#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ll6 n SER 16 N 0.00 1.11 -0.18 1.08 7.64 -1.26 -4.47 113.62 117.53 3ll6 n SER 16 Ca 0.00 -1.71 0.15 0.00 1.01 0.00 0.00 58.87 58.31 3ll6 n SER 16 Cb 0.00 -0.05 0.77 0.00 -1.01 0.00 0.00 64.21 63.91 3ll6 n SER 16 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3ll6 n ASP 17 N -0.35 0.56 0.06 6.43 2.03 -1.26 -3.83 116.55 120.19 3ll6 n ASP 17 Ca 0.01 -1.21 -0.19 0.00 0.52 0.00 0.00 54.79 53.93 3ll6 n ASP 17 Cb 0.42 -0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.67 3ll6 n ASP 17 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 3ll6 h PHE 18 N 0.87 0.52 -2.45 -0.67 3.57 -1.99 -3.43 116.94 113.35 3ll6 h PHE 18 Ca 0.00 -0.38 -0.59 0.00 3.53 0.00 0.00 57.97 60.54 3ll6 h PHE 18 Cb 0.19 -0.02 0.07 0.00 2.79 0.00 0.00 35.95 38.97 3ll6 h PHE 18 CO 0.00 1.47 0.70 0.28 -2.23 0.00 0.00 178.31 178.54 3ll6 n VAL 19 N -3.48 0.46 0.00 1.41 0.31 -1.25 -1.48 118.33 114.30 3ll6 n VAL 19 Ca -0.19 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 3ll6 n VAL 19 Cb 1.05 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 3ll6 n VAL 19 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ll6 n GLY 20 N 2.77 3.31 3.74 2.92 0.00 0.26 -5.03 105.19 113.15 3ll6 n GLY 20 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3ll6 n GLY 20 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ll6 s GLN 21 N -0.61 0.90 -0.06 1.61 -0.21 -0.55 -4.77 119.66 115.96 3ll6 s GLN 21 Ca 0.00 0.44 0.05 0.00 0.02 0.00 0.00 55.36 55.87 3ll6 s GLN 21 Cb 0.00 -1.80 -0.00 0.00 1.00 0.00 0.00 33.01 32.21 3ll6 s GLN 21 CO 0.00 -2.40 -0.21 0.99 -2.12 0.00 0.00 175.29 171.55 3ll6 s THR 22 N -3.11 1.76 -0.06 -0.19 2.01 -1.26 -1.30 115.64 113.49 3ll6 s THR 22 Ca 0.64 -0.89 0.04 0.00 0.31 0.00 0.00 61.69 61.79 3ll6 s THR 22 Cb -0.17 -1.51 -0.00 0.00 0.01 0.00 0.00 72.50 70.84 3ll6 s THR 22 CO 0.55 0.50 -0.19 -0.69 -0.69 0.00 0.00 174.62 174.10 3ll6 s VAL 23 N 0.03 1.64 -0.21 3.82 1.01 0.28 -4.90 120.40 122.07 3ll6 s VAL 23 Ca -0.06 -0.81 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 3ll6 s VAL 23 Cb -0.14 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.78 3ll6 s VAL 23 CO 0.04 0.47 0.16 -1.61 0.00 0.00 0.00 175.10 174.15 3ll6 s GLU 24 N 0.15 4.17 -0.35 2.72 2.02 -1.26 -0.62 118.70 125.52 3ll6 s GLU 24 Ca -0.08 -0.19 -0.00 0.00 0.02 0.00 0.00 54.97 54.71 3ll6 s GLU 24 Cb -0.14 -3.45 0.12 0.00 0.10 0.00 0.00 34.13 30.76 3ll6 s GLU 24 CO 0.04 0.23 0.17 -1.17 0.02 0.00 0.00 175.26 174.56 3ll6 s LEU 25 N 0.55 1.64 0.00 1.80 2.96 -0.36 -5.00 118.68 120.26 3ll6 s LEU 25 Ca 0.09 -1.99 0.00 0.00 -0.22 0.00 0.00 54.13 52.01 3ll6 s LEU 25 Cb -0.12 -0.66 0.00 0.00 0.50 0.00 0.00 46.19 45.91 3ll6 s LEU 25 CO 0.00 -0.35 0.00 0.61 -1.32 0.00 0.00 176.35 175.29 3ll6 n GLY 26 N 4.35 4.22 0.06 7.98 0.00 -1.26 -0.94 105.19 119.60 3ll6 n GLY 26 Ca 0.04 0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.30 3ll6 n GLY 26 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3ll6 n GLU 27 N 13.90 0.15 -2.66 1.61 0.00 -1.26 -4.83 120.64 127.55 3ll6 n GLU 27 Ca 0.00 0.11 -0.40 0.00 0.00 0.00 0.00 57.16 56.87 3ll6 n GLU 27 Cb 0.00 -1.66 -0.05 0.00 0.00 0.00 0.00 31.44 29.73 3ll6 n GLU 27 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3ll6 s LEU 28 N -3.85 4.58 -0.33 -1.84 1.43 -0.11 -4.93 118.68 113.63 3ll6 s LEU 28 Ca 0.11 2.00 0.03 0.00 -1.03 0.00 0.00 54.13 55.25 3ll6 s LEU 28 Cb 0.15 -3.61 0.10 0.00 0.03 0.00 0.00 46.19 42.86 3ll6 s LEU 28 CO 0.59 0.01 0.05 -0.60 0.23 0.00 0.00 176.35 176.64 3ll6 s ARG 29 N -0.92 1.39 -0.33 1.70 3.52 -1.26 -1.22 118.95 121.83 3ll6 s ARG 29 Ca 0.44 -1.71 -0.11 0.00 -0.13 0.00 0.00 55.73 54.22 3ll6 s ARG 29 Cb -0.27 -2.99 -0.01 0.00 -1.56 0.00 0.00 34.95 30.12 3ll6 s ARG 29 CO 0.34 -0.93 0.19 -0.51 -0.81 0.00 0.00 175.30 173.58 3ll6 s LEU 30 N 1.03 4.32 -0.06 -0.88 1.43 0.20 -0.77 118.68 123.96 3ll6 s LEU 30 Ca 0.10 -0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 52.38 3ll6 s LEU 30 Cb -0.19 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 3ll6 s LEU 30 CO -0.11 -0.22 1.20 -0.13 0.23 0.00 0.00 176.35 177.32 3ll6 s ARG 31 N 1.65 4.35 -0.46 1.70 1.81 0.24 -0.56 118.95 127.69 3ll6 s ARG 31 Ca 0.05 1.67 -0.24 0.00 -1.72 0.00 0.00 55.73 55.48 3ll6 s ARG 31 Cb -0.17 -3.56 0.03 0.00 -0.45 0.00 0.00 34.95 30.79 3ll6 s ARG 31 CO 0.08 -0.45 0.85 0.08 -0.68 0.00 0.00 175.30 175.18 3ll6 s VAL 32 N 2.23 4.56 -0.13 3.52 1.01 -0.42 -1.33 120.40 129.84 3ll6 s VAL 32 Ca 0.56 0.54 -0.06 0.00 0.00 0.00 0.00 61.98 63.02 3ll6 s VAL 32 Cb -0.24 -4.38 -0.25 0.00 0.00 0.00 0.00 36.38 31.50 3ll6 s VAL 32 CO 0.22 -0.79 0.31 -1.14 0.00 0.00 0.00 175.10 173.69 3ll6 n ARG 33 N 6.95 0.75 -3.61 2.72 3.00 0.44 -0.58 116.66 126.33 3ll6 n ARG 33 Ca 0.04 0.25 -0.03 0.00 -0.00 0.00 0.00 57.85 58.11 3ll6 n ARG 33 Cb 0.48 -1.69 -0.02 0.00 0.00 0.00 0.00 32.46 31.23 3ll6 n ARG 33 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 3ll6 s ARG 34 N -2.55 0.22 0.16 -0.14 1.70 -1.22 -4.74 118.95 112.38 3ll6 s ARG 34 Ca -0.24 -0.08 -0.30 0.00 -0.47 0.00 0.00 55.73 54.64 3ll6 s ARG 34 Cb 