Cb -0.15 -3.25 0.05 0.00 0.00 0.00 0.00 23.12 19.78 1lwt s ALA 365 CO -0.27 -1.03 0.02 -2.00 0.00 0.00 0.00 175.76 172.48 1lwt s GLU 366 N -4.26 0.69 1.06 0.00 2.12 0.10 -4.95 118.70 113.46 1lwt s GLU 366 Ca 0.63 -0.30 -0.22 0.00 0.36 0.00 0.00 54.97 55.44 1lwt s GLU 366 Cb -0.17 -1.84 -0.03 0.00 0.26 0.00 0.00 34.13 32.36 1lwt s GLU 366 CO 0.42 -0.55 -0.64 -2.30 -0.54 0.00 0.00 175.26 171.65 1lwt n PRO 367 N 5.07 -0.86 -1.27 4.30 -0.02 -1.26 -0.12 135.00 140.84 1lwt n PRO 367 Ca -0.09 -0.24 -0.30 0.00 -2.02 0.00 0.00 63.50 60.85 1lwt n PRO 367 Cb 0.48 -1.40 0.23 0.00 -0.02 0.00 0.00 33.50 32.79 1lwt n PRO 367 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lwt s ALA 368 N -2.14 0.96 0.15 3.55 0.00 -1.26 -4.34 121.76 118.67 1lwt s ALA 368 Ca 0.47 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 51.37 1lwt s ALA 368 Cb -0.03 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.25 1lwt s ALA 368 CO 0.67 -3.36 0.28 1.17 0.00 0.00 0.00 175.76 174.52 1lwt n LYS 369 N -4.56 0.40 -3.64 0.00 4.81 -1.24 -4.93 118.16 109.00 1lwt n LYS 369 Ca 0.14 -0.92 -0.08 0.00 -0.87 0.00 0.00 58.31 56.58 1lwt n LYS 369 Cb 0.59 1.07 -0.07 0.00 0.02 0.00 0.00 35.03 36.65 1lwt n LYS 369 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1lwt s VAL 370 N -2.64 0.00 0.00 3.15 1.01 -1.24 -1.82 120.40 118.86 1lwt s VAL 370 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.05 1lwt s VAL 370 Cb -0.02 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.36 1lwt s VAL 370 CO 0.05 0.00 0.00 -0.90 0.00 0.00 0.00 175.10 174.25 1lwt n ASP 371 N 2.77 0.00 0.00 3.32 5.75 -1.14 -4.90 116.55 122.35 1lwt n ASP 371 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.63 1lwt n ASP 371 Cb 0.56 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 1lwt n ASP 371 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1lwt n ASN 373 N -0.40 0.00 -1.40 -1.12 0.23 -1.26 -4.31 115.26 107.00 1lwt n ASN 373 Ca 0.00 0.00 -0.16 0.00 -0.53 0.00 0.00 54.58 53.89 1lwt n ASN 373 Cb 0.00 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 37.65 1lwt n ASN 373 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1lwt n GLY 374 N 0.00 1.13 3.84 4.83 0.00 -1.26 -4.99 105.19 108.74 1lwt n GLY 374 Ca 0.00 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 1lwt n GLY 374 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lwt s THR 375 N -2.66 4.87 -0.64 2.61 -4.23 -1.26 -5.03 115.64 109.30 1lwt s THR 375 Ca 0.00 0.86 -0.20 0.00 -1.18 0.00 0.00 61.69 61.17 1lwt s THR 375 Cb 0.00 -3.75 0.09 0.00 1.34 0.00 0.00 72.50 70.18 1lwt s THR 375 CO 0.00 0.33 0.84 -0.54 -0.54 0.00 0.00 174.62 174.70 1lwt s LYS 376 N -1.74 3.11 0.98 3.99 1.02 -1.26 -2.89 119.74 122.94 1lwt s LYS 376 Ca 0.35 -1.16 -0.13 0.00 0.02 0.00 0.00 55.97 55.05 1lwt s LYS 376 Cb -0.16 -4.29 0.17 0.00 -0.52 0.00 0.00 37.83 33.04 1lwt s LYS 376 CO 0.19 -1.67 1.12 -1.01 -0.92 0.00 0.00 175.35 173.06 1lwt s HIS 377 N 3.23 2.15 0.23 3.18 3.76 -0.75 -4.91 115.29 122.18 1lwt s HIS 377 Ca 0.17 0.85 0.10 0.00 -0.15 0.00 0.00 55.06 56.03 1lwt s HIS 377 Cb -0.20 -3.37 -0.05 0.00 1.11 0.00 0.00 32.58 30.07 1lwt s HIS 377 CO 0.07 -2.73 -0.18 0.15 -0.85 0.00 0.00 174.74 171.20 1lwt s LYS 378 N -5.19 1.49 -0.23 1.40 1.02 -1.26 -3.59 119.74 113.39 1lwt s LYS 378 Ca 0.65 -1.65 -0.36 0.00 0.02 0.00 0.00 55.97 54.64 1lwt s LYS 378 Cb -0.15 -1.47 -0.12 0.00 -0.52 0.00 0.00 37.83 35.56 1lwt s LYS 378 CO 0.55 0.27 1.96 1.51 -0.92 0.00 0.00 175.35 178.72 1lwt n ILE 379 N -0.38 0.38 -4.17 2.17 0.13 -1.26 -4.43 119.36 111.80 1lwt n ILE 379 Ca -0.07 -0.16 -0.27 0.00 -1.10 0.00 0.00 62.75 61.15 1lwt n ILE 379 Cb 0.60 -1.67 -0.07 0.00 -0.84 0.00 0.00 39.64 37.65 1lwt n ILE 379 CO 0.00 0.00 0.00 -0.55 2.80 0.00 0.00 176.55 178.80 1lwt s SER 380 N 5.18 4.98 -0.07 9.51 0.15 0.83 -4.66 113.70 129.63 1lwt s SER 380 Ca 1.00 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 57.36 1lwt s SER 380 Cb -0.83 -1.14 0.01 0.00 -1.71 0.00 0.00 66.02 62.36 1lwt s SER 380 CO 0.54 0.09 -0.12 -0.31 1.20 0.00 0.00 173.24 174.64 1lwt s TYR 381 N -1.72 1.49 -0.82 3.44 2.02 0.42 0.03 117.35 122.21 1lwt s TYR 381 Ca 0.28 -0.57 0.01 0.00 -0.37 0.00 0.00 57.07 56.42 1lwt s TYR 381 Cb -0.10 -1.10 0.21 0.00 -0.40 0.00 0.00 41.96 40.58 1lwt s TYR 381 CO 0.20 -0.31 0.73 0.00 -1.57 0.00 0.00 175.55 174.60 1lwt n ALA 382 N 3.92 3.79 -1.88 3.71 0.00 -0.77 -1.19 120.51 128.10 1lwt n ALA 382 Ca -0.22 -4.61 -0.42 0.00 0.00 0.00 0.00 53.44 48.19 1lwt n ALA 382 Cb 0.52 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.51 1lwt n ALA 382 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1lwt s ILE 383 N -1.63 3.02 0.38 0.00 -1.16 -0.93 -3.08 121.20 117.80 1lwt s ILE 383 Ca 0.29 0.40 0.08 0.00 -0.51 0.00 0.00 60.65 60.90 1lwt s ILE 383 Cb -0.03 -3.26 -0.04 0.00 0.61 0.00 0.00 42.46 39.75 1lwt s ILE 383 CO -0.12 -0.01 0.23 -0.47 -2.81 0.00 0.00 174.94 171.77 1lwt s TYR 384 N 2.99 2.70 0.00 3.50 5.04 0.21 -2.46 117.35 129.33 1lwt s TYR 384 Ca 0.76 -0.46 0.00 0.00 -2.44 0.00 0.00 57.07 54.93 1lwt s TYR 384 Cb -0.40 -1.89 0.00 0.00 0.35 0.00 0.00 41.96 40.02 1lwt s TYR 384 CO 0.33 0.16 0.00 -1.13 -1.34 0.00 0.00 175.55 173.57 1lwt n SER 386 N -1.30 0.00 0.00 4.32 3.41 -0.46 -0.80 113.62 118.79 1lwt n SER 386 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1lwt n SER 386 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1lwt n SER 386 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lwt n GLY 387 N -1.21 0.00 7.00 5.00 0.00 -1.26 -0.67 105.19 114.05 1lwt n GLY 387 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1lwt n GLY 387 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lwt n GLY 388 N 0.00 1.14 0.07 -0.02 0.00 -1.26 -3.16 105.19 101.96 1lwt n GLY 388 Ca 0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 46.02 45.52 1lwt n GLY 388 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lwt