0.07 0.10 -0.07 0.00 -0.57 0.00 0.00 34.95 34.48 3ll6 s ARG 34 CO 0.75 -0.10 1.05 0.08 -1.08 0.00 0.00 175.30 176.01 3ll6 s VAL 35 N -2.29 4.08 -0.14 4.99 1.01 -1.26 -0.66 120.40 126.13 3ll6 s VAL 35 Ca 0.10 1.79 0.06 0.00 0.00 0.00 0.00 61.98 63.93 3ll6 s VAL 35 Cb -0.01 -4.14 -0.13 0.00 0.00 0.00 0.00 36.38 32.10 3ll6 s VAL 35 CO -0.04 0.30 -0.04 0.18 0.00 0.00 0.00 175.10 175.50 3ll6 n LEU 36 N 2.47 1.42 -3.48 3.92 4.77 0.88 -4.84 117.00 122.14 3ll6 n LEU 36 Ca 0.02 -0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 55.81 3ll6 n LEU 36 Cb 0.47 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 3ll6 n LEU 36 CO 0.53 0.53 0.42 0.00 -1.33 0.00 0.00 177.39 177.53 3ll6 s ALA 37 N -2.31 -1.69 0.00 -1.18 0.00 -0.98 -4.99 121.76 110.61 3ll6 s ALA 37 Ca -0.13 0.95 0.00 0.00 0.00 0.00 0.00 51.96 52.77 3ll6 s ALA 37 Cb 0.05 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.55 3ll6 s ALA 37 CO 0.44 -0.54 0.00 -0.85 0.00 0.00 0.00 175.76 174.81 3ll6 n GLU 38 N 0.35 0.00 -0.38 0.00 0.28 -1.26 -0.66 120.64 118.97 3ll6 n GLU 38 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.82 3ll6 n GLU 38 Cb 0.60 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.47 3ll6 n GLU 38 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3ll6 n GLY 39 N 0.00 0.74 3.86 -1.84 0.00 -1.17 -4.89 105.19 101.89 3ll6 n GLY 39 Ca 0.00 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.82 3ll6 n GLY 39 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ll6 s GLY 40 N 0.00 2.36 -0.68 -0.02 0.00 -1.26 -3.71 107.32 104.00 3ll6 s GLY 40 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.50 3ll6 s GLY 40 CO 0.00 -0.02 1.77 0.33 0.00 0.00 0.00 173.10 175.18 3ll6 n PHE 41 N 0.34 3.11 -4.83 1.90 -0.00 -1.26 -4.99 117.46 111.73 3ll6 n PHE 41 Ca -0.03 -2.62 -0.28 0.00 -0.00 0.00 0.00 57.45 54.53 3ll6 n PHE 41 Cb 0.52 -0.94 -0.17 0.00 -0.00 0.00 0.00 39.48 38.89 3ll6 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3ll6 s ALA 42 N -3.88 1.63 0.14 3.13 0.00 -1.24 -1.65 121.76 119.89 3ll6 s ALA 42 Ca 0.54 -0.64 0.05 0.00 0.00 0.00 0.00 51.96 51.90 3ll6 s ALA 42 Cb 0.44 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 3ll6 s ALA 42 CO -0.25 0.17 0.12 -0.06 0.00 0.00 0.00 175.76 175.74 3ll6 s PHE 43 N 0.55 3.15 -0.12 0.00 0.08 -0.98 -3.04 117.98 117.63 3ll6 s PHE 43 Ca -0.16 0.00 0.03 0.00 0.12 0.00 0.00 56.93 56.92 3ll6 s PHE 43 Cb -0.17 -1.54 0.01 0.00 -0.57 0.00 0.00 43.02 40.76 3ll6 s PHE 43 CO 0.06 0.52 -0.21 0.08 -0.10 0.00 0.00 175.22 175.57 3ll6 s VAL 44 N -1.65 1.89 0.22 -0.44 1.01 0.17 -0.95 120.40 120.65 3ll6 s VAL 44 Ca 0.30 -0.90 0.11 0.00 0.00 0.00 0.00 61.98 61.49 3ll6 s VAL 44 Cb -0.11 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 3ll6 s VAL 44 CO 0.23 0.52 -0.16 -0.31 0.00 0.00 0.00 175.10 175.38 3ll6 s TYR 45 N 0.69 2.44 -0.01 5.22 2.02 0.49 -0.09 117.35 128.11 3ll6 s TYR 45 Ca -0.11 -0.30 -0.24 0.00 -0.37 0.00 0.00 57.07 56.06 3ll6 s TYR 45 Cb -0.16 -1.15 -0.05 0.00 -0.40 0.00 0.00 41.96 40.21 3ll6 s TYR 45 CO 0.02 0.58 0.71 -2.00 -1.57 0.00 0.00 175.55 173.29 3ll6 s GLU 46 N -3.08 4.44 0.03 -0.62 2.12 0.16 -0.91 118.70 120.85 3ll6 s GLU 46 Ca 0.26 0.93 0.04 0.00 0.36 0.00 0.00 54.97 56.56 3ll6 s GLU 46 Cb -0.07 -3.40 -0.02 0.00 0.26 0.00 0.00 34.13 30.90 3ll6 s GLU 46 CO 0.14 0.20 -0.12 0.00 -0.54 0.00 0.00 175.26 174.94 3ll6 s ALA 47 N 0.30 0.97 -0.07 6.30 0.00 -0.45 -0.42 121.76 128.39 3ll6 s ALA 47 Ca 0.37 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.62 3ll6 s ALA 47 Cb -0.19 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 22.81 3ll6 s ALA 47 CO 0.20 0.17 -0.09 -1.14 0.00 0.00 0.00 175.76 174.90 3ll6 s GLN 48 N -1.02 1.44 -0.03 0.00 0.74 -0.44 -0.65 119.66 119.70 3ll6 s GLN 48 Ca 0.00 -0.30 -0.30 0.00 0.05 0.00 0.00 55.36 54.81 3ll6 s GLN 48 Cb -0.07 -1.31 -0.03 0.00 1.10 0.00 0.00 33.01 32.70 3ll6 s GLN 48 CO 0.01 -0.07 1.16 0.34 -0.55 0.00 0.00 175.29 176.18 3ll6 s ASP 49 N 0.98 7.10 0.06 6.67 2.15 0.40 -0.59 116.67 133.43 3ll6 s ASP 49 Ca -0.09 1.81 -0.19 0.00 0.43 0.00 0.00 52.55 54.51 3ll6 s ASP 49 Cb -0.15 -2.56 -0.12 0.00 -0.30 0.00 0.00 42.92 39.79 3ll6 s ASP 49 CO 0.00 -0.52 1.41 0.58 -0.17 0.00 0.00 175.17 176.46 3ll6 h VAL 50 N 4.91 1.31 0.00 1.11 2.07 -1.28 0.20 116.25 124.58 3ll6 h VAL 50 Ca -0.36 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 65.96 3ll6 h VAL 50 Cb 1.17 1.69 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 3ll6 h VAL 50 CO 0.85 0.36 -0.03 1.23 0.02 0.00 0.00 177.57 180.01 3ll6 h GLY 51 N 0.10 0.00 0.00 2.17 0.00 -1.92 -3.35 103.07 100.08 3ll6 h GLY 51 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 3ll6 h GLY 51 CO 0.03 0.00 -0.43 -1.14 0.00 0.00 0.00 176.54 175.00 3ll6 n SER 52 N -3.20 2.16 0.00 0.19 3.41 -1.20 -5.01 113.62 109.97 3ll6 n SER 52 Ca -0.01 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 3ll6 n SER 52 Cb 0.22 0.66 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 3ll6 n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ll6 n GLY 53 N 1.31 0.66 3.77 5.00 0.00 0.71 -5.01 105.19 111.63 3ll6 n GLY 53 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3ll6 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ll6 s ARG 54 N -0.34 3.09 -0.02 1.61 0.52 -1.24 -4.66 118.95 117.90 3ll6 s ARG 54 Ca 0.00 1.48 0.04 0.00 -0.52 0.00 0.00 55.73 56.73 3ll6 s ARG 54 Cb 0.00 -1.98 -0.03 0.00 0.52 0.00 0.00 34.95 33.46 3ll6 s ARG 54 CO 0.00 -1.04 -0.14 -1.21 0.02 0.00 0.00 175.30 172.93 3ll6 s GLU 55 N -3.71 2.42 0.11 3.54 2.02 -1.26 -0.46 118.70 121.36 3ll6 s GLU 55 Ca 0.69 -0.75 -0.01 0.00 0.02 0.00 0.00 54.97 54.92 3ll6 s GLU 55 Cb -0.22 -2.36 -0.04 0.00 0.10 0.00 0.00 34.13 31.61 3ll6 s GLU 55 CO 0.34 0.60 0.02 0.71 0.02 0.00 0.00 175.26 176.96 3ll6 s TYR 56 N -0.81 0.77 -0.16 1.61 2.02 0.18 -4.28 117.35 116.69 3ll6 s TYR 56 Ca 0.13 -1.16 -0.14 0.00 -0.37 0.00 0.00 57.07 55.52 3ll6 s TYR 56 Cb -0.11 -0.46 -0.05 0.00 -0.40 0.00 0.00 41.96 40.94 3ll6 s TYR 56 CO 0.02 -0.45 0.32 0.00 -1.57 0.00 0.00 175.55 173.87 3ll6 s ALA 57 N -3.98 3.57 -0.23 3.71 0.00 0.44 -1.34 121.76 123.93 3ll6 s ALA 57 Ca 0.18 -0.42 -0.00 0.00 0.00 0.00 0.00 51.96 51.72 3ll6 s ALA 57 Cb 0.08 -2.43 0.03 0.00 0.00 0.00 0.00 23.12 20.80 3ll6 s ALA 57 CO -0.02 0.08 -0.11 -1.17 0.00 0.00 0.00 175.76 174.54 3ll6 s LEU 58 N 0.49 2.92 -0.18 0.00 2.96 -0.09 -0.61 118.68 124.16 3ll6 s LEU 58 Ca 0.18 -0.86 -0.10 0.00 -0.22 0.00 0.00 54.13 53.13 3ll6 s LEU 58 Cb -0.13 -1.60 -0.05 0.00 0.50 0.00 0.00 46.19 44.91 3ll6 s LEU 58 CO 0.05 -0.09 0.15 -0.75 -1.32 0.00 0.00 176.35 174.38 3ll6 s LYS 59 N 1.29 4.09 -0.20 1.98 2.20 0.13 -0.38 119.74 128.84 3ll6 s LYS 59 Ca 0.01 -0.17 -0.02 0.00 -0.36 0.00 0.00 55.97 55.43 3ll6 s LYS 59 Cb -0.16 -3.39 0.01 0.00 -1.51 0.00 0.00 37.83 32.78 3ll6 s LYS 59 CO -0.07 0.36 -0.11 0.50 -0.36 0.00 0.00 175.35 175.68 3ll6 s ARG 60 N 0.16 3.18 -0.16 4.03 3.52 -0.12 -0.40 118.95 129.16 3ll6 s ARG 60 Ca 0.10 -0.73 0.02 0.00 -0.13 0.00 0.00 55.73 54.98 3ll6 s ARG 60 Cb -0.11 -2.82 0.02 0.00 -1.56 0.00 0.00 34.95 30.47 3ll6 s ARG 60 CO -0.00 -0.21 -0.21 -0.51 -0.81 0.00 0.00 175.30 173.56 3ll6 s LEU 61 N 1.39 2.10 -0.08 -0.88 1.02 0.18 -2.33 118.68 120.08 3ll6 s LEU 61 Ca 0.05 -0.63 -0.04 0.00 0.02 0.00 0.00 54.13 53.54 3ll6 s LEU 61 Cb -0.14 -1.45 -0.04 0.00 0.02 0.00 0.00 46.19 44.58 3ll6 s LEU 61 CO -0.07 0.03 0.08 -0.76 0.02 0.00 0.00 176.35 175.65 3ll6 s LEU 62 N 1.11 4.03 -0.01 1.79 1.43 -0.66 -0.85 118.68 125.52 3ll6 s LEU 62 Ca 0.00 0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.41 3ll6 s LEU 62 Cb -0.14 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.05 3ll6 s LEU 62 CO -0.09 0.37 -0.01 -0.55 0.23 0.00 0.00 176.35 176.30 3ll6 s SER 63 N -1.13 0.28 0.00 2.29 0.15 -0.43 -4.86 113.70 110.00 3ll6 s SER 63 Ca 0.16 -0.03 0.04 0.00 0.70 0.00 0.00 55.95 56.82 3ll6 s SER 63 Cb -0.12 -0.09 0.10 0.00 -1.71 0.00 0.00 66.02 64.20 3ll6 s SER 63 CO 0.06 -0.02 1.02 -0.46 1.20 0.00 0.00 173.24 175.04 3ll6 n ASN 64 N 3.44 2.18 -4.00 5.45 0.23 -1.26 -0.28 115.26 121.02 3ll6 n ASN 64 Ca -0.18 -1.87 -0.09 0.00 -0.53 0.00 0.00 54.58 51.91 3ll6 n ASN 64 Cb 0.56 -0.07 -0.11 0.00 -2.08 0.00 0.00 39.78 38.08 3ll6 n ASN 64 CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 3ll6 s GLU 65 N -0.90 0.42 0.39 -3.83 -1.05 -1.26 -5.03 118.70 107.44 3ll6 s GLU 65 Ca 0.08 -0.77 0.06 0.00 -0.15 0.00 0.00 54.97 54.19 3ll6 s GLU 65 Cb 0.04 0.15 0.77 0.00 -0.44 0.00 0.00 34.13 34.66 3ll6 s GLU 65 CO 0.06 -0.08 2.01 1.05 0.95 0.00 0.00 175.26 179.25 3ll6 h GLU 66 N 4.16 0.56 -0.43 -4.83 4.11 -1.99 -0.96 114.58 115.21 3ll6 h GLU 66 Ca -0.32 -0.05 -0.08 0.00 0.07 0.00 0.00 59.36 58.97 3ll6 h GLU 66 Cb 1.19 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 3ll6 h GLU 66 CO 0.48 0.42 -0.05 0.93 0.07 0.00 0.00 179.01 180.86 3ll6 h GLU 67 N 0.57 0.73 -0.06 1.06 3.07 -1.99 -0.72 114.58 117.25 3ll6 h GLU 67 Ca 0.15 -0.21 -0.22 0.00 -0.50 0.00 0.00 59.36 58.57 3ll6 h GLU 67 Cb 0.03 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 27.87 3ll6 h GLU 67 CO -0.02 0.78 -0.87 -0.22 -1.40 0.00 0.00 179.01 177.28 3ll6 h LYS 68 N 0.68 0.55 -0.66 2.33 3.64 -1.75 -1.31 116.57 120.04 3ll6 h LYS 68 Ca 0.13 -0.51 0.13 0.00 -1.27 0.00 0.00 60.65 59.13 3ll6 h LYS 68 Cb 0.49 0.13 -0.10 0.00 -0.41 0.00 0.00 32.23 32.35 3ll6 h LYS 68 CO 0.03 1.14 0.15 -0.91 -2.27 0.00 0.00 179.45 177.59 3ll6 h ASN 69 N 0.34 0.02 0.09 4.20 2.35 -0.85 0.14 115.58 121.87 3ll6 h ASN 69 Ca -0.07 0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 3ll6 h ASN 69 Cb 1.49 0.17 0.00 0.00 0.05 0.00 0.00 38.32 40.03 3ll6 h ASN 69 CO 0.16 -0.00 -0.05 -0.09 -1.65 0.00 0.00 177.43 175.80 3ll6 h ARG 70 N 0.27 -0.12 -0.58 0.81 2.43 -0.89 -1.12 114.38 115.18 3ll6 h ARG 70 Ca 0.36 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.53 3ll6 h ARG 70 Cb 0.56 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 3ll6 h ARG 70 CO -0.45 -0.05 0.33 0.00 -1.51 0.00 0.00 179.97 178.29 3ll6 h ALA 71 N 0.74 1.48 0.05 2.80 0.00 -0.48 -1.15 119.26 122.71 3ll6 h ALA 71 Ca -0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3ll6 h ALA 71 Cb 0.13 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3ll6 h ALA 71 CO 0.02 0.44 -0.02 