n ASP 389 N -2.91 -0.19 -0.26 1.61 9.92 -1.26 -0.95 116.55 122.52 1lwt n ASP 389 Ca 0.00 0.56 0.07 0.00 -0.53 0.00 0.00 54.79 54.89 1lwt n ASP 389 Cb 0.00 -0.16 0.15 0.00 -0.64 0.00 0.00 41.12 40.47 1lwt n ASP 389 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1lwt n VAL 390 N -3.30 -0.30 -0.03 2.53 0.31 -1.19 0.13 118.33 116.48 1lwt n VAL 390 Ca 0.00 1.62 -0.16 0.00 -0.01 0.00 0.00 64.34 65.80 1lwt n VAL 390 Cb 0.05 -2.30 -0.08 0.00 -0.91 0.00 0.00 33.84 30.59 1lwt n VAL 390 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1lwt h LEU 391 N 0.00 0.67 0.22 7.52 5.85 -1.16 -3.23 115.31 125.18 1lwt h LEU 391 Ca 0.39 -0.63 0.01 0.00 0.84 0.00 0.00 57.88 58.49 1lwt h LEU 391 Cb 0.70 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1lwt h LEU 391 CO -0.71 1.19 -0.38 0.25 -0.34 0.00 0.00 178.44 178.45 1lwt h LEU 392 N 0.19 -1.07 -1.61 2.25 5.85 0.16 0.36 115.31 121.45 1lwt h LEU 392 Ca -0.03 0.11 0.10 0.00 0.84 0.00 0.00 57.88 58.90 1lwt h LEU 392 Cb 1.16 0.39 -0.01 0.00 0.37 0.00 0.00 40.66 42.56 1lwt h LEU 392 CO 0.11 -0.48 0.61 -1.13 -0.34 0.00 0.00 178.44 177.21 1lwt h ASN 393 N -0.68 0.00 0.04 1.25 -1.24 0.23 0.79 115.58 115.97 1lwt h ASN 393 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 1lwt h ASN 393 Cb 0.66 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.71 1lwt h ASN 393 CO -0.16 0.00 -0.02 0.58 -1.29 0.00 0.00 177.43 176.54 1lwt h VAL 394 N 0.00 1.02 -0.99 2.57 2.07 -1.00 -3.34 116.25 116.58 1lwt h VAL 394 Ca 0.17 -1.63 0.20 0.00 0.82 0.00 0.00 66.70 66.26 1lwt h VAL 394 Cb 1.39 1.88 -0.10 0.00 -1.52 0.00 0.00 31.29 32.94 1lwt h VAL 394 CO -0.00 0.33 0.61 -0.07 0.02 0.00 0.00 177.57 178.46 1lwt h LEU 395 N -0.96 0.71 -1.86 2.57 3.38 0.17 0.30 115.31 119.62 1lwt h LEU 395 Ca -0.01 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.08 1lwt h LEU 395 Cb 0.58 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1lwt h LEU 395 CO 0.01 0.24 0.41 0.77 0.09 0.00 0.00 178.44 179.96 1lwt h SER 396 N 0.68 0.00 -0.75 -0.43 4.64 0.77 0.76 113.55 119.23 1lwt h SER 396 Ca 0.57 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.63 1lwt h SER 396 Cb 0.99 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.93 1lwt h SER 396 CO -0.35 0.00 0.33 0.29 -0.87 0.00 0.00 176.83 176.23 1lwt n LYS 397 N -3.05 3.29 -4.02 4.77 5.02 0.11 -4.80 118.16 119.48 1lwt n LYS 397 Ca 0.00 -2.85 -0.22 0.00 -2.02 0.00 0.00 58.31 53.23 1lwt n LYS 397 Cb 0.48 -2.15 -0.04 0.00 -0.02 0.00 0.00 35.03 33.31 1lwt n LYS 397 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lwt n ALA 399 N -1.25 1.72 -1.50 0.00 0.00 -1.26 -4.66 120.51 113.57 1lwt n ALA 399 Ca -0.06 -0.64 -0.38 0.00 0.00 0.00 0.00 53.44 52.36 1lwt n ALA 399 Cb 0.58 0.10 0.04 0.00 0.00 0.00 0.00 19.45 20.18 1lwt n ALA 399 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lwt n GLY 400 N 2.59 -1.22 0.13 0.00 0.00 -1.26 -3.63 105.19 101.81 