0.82 0.00 0.00 0.00 179.25 180.50 3ll6 h ILE 72 N 0.81 1.20 -0.18 0.00 2.04 -0.73 -1.50 117.51 119.14 3ll6 h ILE 72 Ca 0.21 -0.83 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 3ll6 h ILE 72 Cb 0.00 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 3ll6 h ILE 72 CO -0.04 0.21 -0.06 0.40 0.00 0.00 0.00 178.15 178.66 3ll6 h ILE 73 N -0.43 1.16 -0.51 -0.67 2.04 -1.09 -1.57 117.51 116.43 3ll6 h ILE 73 Ca -0.01 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 3ll6 h ILE 73 Cb 0.39 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 3ll6 h ILE 73 CO 0.01 0.21 0.18 -0.61 0.00 0.00 0.00 178.15 177.94 3ll6 h GLN 74 N 0.27 0.78 0.03 2.37 5.75 -1.09 -0.20 115.11 123.02 3ll6 h GLN 74 Ca 0.06 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.40 3ll6 h GLN 74 Cb 0.29 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.72 3ll6 h GLN 74 CO 0.01 0.72 -0.01 1.49 -2.65 0.00 0.00 178.83 178.39 3ll6 h GLU 75 N 0.69 -0.03 -0.98 1.69 4.81 -0.39 -0.83 114.58 119.55 3ll6 h GLU 75 Ca 0.17 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.50 3ll6 h GLU 75 Cb 0.24 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.55 3ll6 h GLU 75 CO -0.01 -0.01 0.61 0.28 -0.73 0.00 0.00 179.01 179.15 3ll6 h VAL 76 N -0.05 0.95 -0.17 0.32 2.07 -1.12 -0.66 116.25 117.60 3ll6 h VAL 76 Ca -0.00 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.05 3ll6 h VAL 76 Cb 0.04 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.66 3ll6 h VAL 76 CO 0.01 0.18 -0.44 0.00 0.02 0.00 0.00 177.57 177.34 3ll6 h PHE 78 N 0.33 1.03 -0.01 0.00 0.04 -0.48 -1.67 116.94 116.17 3ll6 h PHE 78 Ca 0.03 -0.40 0.02 0.00 2.80 0.00 0.00 57.97 60.41 3ll6 h PHE 78 Cb 0.90 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.85 3ll6 h PHE 78 CO 0.03 1.22 -0.10 0.52 -0.60 0.00 0.00 178.31 179.38 3ll6 h MET 79 N 0.58 -0.16 -0.69 1.51 2.86 -0.74 -1.12 114.93 117.17 3ll6 h MET 79 Ca -0.02 0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.66 3ll6 h MET 79 Cb 1.26 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.91 3ll6 h MET 79 CO 0.14 -0.10 0.44 -0.22 1.06 0.00 0.00 176.91 178.22 3ll6 h LYS 80 N -0.16 0.83 -0.40 1.72 3.64 -1.21 -1.55 116.57 119.44 3ll6 h LYS 80 Ca 0.04 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 3ll6 h LYS 80 Cb 0.22 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3ll6 h LYS 80 CO -0.11 0.55 -0.21 -0.22 -2.27 0.00 0.00 179.45 177.19 3ll6 h LYS 81 N 0.86 0.78 0.00 1.90 1.63 -0.83 -3.17 116.57 117.73 3ll6 h LYS 81 Ca 0.27 -0.31 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 3ll6 h LYS 81 Cb 0.00 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 3ll6 h LYS 81 CO -0.10 0.92 -0.55 1.28 -3.45 0.00 0.00 179.45 177.55 3ll6 n LEU 82 N -4.12 0.54 -4.75 5.20 4.77 -0.47 -4.92 117.00 113.26 3ll6 n LEU 82 Ca 0.00 0.08 -0.37 0.00 -0.03 0.00 0.00 56.01 55.69 3ll6 n LEU 82 Cb 0.43 -0.23 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 3ll6 n LEU 82 CO 0.44 0.07 0.89 -0.55 -1.33 0.00 0.00 177.39 176.91 3ll6 s SER 83 N -3.38 5.10 0.00 -1.43 0.15 -0.61 -3.40 113.70 110.13 3ll6 s SER 83 Ca 0.09 2.53 0.00 0.00 0.70 0.00 0.00 55.95 59.27 3ll6 s SER 83 Cb 0.16 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 3ll6 s SER 83 CO 0.71 -1.67 0.00 0.61 1.20 0.00 0.00 173.24 174.09 3ll6 n GLY 84 N 0.67 2.16 3.84 9.45 0.00 -1.26 -4.99 105.19 115.05 3ll6 n GLY 84 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 3ll6 n GLY 84 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ll6 s HIS 85 N -2.38 3.62 0.52 1.61 5.04 -1.22 -4.96 115.29 117.52 3ll6 s HIS 85 Ca 0.00 1.14 0.38 0.00 -1.54 0.00 0.00 55.06 55.04 3ll6 s HIS 85 Cb 0.00 -2.43 2.01 0.00 0.04 0.00 0.00 32.58 32.20 3ll6 s HIS 85 CO 0.00 0.41 2.24 -1.35 -2.34 0.00 0.00 174.74 173.70 3ll6 h PRO 86 N 3.52 0.00 -0.29 2.88 0.11 -1.97 -2.18 132.00 134.07 3ll6 h PRO 86 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 3ll6 h PRO 86 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3ll6 h PRO 86 CO 0.66 0.02 0.00 0.09 -0.21 0.00 0.00 178.00 178.56 3ll6 n ASN 87 N -3.29 3.99 -4.28 -2.05 4.13 -1.26 -4.86 115.26 107.64 3ll6 n ASN 87 Ca -0.02 -3.04 -0.32 0.00 1.68 0.00 0.00 54.58 52.88 3ll6 n ASN 87 Cb 0.14 -0.56 -0.16 0.00 -1.54 0.00 0.00 39.78 37.66 3ll6 n ASN 87 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3ll6 s ILE 88 N -2.85 2.25 0.19 2.41 1.01 -0.82 -1.07 121.20 122.32 3ll6 s ILE 88 Ca 0.43 -0.98 -0.33 0.00 0.00 0.00 0.00 60.65 59.77 3ll6 s ILE 88 Cb 0.35 -1.84 -0.14 0.00 0.01 0.00 0.00 42.46 40.84 3ll6 s ILE 88 CO 0.09 0.56 1.50 0.52 0.00 0.00 0.00 174.94 177.61 3ll6 n VAL 89 N 3.10 0.35 -2.28 2.92 0.31 -0.87 -4.67 118.33 117.19 3ll6 n VAL 89 Ca -0.18 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.64 3ll6 n VAL 89 Cb 0.52 -1.47 -0.03 0.00 -0.91 0.00 0.00 33.84 31.96 3ll6 n VAL 89 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 3ll6 s GLN 90 N 0.39 4.28 0.14 5.55 2.00 -1.26 -4.66 119.66 126.10 3ll6 s GLN 90 Ca 0.75 1.89 -0.30 0.00 -2.00 0.00 0.00 55.36 55.70 3ll6 s GLN 90 Cb -0.69 -3.63 -0.07 0.00 0.80 0.00 0.00 33.01 29.42 3ll6 s GLN 90 CO 0.43 -0.59 1.26 0.12 -0.50 0.00 0.00 175.29 176.01 3ll6 s PHE 91 N 2.63 3.36 -0.11 1.67 5.36 -1.26 -1.42 117.98 128.20 3ll6 s PHE 91 Ca 0.62 1.25 -0.05 0.00 -0.96 0.00 0.00 56.93 57.78 3ll6 s PHE 91 Cb -0.29 -3.51 -0.05 0.00 -0.34 0.00 0.00 43.02 38.83 3ll6 s PHE 91 CO 0.24 -1.61 -0.14 0.00 -1.46 0.00 0.00 175.22 172.25 3ll6 s SER 93 N -5.97 -0.27 -0.02 0.00 0.15 -0.85 -5.01 113.70 101.73 3ll6 s SER 93 Ca -0.16 -0.27 -0.12 0.00 0.70 0.00 0.00 55.95 56.10 3ll6 s SER 93 Cb 0.06 0.48 0.02 0.00 -1.71 0.00 0.00 66.02 64.87 3ll6 s SER 93 CO 0.20 -0.86 0.26 0.00 1.20 0.00 0.00 173.24 174.05 3ll6 s ALA 94 N -3.32 -0.65 0.18 5.45 0.00 -1.26 0.10 121.76 122.26 3ll6 s ALA 94 Ca 0.09 0.28 -0.16 0.00 0.00 0.00 0.00 51.96 52.17 3ll6 s ALA 94 Cb -0.02 0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.13 3ll6 s ALA 94 CO -0.02 -0.23 0.47 0.00 0.00 0.00 0.00 175.76 175.99 3ll6 s ALA 95 N -1.13 -0.78 0.00 0.00 0.00 0.11 -4.99 121.76 114.97 3ll6 s ALA 95 Ca -0.12 -0.32 0.02 0.00 0.00 0.00 0.00 51.96 51.55 3ll6 s ALA 95 Cb -0.05 0.84 -0.01 0.00 0.00 0.00 0.00 23.12 23.90 3ll6 s ALA 95 CO 0.03 -0.77 -0.07 -1.54 0.00 0.00 0.00 175.76 173.41 3ll6 s SER 96 N -2.88 0.85 -0.21 0.00 1.04 -1.26 0.01 113.70 111.25 3ll6 s SER 96 Ca 0.10 -0.17 -0.05 0.00 0.48 0.00 0.00 55.95 56.30 3ll6 s SER 96 Cb -0.00 -0.08 -0.02 0.00 0.10 0.00 0.00 66.02 66.02 3ll6 s SER 96 CO -0.03 0.06 0.01 -0.63 0.98 0.00 0.00 173.24 173.62 3ll6 s ILE 97 N -0.29 3.93 0.74 -1.02 1.01 0.13 -4.98 121.20 120.72 3ll6 s ILE 97 Ca 0.02 -0.31 -0.15 0.00 0.00 0.00 0.00 60.65 60.20 3ll6 s ILE 97 Cb -0.03 -2.79 0.03 0.00 0.01 0.00 0.00 42.46 39.68 3ll6 s ILE 97 CO -0.00 0.41 1.13 0.61 0.00 0.00 0.00 174.94 177.09 3ll6 n GLY 98 N 4.42 -0.06 0.31 6.18 0.00 -1.26 -0.46 105.19 114.32 3ll6 n GLY 98 Ca -0.17 -0.35 0.11 0.00 0.00 0.00 0.00 46.02 45.61 3ll6 n GLY 98 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3ll6 n LYS 99 N -2.38 -0.07 -0.05 1.61 4.81 -1.25 -1.71 118.16 119.11 3ll6 n LYS 99 Ca 0.14 1.33 -0.15 0.00 -0.87 0.00 0.00 58.31 58.76 3ll6 n LYS 99 Cb 0.49 -2.08 -0.07 0.00 0.02 0.00 0.00 35.03 33.40 3ll6 n LYS 99 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 3ll6 h GLU 100 N 0.00 0.65 0.00 1.64 9.09 -1.91 -3.18 114.58 120.88 3ll6 h GLU 100 Ca 0.50 -0.45 0.00 0.00 0.05 0.00 0.00 59.36 59.46 3ll6 h GLU 100 Cb 0.98 0.07 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 3ll6 h GLU 100 CO -0.85 1.07 -0.21 -0.85 0.05 0.00 0.00 179.01 178.23 3ll6 n GLU 101 N -4.18 0.05 -2.90 1.06 0.00 -1.01 -4.83 120.64 108.83 3ll6 n GLU 101 Ca -0.06 0.03 -0.41 0.00 0.00 0.00 0.00 57.16 56.72 3ll6 n GLU 101 Cb 0.58 -1.55 -0.04 0.00 0.00 0.00 0.00 31.44 30.43 3ll6 n GLU 101 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3ll6 s SER 102 N -3.26 7.21 0.00 -1.84 0.15 -0.70 -4.91 113.70 110.36 3ll6 s SER 102 Ca 0.12 1.45 0.00 0.00 0.70 0.00 0.00 55.95 58.22 3ll6 s SER 102 Cb 0.17 -2.49 0.00 0.00 -1.71 0.00 0.00 66.02 62.00 3ll6 s SER 102 CO 0.61 -0.12 1.16 0.47 1.20 0.00 0.00 173.24 176.56 3ll6 n ASP 103 N 3.45 3.27 -0.00 5.45 9.92 -1.26 -2.44 116.55 134.93 3ll6 n ASP 103 Ca 0.01 -1.87 0.04 0.00 -0.53 0.00 0.00 54.79 52.45 3ll6 n ASP 103 Cb 0.51 -0.62 -0.07 0.00 -0.64 0.00 0.00 41.12 40.30 3ll6 n ASP 103 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 3ll6 n THR 104 N 0.97 0.00 -1.00 -3.53 -1.04 -1.26 -4.99 114.28 103.43 3ll6 n THR 104 Ca 0.00 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 3ll6 n THR 104 Cb 0.42 0.34 0.00 0.00 -1.82 0.00 0.00 70.33 69.27 3ll6 n THR 104 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ll6 n GLY 105 N 1.94 0.26 3.37 3.41 0.00 -1.02 -5.04 105.19 108.11 3ll6 n GLY 105 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 3ll6 n GLY 105 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ll6 s GLN 106 N -0.97 1.41 0.50 1.61 -0.21 -1.26 -4.89 119.66 115.86 3ll6 s GLN 106 Ca 0.00 -1.67 -0.22 0.00 0.02 0.00 0.00 55.36 53.48 3ll6 s GLN 106 Cb 0.00 -1.07 -0.06 0.00 1.00 0.00 0.00 33.01 32.88 3ll6 s GLN 106 CO 0.00 0.10 1.29 0.00 -2.12 0.00 0.00 175.29 174.55 3ll6 s ALA 107 N -3.04 2.91 -0.07 6.09 0.00 0.62 -3.87 121.76 124.40 3ll6 s ALA 107 Ca 0.26 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.41 3ll6 s ALA 107 Cb 0.02 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.66 3ll6 s ALA 107 CO 0.09 -1.08 -0.05 -2.00 0.00 0.00 0.00 175.76 172.72 3ll6 s GLU 108 N -2.78 1.07 -0.04 0.00 2.12 0.39 -1.32 118.70 118.14 3ll6 s GLU 108 Ca 0.68 -0.14 0.06 0.00 0.36 0.00 0.00 54.97 55.92 3ll6 s GLU 108 Cb -0.36 -1.11 -0.02 0.00 0.26 0.00 0.00 34.13 32.90 3ll6 s GLU 108 CO 0.43 -0.14 -0.20 -0.06 -0.54 0.00 0.00 175.26 174.75 3ll6 s PHE 109 N 1.24 2.52 -0.14 5.30 0.08 -0.03 0.22 117.98 127.18 3ll6 s PHE 109 Ca -0.05 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 56.65 3ll6 s PHE 109 Cb -0.14 -1.58 0.02 0.00 -0.57 0.00 0.00 43.02 40.75 3ll6 s PHE 109 CO -0.02 0.04 -0.14 -0.51 -0.10 0.00 0.00 175.22 174.49 3ll6 s LEU 110 N -0.59 1.65 -0.21 -0.37 1.02 0.10 -0.65 118.68 119.63 3ll6 s LEU 110 Ca 0.09 -0.46 0.01 0.00 0.02 0.00 0.00 54.13 53.79 3ll6 s LEU 110 Cb -0.11 -1.13 0.03 0.00 0.02 0.00 0.00 46.19 45.00 3ll6 s LEU 110 CO 0.00 -0.05 -0.15 -0.76 0.02 0.00 0.00 176.35 175.42 3ll6 s LEU 111 N 1.40 2.68 -0.21 1.79 1.02 0.46 -0.71 118.68 125.11 3ll6 s LEU 111 Ca 0.02 -0.90 -0.05 0.00 0.02 0.00 0.00 54.13 53.23 3ll6 s LEU 111 Cb -0.13 -1.53 -0.02 0.00 0.02 0.00 0.00 46.19 44.53 3ll6 s LEU 111 CO -0.09 -0.07 -0.00 -0.22 0.02 0.00 0.00 176.35 175.99 3ll6 s LEU 112 N 1.24 3.21 0.35 1.79 2.96 0.11 -0.70 118.68 127.65 3ll6 s LEU 112 Ca 0.00 -0.23 0.04 0.00 -0.22 0.00 0.00 54.13 53.72 3ll6 s LEU 112 Cb -0.16 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 3ll6 s LEU 112 CO -0.09 0.04 0.15 0.42 -1.32 0.00 0.00 176.35 175.55 3ll6 s THR 113 N 1.13 0.49 0.35 3.68 -4.23 0.22 -1.09 115.64 116.20 3ll6 s THR 113 Ca 0.03 -2.00 -0.26 0.00 -1.18 0.00 0.00 61.69 58.28 3ll6 s THR 113 Cb -0.14 -2.47 -0.12 0.00 1.34 0.00 0.00 72.50 71.10 3ll6 s THR 113 CO 0.01 0.00 0.97 1.21 -0.54 0.00 0.00 174.62 176.27 3ll6 n GLU 114 N -0.72 1.30 -3.31 3.99 2.13 -0.51 -0.42 120.64 123.09 3ll6 n GLU 114 Ca -0.02 0.46 -0.38 0.00 0.66 0.00 0.00 57.16 57.88 3ll6 n GLU 114 Cb 0.65 -1.90 -0.07 0.00 0.27 0.00 0.00 31.44 30.39 3ll6 n GLU 114 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 3ll6 s LEU 115 N 0.16 4.19 0.59 4.31 2.96 -1.26 -3.85 118.68 125.78 3ll6 s LEU 115 Ca 0.61 0.67 0.03 0.00 -0.22 0.00 0.00 54.13 55.22 3ll6 s LEU 115 Cb -0.63 -2.65 0.07 0.00 0.50 0.00 0.00 46.19 43.48 3ll6 s LEU 115 CO 0.59 -0.10 0.82 0.00 -1.32 0.00 0.00 176.35 176.34 3ll6 h LYS 117 N -0.02 0.10 0.00 0.00 3.64 -0.60 -3.46 116.57 116.24 3ll6 h LYS 117 Ca -0.38 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 3ll6 h LYS 117 Cb 1.28 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 3ll6 h LYS 117 CO 0.46 0.85 0.00 0.41 -2.27 0.00 0.00 179.45 178.90 3ll6 n GLY 118 N 0.72 -2.06 3.73 5.01 0.00 -1.11 -5.01 105.19 106.47 3ll6 n GLY 118 Ca -0.02 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 3ll6 n GLY 118 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ll6 s GLN 119 N -1.95 4.58 0.23 1.61 -1.52 -1.26 -0.59 119.66 120.76 3ll6 s GLN 119 Ca 0.00 1.64 -0.07 0.00 -1.95 0.00 0.00 55.36 54.98 3ll6 s GLN 119 Cb 0.00 -3.33 0.38 0.00 -0.22 0.00 0.00 33.01 29.84 3ll6 s GLN 119 CO 0.00 0.03 1.70 1.25 -0.25 0.00 0.00 175.29 178.02 3ll6 h LEU 120 N 5.68 0.06 -2.19 2.90 5.85 -1.53 -1.66 115.31 124.42 3ll6 h LEU 120 Ca -0.43 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 3ll6 h LEU 120 Cb 1.21 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.39 3ll6 h LEU 120 CO 0.74 0.02 -0.04 -0.37 -0.34 0.00 0.00 178.44 178.45 3ll6 h VAL 121 N 0.30 0.70 -0.36 1.05 -1.51 -1.80 -0.04 116.25 114.59 3ll6 h VAL 121 Ca 0.36 -0.16 -0.01 0.00 -1.23 0.00 0.00 66.70 65.67 3ll6 h VAL 121 Cb 0.57 1.09 -0.02 0.00 -2.13 0.00 0.00 31.29 30.80 3ll6 h VAL 121 CO -0.44 0.04 0.20 -0.08 -1.23 0.00 0.00 177.57 176.06 3ll6 h GLU 122 N 0.00 0.50 -0.04 5.19 4.81 -1.70 -1.34 114.58 122.00 3ll6 h GLU 122 Ca -0.00 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.03 3ll6 h GLU 122 Cb 0.09 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 3ll6 h GLU 122 CO 0.01 0.41 -0.62 0.74 -0.73 0.00 0.00 179.01 178.81 3ll6 h PHE 123 N 0.45 0.19 -0.43 0.92 -1.00 -1.05 -2.88 116.94 113.15 3ll6 h PHE 123 Ca 0.13 -0.07 -0.03 0.00 2.81 0.00 0.00 57.97 60.80 3ll6 h PHE 123 Cb 0.05 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.56 3ll6 h PHE 123 CO -0.03 0.73 0.15 -0.07 -1.61 0.00 0.00 178.31 177.48 3ll6 h LEU 124 N 0.11 0.61 -0.34 1.54 3.38 -1.02 -2.44 115.31 117.16 3ll6 h LEU 124 Ca -0.01 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 57.84 3ll6 h LEU 124 Cb 1.12 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.64 3ll6 h LEU 124 CO 0.09 0.64 -0.12 0.11 0.09 0.00 0.00 178.44 179.25 3ll6 h LYS 125 N 0.55 -0.05 -0.36 1.13 1.57 -1.12 -2.29 116.57 116.00 3ll6 h LYS 125 Ca 0.14 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.99 3ll6 h LYS 125 Cb 0.24 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.50 3ll6 h LYS 125 CO -0.01 -0.03 0.01 0.87 -0.57 0.00 0.00 179.45 179.72 3ll6 h LYS 126 N -0.05 0.11 0.00 3.15 6.56 -1.39 -1.93 116.57 123.02 3ll6 h LYS 126 Ca 0.17 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.75 3ll6 h LYS 126 Cb 0.31 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 31.94 3ll6 h LYS 126 CO -0.38 0.07 0.21 0.52 -2.06 0.00 0.00 179.45 177.82 3ll6 h MET 127 N 0.11 0.00 0.75 3.15 2.86 -0.93 -3.28 114.93 117.59 3ll6 h MET 127 Ca 0.18 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.78 3ll6 h MET 127 Cb 0.24 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.91 3ll6 h MET 127 CO -0.28 0.00 -0.36 0.93 1.06 0.00 0.00 176.91 178.26 3ll6 h GLU 128 N 0.00 -0.97 -0.29 1.72 5.08 -0.95 -2.23 114.58 116.95 3ll6 h GLU 128 Ca 0.00 0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 3ll6 h GLU 128 Cb 0.43 0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.85 3ll6 h GLU 128 CO 0.00 -0.63 -0.11 -1.13 -1.00 0.00 0.00 179.01 176.14 3ll6 n SER 129 N -5.51 -0.18 0.00 1.42 3.41 -1.24 0.23 113.62 111.76 3ll6 