1lwt n GLY 400 Ca -0.20 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 1lwt n GLY 400 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1lwt h SER 401 N 0.35 -0.19 0.90 1.61 4.64 -1.94 -0.90 113.55 118.02 1lwt h SER 401 Ca -0.46 -0.35 0.00 0.00 -0.47 0.00 0.00 61.79 60.51 1lwt h SER 401 Cb 1.39 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 1lwt h SER 401 CO 0.48 0.34 0.00 0.07 -0.87 0.00 0.00 176.83 176.85 1lwt h LYS 402 N -0.80 0.00 0.00 4.77 2.10 -1.99 -3.33 116.57 117.32 1lwt h LYS 402 Ca -0.02 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.31 1lwt h LYS 402 Cb 0.53 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.81 1lwt h LYS 402 CO 0.04 0.00 -1.91 1.63 -2.00 0.00 0.00 179.45 177.21 1lwt n LYS 403 N -2.40 0.57 -1.24 0.07 5.02 -1.22 -4.72 118.16 114.23 1lwt n LYS 403 Ca 0.02 0.35 -0.41 0.00 -2.02 0.00 0.00 58.31 56.26 1lwt n LYS 403 Cb 0.27 -1.56 -0.01 0.00 -0.02 0.00 0.00 35.03 33.71 1lwt n LYS 403 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1lwt n PHE 404 N -4.35 -1.51 -3.66 2.13 7.35 -0.34 -4.92 117.46 112.16 1lwt n PHE 404 Ca -0.41 0.68 -0.08 0.00 -0.76 0.00 0.00 57.45 56.88 1lwt n PHE 404 Cb 0.75 -1.72 -0.08 0.00 0.35 0.00 0.00 39.48 38.79 1lwt n PHE 404 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1lwt s ARG 405 N -0.94 0.62 0.52 -4.13 1.81 -1.22 -4.97 118.95 110.64 1lwt s ARG 405 Ca 0.57 1.09 -0.19 0.00 -1.72 0.00 0.00 55.73 55.48 1lwt s ARG 405 Cb -0.68 0.10 -0.11 0.00 -0.45 0.00 0.00 34.95 33.81 1lwt s ARG 405 CO 0.57 -0.15 0.33 -2.30 -0.68 0.00 0.00 175.30 173.07 1lwt n PRO 406 N 4.23 0.36 -2.42 3.54 -0.02 -1.26 -1.35 135.00 138.09 1lwt n PRO 406 Ca -0.21 0.14 -0.41 0.00 -2.02 0.00 0.00 63.50 61.00 1lwt n PRO 406 Cb 0.58 -1.45 -0.04 0.00 -0.02 0.00 0.00 33.50 32.57 1lwt n PRO 406 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lwt s ALA 407 N -1.76 3.42 0.75 3.55 0.00 -1.26 -4.54 121.76 121.91 1lwt s ALA 407 Ca 0.64 0.93 -0.16 0.00 0.00 0.00 0.00 51.96 53.37 1lwt s ALA 407 Cb -0.49 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.19 1lwt s ALA 407 CO 0.58 -0.29 0.27 -2.30 0.00 0.00 0.00 175.76 174.02 1lwt n PRO 408 N 1.95 0.16 0.00 0.00 -0.02 -1.26 -4.86 135.00 130.97 1lwt n PRO 408 Ca 0.02 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1lwt n PRO 408 Cb 0.45 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 1lwt n PRO 408 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lwt n ALA 409 N -2.40 0.00 0.00 3.55 0.00 -1.26 -4.87 120.51 115.53 1lwt n ALA 409 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1lwt n ALA 409 Cb 0.51 0.19 0.00 0.00 0.00 0.00 0.00 19.45 20.14 1lwt n ALA 409 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lwt n ALA 410 N -1.46 0.00 -3.74 0.00 0.00 -1.26 -5.00 120.51 109.05 1lwt n ALA 410 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1lwt n ALA 410 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1lwt n