n SER 129 Ca -0.14 0.50 0.08 0.00 -0.26 0.00 0.00 58.87 59.05 3ll6 n SER 129 Cb 0.41 -0.12 0.35 0.00 -0.26 0.00 0.00 64.21 64.58 3ll6 n SER 129 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3ll6 n ARG 130 N -4.43 0.02 0.00 4.33 1.74 -0.84 -5.00 116.66 112.47 3ll6 n ARG 130 Ca 0.03 0.22 0.00 0.00 -0.77 0.00 0.00 57.85 57.33 3ll6 n ARG 130 Cb 0.12 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 3ll6 n ARG 130 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ll6 n GLY 131 N 0.15 -1.37 3.67 -0.13 0.00 0.64 -5.01 105.19 103.13 3ll6 n GLY 131 Ca 0.04 -2.10 -0.40 0.00 0.00 0.00 0.00 46.02 43.57 3ll6 n GLY 131 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3ll6 n PRO 132 N 0.00 1.48 -2.10 1.61 -0.02 -1.26 -4.60 135.00 130.10 3ll6 n PRO 132 Ca 0.00 0.54 -0.39 0.00 -2.02 0.00 0.00 63.50 61.63 3ll6 n PRO 132 Cb 0.00 -2.30 -0.01 0.00 -0.02 0.00 0.00 33.50 31.17 3ll6 n PRO 132 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ll6 s LEU 133 N -1.95 4.17 0.77 2.45 1.43 -1.26 -4.99 118.68 119.30 3ll6 s LEU 133 Ca 0.68 2.56 -0.13 0.00 -1.03 0.00 0.00 54.13 56.22 3ll6 s LEU 133 Cb -0.47 -3.98 0.06 0.00 0.03 0.00 0.00 46.19 41.83 3ll6 s LEU 133 CO 0.53 -0.87 1.15 -0.94 0.23 0.00 0.00 176.35 176.45 3ll6 s SER 134 N -0.89 4.10 0.40 2.29 1.04 -1.26 -4.86 113.70 114.52 3ll6 s SER 134 Ca 0.58 2.13 0.11 0.00 0.48 0.00 0.00 55.95 59.25 3ll6 s SER 134 Cb -0.36 -2.56 0.85 0.00 0.10 0.00 0.00 66.02 64.05 3ll6 s SER 134 CO 0.45 -2.32 1.94 0.00 0.98 0.00 0.00 173.24 174.30 3ll6 h ASP 136 N 0.17 1.10 -0.10 0.00 5.19 -1.98 0.10 116.42 120.89 3ll6 h ASP 136 Ca 0.03 -0.08 -0.08 0.00 -0.62 0.00 0.00 57.03 56.28 3ll6 h ASP 136 Cb 0.35 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.58 3ll6 h ASP 136 CO 0.02 0.86 -0.25 0.74 -3.12 0.00 0.00 179.24 177.49 3ll6 h THR 137 N 1.24 1.40 -0.56 0.35 2.02 -1.80 -1.25 112.91 114.32 3ll6 h THR 137 Ca 0.32 -1.58 0.08 0.00 0.77 0.00 0.00 66.41 66.00 3ll6 h THR 137 Cb -0.02 2.18 -0.07 0.00 -1.74 0.00 0.00 68.15 68.50 3ll6 h THR 137 CO -0.06 0.46 0.20 0.58 0.37 0.00 0.00 175.52 177.07 3ll6 h VAL 138 N -0.11 0.79 -0.09 3.16 2.07 -1.31 -0.63 116.25 120.13 3ll6 h VAL 138 Ca -0.00 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.41 3ll6 h VAL 138 Cb 0.86 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3ll6 h VAL 138 CO 0.05 0.07 -0.04 0.25 0.02 0.00 0.00 177.57 177.92 3ll6 h LEU 139 N 0.37 -0.13 -0.35 2.57 5.85 -0.65 -0.08 115.31 122.90 3ll6 h LEU 139 Ca 0.27 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.94 3ll6 h LEU 139 Cb 0.32 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 3ll6 h LEU 139 CO -0.28 -0.05 -0.12 0.11 -0.34 0.00 0.00 178.44 177.75 3ll6 h LYS 140 N -0.03 0.69 -0.27 1.25 1.57 -0.68 0.98 116.57 120.08 3ll6 h LYS 140 Ca 0.05 -0.28 0.01 0.00 -1.87 0.00 0.00 60.65 58.55 3ll6 h LYS 140 Cb 0.10 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 3ll6 h LYS 140 CO -0.11 0.87 0.17 0.82 -0.57 0.00 0.00 179.45 180.63 3ll6 h ILE 141 N 0.47 1.05 -0.18 1.86 2.04 -0.99 -2.04 117.51 119.73 3ll6 h ILE 141 Ca 0.08 -0.12 -0.15 0.00 1.00 0.00 0.00 64.86 65.67 3ll6 h ILE 141 Cb 0.64 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 3ll6 h ILE 141 CO 0.04 0.06 -0.48 0.15 0.00 0.00 0.00 178.15 177.93 3ll6 h PHE 142 N 0.35 0.82 -0.77 1.37 3.57 -0.88 -1.75 116.94 119.65 3ll6 h PHE 142 Ca 0.10 -0.32 0.04 0.00 3.53 0.00 0.00 57.97 61.32 3ll6 h PHE 142 Cb -0.02 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.52 3ll6 h PHE 142 CO -0.07 1.10 0.48 -0.92 -2.23 0.00 0.00 178.31 176.67 3ll6 h TYR 143 N 0.32 0.89 -0.07 0.41 3.20 -0.78 -0.68 116.97 120.25 3ll6 h TYR 143 Ca -0.01 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.73 3ll6 h TYR 143 Cb 1.09 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.06 3ll6 h TYR 143 CO 0.09 0.49 -0.63 1.96 -1.64 0.00 0.00 178.16 178.44 3ll6 h GLN 144 N 0.91 0.27 -0.36 1.82 4.20 -1.12 0.21 115.11 121.04 3ll6 h GLN 144 Ca 0.32 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.81 3ll6 h GLN 144 Cb 0.07 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3ll6 h GLN 144 CO -0.13 0.81 0.13 1.15 -0.67 0.00 0.00 178.83 180.12 3ll6 h THR 145 N 0.20 1.20 -0.22 -0.54 2.02 -1.00 -2.83 112.91 111.75 3ll6 h THR 145 Ca -0.01 -0.64 -0.10 0.00 0.77 0.00 0.00 66.41 66.42 3ll6 h THR 145 Cb 1.15 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 3ll6 h THR 145 CO 0.10 0.23 -0.30 0.00 0.37 0.00 0.00 175.52 175.92 3ll6 h ARG 147 N 0.38 1.11 -0.33 0.00 2.43 -0.88 0.22 114.38 117.30 3ll6 h ARG 147 Ca 0.05 -0.21 0.05 0.00 -0.81 0.00 0.00 59.98 59.06 3ll6 h ARG 147 Cb 0.72 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 30.05 3ll6 h ARG 147 CO 0.06 0.91 0.06 0.00 -1.51 0.00 0.00 179.97 179.49 3ll6 h ALA 148 N 1.14 0.35 -0.36 2.80 0.00 -1.24 -1.51 119.26 120.44 3ll6 h ALA 148 Ca 0.24 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 3ll6 h ALA 148 Cb 0.23 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3ll6 h ALA 148 CO -0.02 -0.34 -0.30 0.28 0.00 0.00 0.00 179.25 178.87 3ll6 h VAL 149 N 0.18 1.28 -1.00 0.00 2.07 -1.18 -2.14 116.25 