ALA 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lwt n ALA 411 N -0.49 -1.59 -1.88 0.00 0.00 -1.26 -4.79 120.51 110.50 1lwt n ALA 411 Ca 0.00 -0.27 -0.41 0.00 0.00 0.00 0.00 53.44 52.76 1lwt n ALA 411 Cb 0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 1lwt n ALA 411 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1lwt s PHE 412 N -3.78 3.22 0.34 0.00 -0.71 -1.26 -4.97 117.98 110.81 1lwt s PHE 412 Ca 0.07 1.35 -0.27 0.00 -1.04 0.00 0.00 56.93 57.05 1lwt s PHE 412 Cb -0.04 -3.59 -0.09 0.00 -1.21 0.00 0.00 43.02 38.08 1lwt s PHE 412 CO 0.69 -1.71 1.04 0.00 -1.34 0.00 0.00 175.22 173.91 1lwt s ALA 413 N -0.53 3.23 -0.98 1.99 0.00 -1.26 -4.95 121.76 119.26 1lwt s ALA 413 Ca 0.52 0.74 -0.01 0.00 0.00 0.00 0.00 51.96 53.21 1lwt s ALA 413 Cb -0.37 -3.27 0.32 0.00 0.00 0.00 0.00 23.12 19.79 1lwt s ALA 413 CO 0.44 -0.11 1.63 0.54 0.00 0.00 0.00 175.76 178.26 1lwt n ARG 414 N 0.56 4.93 -1.03 0.00 1.74 -1.26 -4.88 116.66 116.72 1lwt n ARG 414 Ca 0.02 -4.67 -0.31 0.00 -0.77 0.00 0.00 57.85 52.11 1lwt n ARG 414 Cb 0.48 -2.45 0.13 0.00 -1.02 0.00 0.00 32.46 29.60 1lwt n ARG 414 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1lwt s GLU 415 N -3.88 1.67 0.71 5.56 0.41 -1.26 -4.61 118.70 117.30 1lwt s GLU 415 Ca 0.39 1.44 -0.13 0.00 -0.41 0.00 0.00 54.97 56.25 1lwt s GLU 415 Cb 0.17 -1.81 0.03 0.00 -1.78 0.00 0.00 34.13 30.74 1lwt s GLU 415 CO -0.08 -2.13 1.10 0.00 -0.49 0.00 0.00 175.26 173.67 1lwt s ARG 417 N -4.43 2.87 0.36 0.00 1.81 -0.65 -4.94 118.95 113.97 1lwt s ARG 417 Ca 0.65 -0.59 0.04 0.00 -1.72 0.00 0.00 55.73 54.10 1lwt s ARG 417 Cb -0.19 -2.58 -0.01 0.00 -0.45 0.00 0.00 34.95 31.71 1lwt s ARG 417 CO 0.48 0.56 0.53 0.20 -0.68 0.00 0.00 175.30 176.38 1lwt s GLY 418 N -0.53 1.51 -0.09 -3.53 0.00 -1.26 -0.56 107.32 102.85 1lwt s GLY 418 Ca 0.08 -1.25 -0.05 0.00 0.00 0.00 0.00 44.72 43.50 1lwt s GLY 418 CO 0.02 -1.15 0.22 -0.11 0.00 0.00 0.00 173.10 172.08 1lwt s PHE 419 N -2.28 -0.28 0.31 1.90 -0.71 1.21 -4.89 117.98 113.24 1lwt s PHE 419 Ca 0.44 0.69 -0.28 0.00 -1.04 0.00 0.00 56.93 56.74 1lwt s PHE 419 Cb -0.10 0.02 -0.09 0.00 -1.21 0.00 0.00 43.02 41.65 1lwt s PHE 419 CO 0.33 -0.20 1.10 0.71 -1.34 0.00 0.00 175.22 175.82 1lwt s TYR 420 N 1.07 3.47 0.00 3.49 2.02 -1.26 -1.15 117.35 124.99 1lwt s TYR 420 Ca -0.08 1.68 0.00 0.00 -0.37 0.00 0.00 57.07 58.30 1lwt s TYR 420 Cb -0.09 -3.26 0.00 0.00 -0.40 0.00 0.00 41.96 38.20 1lwt s TYR 420 CO -0.07 -0.63 0.00 1.97 -1.57 0.00 0.00 175.55 175.25 1lwt n PHE 421 N 0.84 0.00 -4.20 2.71 -1.74 -1.26 0.14 117.46 113.95 1lwt n PHE 421 Ca 0.01 0.00 -0.17 0.00 -0.56 0.00 0.00 57.45 56.72 1lwt n PHE 421 Cb 0.46 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.33 1lwt n PHE 421 CO 0.00 0.00 0.00 -2.00 -0.56 0.00 0.00 176.76 174.20 1lwt s GLU 422 N -0.77 0.74 -0.04 3.97 2.12 0.10 -4.70 118.70 120.11 1lwt s GLU 422 Ca 0.00 -0.76 0.05 0.00 0.36 0.00 0.00 54.97 54.62 1lwt s GLU 422 Cb 0.00 -0.68 -0.00 0.00 0.26 0.00 0.00 34.13 33.71 1lwt s GLU 422 CO 0.00 0.16 -0.18 -1.17 -0.54 0.00 0.00 175.26 173.52 1lwt s LEU 423 N -1.33 1.94 -0.03 2.70 2.96 -1.26 -2.88 118.68 120.78 1lwt s LEU 423 Ca -0.03 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.53 1lwt s LEU 423 Cb -0.08 -1.03 0.01 0.00 0.50 0.00 0.00 46.19 45.58 1lwt s LEU 423 CO 0.01 0.17 -0.08 -1.58 -1.32 0.00 0.00 176.35 173.55 1lwt s GLN 424 N -0.00 0.93 -0.34 1.98 2.00 -0.36 -4.93 119.66 118.94 1lwt s GLN 424 Ca -0.04 -0.25 -0.28 0.00 -2.00 0.00 0.00 55.36 52.79 1lwt s GLN 424 Cb -0.12 -0.88 0.02 0.00 0.80 0.00 0.00 33.01 32.83 1lwt s GLN 424 CO 0.02 0.06 1.04 -1.21 -0.50 0.00 0.00 175.29 174.70 1lwt s GLU 425 N 0.38 3.99 0.53 1.67 2.02 -1.26 0.85 118.70 126.88 1lwt s GLU 425 Ca -0.06 0.90 0.07 0.00 0.02 0.00 0.00 54.97 55.91 1lwt s GLU 425 Cb -0.10 -3.77 0.04 0.00 0.10 0.00 0.00 34.13 30.41 1lwt s GLU 425 CO 0.01 -0.95 0.52 -1.17 0.02 0.00 0.00 175.26 173.69 1lwt s LEU 426 N 3.66 2.95 0.35 1.80 2.96 -1.26 -4.95 118.68 124.18 1lwt s LEU 426 Ca 0.44 -1.03 -0.26 0.00 -0.22 0.00 0.00 54.13 53.06 1lwt s LEU 426 Cb -0.12 -1.49 -0.10 0.00 0.50 0.00 0.00 46.19 44.99 1lwt s LEU 426 CO 0.17 -1.10 1.00 -0.75 -1.32 0.00 0.00 176.35 174.35 1lwt s LYS 427 N -4.38 4.43 0.60 1.98 2.20 -1.26 -4.80 119.74 118.51 1lwt s LYS 427 Ca 0.45 1.44 -0.18 0.00 -0.36 0.00 0.00 55.97 57.33 1lwt s LYS 427 Cb -0.04 -2.74 -0.13 0.00 -1.51 0.00 0.00 37.83 33.41 1lwt s LYS 427 CO 0.28 0.11 -0.07 -1.91 -0.36 0.00 0.00 175.35 173.40 1lwt n GLU 428 N 0.38 0.09 -3.62 4.03 2.13 -1.25 -4.83 120.64 117.57 1lwt n GLU 428 Ca 0.03 0.04 -0.04 0.00 0.66 0.00 0.00 57.16 57.85 1lwt n GLU 428 Cb 0.49 -1.16 -0.03 0.00 0.27 0.00 0.00 31.44 31.02 1lwt n GLU 428 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1lwt s ASP 429 N -1.06 -0.09 0.55 4.31 2.15 0.18 -4.92 116.67 117.79 1lwt s ASP 429 Ca 0.57 0.02 -0.21 0.00 0.43 0.00 0.00 52.55 53.36 1lwt s ASP 429 Cb -0.44 0.09 -0.06 0.00 -0.30 0.00 0.00 42.92 42.22 1lwt s ASP 429 CO 0.66 -0.13 1.21 0.47 -0.17 0.00 0.00 175.17 177.21 1lwt n ASP 430 N 0.09 1.99 -4.09 -0.34 8.00 -1.26 -2.30 116.55 118.64 1lwt n ASP 430 Ca 0.02 0.94 -0.16 0.00 0.71 0.00 0.00 54.79 56.29 1lwt n ASP 430 Cb 0.58 -1.50 -0.12 0.00 -0.02 0.00 0.00 41.12 40.06 1lwt n ASP 430 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1lwt s TYR 431 N -1.34 0.87 -0.04 1.24 -0.85 0.50 -4.42 117.35 113.31 1lwt s TYR 431 Ca 0.72 -0.41 0.06 0.00 -0.52 0.00 0.00 57.07 56.92 1lwt s TYR 431 Cb -0.44 -0.52 -0.01 0.00 0.38 0.00 0.00 41.96 41.38 1lwt s TYR 431 CO 0.49 -0.02 -0.23 0.71 -1.52 0.00 0.00 175.55 174.99 1lwt s TYR 432 N -1.10 2.15 0.07 -3.49 1.51 0.12 -2.11 117.35 114.49 1lwt s TYR 432 Ca -0.05 -0.55 -0.06 0.00 -1.01 0.00 0.00 57.07 55.41 1lwt s TYR 432 Cb -0.09 -1.41 -0.02 0.00 -0.11 0.00 0.00 41.96 40.34 1lwt s TYR 432 CO 0.01 -0.14 0.11 0.20 -1.11 0.00 0.00 175.55 174.62 1lwt s GLY 433 N -0.26 0.22 0.14 0.71 0.00 0.43 0.22 107.32 108.78 1lwt s GLY 433 Ca 0.01 -0.80 0.07 0.00 0.00 0.00 0.00 44.72 44.00 1lwt s GLY 433 CO 0.02 -0.95 -0.15 -0.26 0.00 0.00 0.00 173.10 171.76 1lwt s ILE 434 N -3.71 1.47 -0.07 0.90 -5.25 -1.26 -2.43 121.20 110.86 1lwt s ILE 434 Ca 0.04 -1.84 0.04 0.00 -0.99 0.00 0.00 60.65 57.90 1lwt s ILE 434 Cb 0.05 -1.68 0.00 0.00 2.95 0.00 0.00 42.46 43.78 1lwt s ILE 434 CO -0.10 -0.43 -0.19 -0.89 -1.79 0.00 0.00 174.94 171.54 1lwt s THR 435 N -2.29 1.64 0.40 8.37 2.01 0.18 -4.72 115.64 121.24 1lwt s THR 435 Ca 0.12 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.35 1lwt s THR 435 Cb -0.04 -1.43 -0.01 0.00 0.01 0.00 0.00 72.50 71.04 1lwt s THR 435 CO 0.04 0.47 0.59 -0.76 -0.69 0.00 0.00 174.62 174.27 1lwt s LEU 436 N 0.27 3.78 0.72 4.42 1.43 -1.26 0.41 118.68 128.45 1lwt s LEU 436 Ca -0.11 0.12 -0.15 0.00 -1.03 0.00 0.00 54.13 52.96 1lwt s LEU 436 Cb -0.15 -3.02 0.04 0.00 0.03 0.00 0.00 46.19 43.09 1lwt s LEU 436 CO 0.05 -0.59 1.19 -0.55 0.23 0.00 0.00 176.35 176.68 1lwt s SER 437 N -4.19 4.31 0.03 2.29 0.15 -1.19 -4.78 113.70 110.32 1lwt s SER 437 Ca 0.47 2.29 -0.12 0.00 0.70 0.00 0.00 55.95 59.29 1lwt s SER 437 Cb -0.10 -2.58 -0.05 0.00 -1.71 0.00 0.00 66.02 61.58 1lwt s SER 437 CO 0.35 -2.18 1.19 0.44 1.20 0.00 0.00 173.24 174.24 1lwt h ASP 438 N -0.28 -0.53 0.00 5.45 5.19 -1.97 -3.09 116.42 121.18 1lwt h ASP 438 Ca -0.47 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 1lwt h ASP 438 Cb 1.29 0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.99 1lwt h ASP 438 CO 0.50 -0.19 0.05 -0.90 -3.12 0.00 0.00 179.24 175.58 1lwt n ASP 439 N -3.46 0.00 -3.03 6.45 5.75 -1.26 -4.62 116.55 116.39 1lwt n ASP 439 Ca -0.03 0.08 -0.10 0.00 -0.01 0.00 0.00 54.79 54.73 1lwt n ASP 439 Cb 0.14 -0.08 0.06 0.00 -1.03 0.00 0.00 41.12 40.20 1lwt n ASP 439 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1lwt n SER 440 N -0.95 0.48 0.04 -1.12 3.41 -1.17 -4.99 113.62 109.33 1lwt n SER 440 Ca 0.00 -1.44 0.13 0.00 -0.26 0.00 0.00 58.87 57.31 1lwt n SER 440 Cb 0.05 -0.30 0.47 0.00 -0.26 0.00 0.00 64.21 64.18 1lwt n SER 440 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1lwt n ASP 441 N -3.03 0.38 -0.05 4.04 5.68 -1.26 -4.92 116.55 117.39 1lwt n ASP 441 Ca 0.07 0.42 -0.01 0.00 -0.50 0.00 0.00 54.79 54.77 1lwt n ASP 441 Cb 0.25 -0.46 -0.00 0.00 -1.14 0.00 0.00 41.12 39.76 1lwt n ASP 441 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1lwt n HIS 442 N -1.80 0.00 -4.46 2.11 8.25 -1.26 -5.00 115.22 113.06 1lwt n HIS 442 Ca 0.06 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.31 1lwt n HIS 442 Cb 0.38 -0.71 -0.14 0.00 1.12 0.00 0.00 29.99 30.64 1lwt n HIS 442 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1lwt s GLN 443 N -0.82 1.04 0.26 -0.41 -2.07 -1.26 -1.20 119.66 115.20 1lwt s GLN 443 Ca 0.00 -0.72 0.03 0.00 -1.82 0.00 0.00 55.36 52.85 1lwt s GLN 443 Cb 0.00 -1.05 -0.05 0.00 -1.09 0.00 0.00 33.01 30.81 1lwt s GLN 443 CO 0.00 0.27 0.04 -0.59 -1.32 0.00 0.00 175.29 173.69 1lwt s PHE 444 N -0.72 1.65 0.02 9.60 -0.71 0.58 -4.52 117.98 123.89 1lwt s PHE 444 Ca 0.03 -1.01 -0.09 0.00 -1.04 0.00 0.00 56.93 54.82 1lwt s PHE 444 Cb -0.07 -1.00 -0.05 0.00 -1.21 0.00 0.00 43.02 40.68 1lwt s PHE 444 CO 0.01 -0.12 0.32 -0.51 -1.34 0.00 0.00 175.22 173.58 1lwt s LEU 445 N -3.35 4.38 0.00 -1.99 1.02 -1.26 -1.60 118.68 115.88 1lwt s LEU 445 Ca 0.33 0.70 0.00 0.00 0.02 0.00 0.00 54.13 55.18 1lwt s LEU 445 Cb 0.07 -2.71 0.00 0.00 0.02 0.00 0.00 46.19 43.58 1lwt s LEU 445 CO 0.12 0.25 0.00 0.18 0.02 0.00 0.00 176.35 176.92 1lwt n LEU 446 N 1.24 0.00 -0.01 1.79 4.77 -0.79 -2.79 117.00 121.21 1lwt n LEU 446 Ca -0.11 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.81 1lwt n LEU 446 Cb 0.53 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.49 1lwt n LEU 446 CO 0.40 -0.19 -0.54 0.00 -1.33 0.00 0.00 177.39 175.73 1lwt n ALA 447 N -3.00 1.66 0.24 -1.18 0.00 -0.87 -3.56 120.51 113.80 1lwt n ALA 447 Ca 0.00 -0.76 -0.02 0.00 0.00 0.00 0.00 53.44 52.66 1lwt n ALA 447 Cb 0.00 -0.80 0.12 0.00 0.00 0.00 0.00 19.45 18.77 1lwt n ALA 447 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1lwt n ASN 448 N -2.94 2.97 0.00 0.00 0.23 -1.26 -4.83 115.26 109.42 1lwt n ASN 448 Ca -0.16 -2.44 0.00 0.00 -0.53 0.00 0.00 54.58 51.44 1lwt n ASN 448 Cb 0.99 -0.59 0.00 0.00 -2.08 0.00 0.00 39.78 38.10 1lwt n ASN 448 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1lwt n GLN 449 N 0.11 -0.43 -2.25 -3.83 6.02 -1.24 -4.99 117.38 110.77 1lwt n GLN 449 Ca 0.15 0.11 -0.42 0.00 -0.01 0.00 0.00 57.00 56.83 1lwt n GLN 449 Cb 0.73 -3.83 -0.03 0.00 1.02 0.00 0.00 30.24 28.13 1lwt n GLN 449 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1lwt s VAL 450 N -1.97 3.59 -0.34 5.09 1.01 -1.26 -1.01 120.40 125.52 1lwt s VAL 450 Ca 0.00 1.11 -0.29 0.00 0.00 0.00 0.00 61.98 62.80 1lwt s VAL 450 Cb 0.00 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1lwt s VAL 450 CO 0.00 0.06 1.18 -0.69 0.00 0.00 0.00 175.10 175.65 1lwt s VAL 451 N 1.41 4.32 0.22 2.92 1.01 0.11 -1.89 120.40 128.49 1lwt s VAL 451 Ca 0.63 1.48 0.08 0.00 0.00 0.00 0.00 61.98 64.17 1lwt s VAL 451 Cb -0.34 -4.34 -0.05 0.00 0.00 0.00 0.00 36.38 31.65 1lwt s VAL 451 CO 0.29 -0.56 -0.14 0.68 0.00 0.00 0.00 175.10 175.37 1lwt s VAL 452 N 4.07 1.79 0.22 2.92 -7.23 -0.63 -4.48 120.40 117.06 1lwt s VAL 452 Ca 0.50 -2.22 0.03 0.00 -1.81 0.00 0.00 61.98 58.48 1lwt s VAL 452 Cb -0.13 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.67 1lwt s VAL 452 CO 0.21 -0.55 0.36 -2.28 -0.31 0.00 0.00 175.10 172.52 1lwt s HIS 453 N -2.94 3.47 -2.00 2.82 2.46 -1.25 -0.31 115.29 117.54 1lwt s HIS 453 Ca 0.24 0.10 0.32 0.00 0.47 0.00 0.00 55.06 56.18 1lwt s HIS 453 Cb -0.01 -1.66 1.89 0.00 -0.13 0.00 0.00 32.58 32.67 1lwt s HIS 453 CO 0.08 0.43 2.21 0.27 -2.47 0.00 0.00 174.74 175.26