115.46 3ll6 h VAL 149 Ca 0.16 -1.46 0.16 0.00 0.82 0.00 0.00 66.70 66.37 3ll6 h VAL 149 Cb 0.18 1.41 -0.09 0.00 -1.52 0.00 0.00 31.29 31.27 3ll6 h VAL 149 CO -0.21 0.48 0.62 -0.61 0.02 0.00 0.00 177.57 177.87 3ll6 h GLN 150 N 0.63 0.84 -0.72 1.57 4.15 -0.39 0.12 115.11 121.30 3ll6 h GLN 150 Ca 0.07 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 3ll6 h GLN 150 Cb 0.87 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 3ll6 h GLN 150 CO 0.08 0.56 0.30 1.25 -1.93 0.00 0.00 178.83 179.08 3ll6 h HIS 151 N 0.87 1.09 0.10 3.99 2.76 -0.77 -0.43 115.15 122.75 3ll6 h HIS 151 Ca 0.54 -0.08 -0.00 0.00 -2.20 0.00 0.00 60.37 58.62 3ll6 h HIS 151 Cb 0.71 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 29.34 3ll6 h HIS 151 CO -0.00 0.83 -0.05 0.52 -1.30 0.00 0.00 177.93 177.93 3ll6 h MET 152 N 1.03 -0.13 0.00 5.26 2.86 -0.60 -3.26 114.93 120.09 3ll6 h MET 152 Ca 0.24 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.85 3ll6 h MET 152 Cb 0.19 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 3ll6 h MET 152 CO -0.02 -0.01 -0.21 0.45 1.06 0.00 0.00 176.91 178.17 3ll6 h HIS 153 N -0.21 0.00 0.00 -0.22 -0.00 -0.53 -1.15 115.15 113.03 3ll6 h HIS 153 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 3ll6 h HIS 153 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.58 3ll6 h HIS 153 CO -0.05 0.21 0.00 0.54 -0.00 0.00 0.00 177.93 178.64 3ll6 n ARG 154 N -3.26 0.16 -0.67 2.45 1.74 -0.20 -4.44 116.66 112.45 3ll6 n ARG 154 Ca 0.01 0.15 -0.31 0.00 -0.77 0.00 0.00 57.85 56.93 3ll6 n ARG 154 Cb 0.50 -1.70 0.17 0.00 -1.02 0.00 0.00 32.46 30.42 3ll6 n ARG 154 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3ll6 n GLN 155 N -1.98 -0.69 -3.86 5.56 1.13 -0.98 -4.88 117.38 111.67 3ll6 n GLN 155 Ca 0.06 -0.14 -0.30 0.00 -1.94 0.00 0.00 57.00 54.68 3ll6 n GLN 155 Cb 0.39 -2.26 -0.14 0.00 0.11 0.00 0.00 30.24 28.33 3ll6 n GLN 155 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3ll6 s LYS 156 N -4.44 1.36 0.63 -1.09 1.02 -1.26 -1.88 119.74 114.07 3ll6 s LYS 156 Ca 0.65 -1.88 -0.06 0.00 0.02 0.00 0.00 55.97 54.71 3ll6 s LYS 156 Cb -0.23 -2.73 0.03 0.00 -0.52 0.00 0.00 37.83 34.38 3ll6 s LYS 156 CO 0.60 -1.04 0.93 -1.25 -0.92 0.00 0.00 175.35 173.68 3ll6 s PRO 157 N 0.68 2.68 0.51 -1.68 0.04 -1.26 -5.06 135.00 130.90 3ll6 s PRO 157 Ca 0.14 -0.11 -0.22 0.00 0.04 0.00 0.00 61.00 60.84 3ll6 s PRO 157 Cb -0.21 -2.25 -0.06 0.00 0.04 0.00 0.00 34.50 32.02 3ll6 s PRO 157 CO -0.08 -0.87 1.28 -2.14 0.04 0.00 0.00 177.00 175.22 3ll6 s PRO 158 N -5.07 3.42 -0.21 0.56 0.02 -0.79 -4.88 135.00 128.06 3ll6 s PRO 158 Ca 0.56 2.05 -0.09 0.00 0.02 0.00 0.00 61.00 63.54 3ll6 s PRO 158 Cb -0.11 -2.34 -0.04 0.00 0.02 0.00 0.00 34.50 32.03 3ll6 s PRO 158 CO 0.45 -0.91 0.10 0.42 -0.33 0.00 0.00 177.00 176.73 3ll6 s ILE 159 N -1.40 4.99 -0.14 2.83 1.01 -0.47 -4.53 121.20 123.49 3ll6 s ILE 159 Ca 0.68 0.04 -0.03 0.00 0.00 0.00 0.00 60.65 61.34 3ll6 s ILE 159 Cb -0.36 -3.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 3ll6 s ILE 159 CO 0.43 0.41 -0.05 -0.63 0.00 0.00 0.00 174.94 175.10 3ll6 s ILE 160 N 0.71 3.78 -0.15 2.92 -1.09 -0.02 -3.73 121.20 123.62 3ll6 s ILE 160 Ca 0.05 -0.40 -0.20 0.00 -2.23 0.00 0.00 60.65 57.87 3ll6 s ILE 160 Cb -0.13 -2.64 -0.18 0.00 -1.58 0.00 0.00 42.46 37.94 3ll6 s ILE 160 CO 0.02 0.51 0.42 -0.74 -1.23 0.00 0.00 174.94 173.92 3ll6 h HIS 161 N 6.55 0.00 0.00 3.97 2.76 -1.90 -0.75 115.15 125.79 3ll6 h HIS 161 Ca -0.32 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.85 3ll6 h HIS 161 Cb 1.19 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.15 3ll6 h HIS 161 CO 0.53 0.84 0.00 0.54 -1.30 0.00 0.00 177.93 178.54 3ll6 n ARG 162 N -4.60 0.00 -2.76 5.26 1.74 -1.26 -2.60 116.66 112.44 3ll6 n ARG 162 Ca -0.13 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 56.91 3ll6 n ARG 162 Cb 0.42 -2.64 0.04 0.00 -1.02 0.00 0.00 32.46 29.26 3ll6 n ARG 162 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3ll6 n ASP 163 N 0.00 1.64 -4.68 0.55 2.03 -1.26 -5.01 116.55 109.81 3ll6 n ASP 163 Ca 0.00 -2.30 -0.42 0.00 0.52 0.00 0.00 54.79 52.58 3ll6 n ASP 163 Cb 0.00 -0.49 -0.03 0.00 -0.72 0.00 0.00 41.12 39.88 3ll6 n ASP 163 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3ll6 s LEU 164 N -3.58 4.27 -0.08 -2.67 1.43 -1.26 -4.98 118.68 111.82 3ll6 s LEU 164 Ca 0.28 1.93 -0.18 0.00 -1.03 0.00 0.00 54.13 55.13 3ll6 s LEU 164 Cb 0.37 -3.55 0.04 0.00 0.03 0.00 0.00 46.19 43.07 3ll6 s LEU 164 CO -0.01 -0.70 0.42 -0.54 0.23 0.00 0.00 176.35 175.74 3ll6 s LYS 165 N 2.74 0.68 0.38 1.70 1.02 -1.26 -4.78 119.74 120.22 3ll6 s LYS 165 Ca 0.60 0.18 0.09 0.00 0.02 0.00 0.00 55.97 56.86 3ll6 s LYS 165 Cb -0.27 0.31 0.77 0.00 -0.52 0.00 0.00 37.83 38.12 3ll6 s LYS 165 CO 0.22 -0.16 1.91 -0.24 -0.92 0.00 0.00 175.35 176.16 3ll6 h VAL 166 N 3.93 1.18 0.00 3.17 3.04 -1.94 -2.14 116.25 123.50 3ll6 h VAL 166 Ca -0.28 -0.81 0.00 0.00 -1.01 0.00 0.00 66.70 64.59 3ll6 h VAL 166 Cb 1.17 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 31.68 3ll6 h VAL 166 CO 0.34 0.25 0.00 -0.33 -1.01 0.00 0.00 177.57 176.82 3ll6 h GLU 167 N 0.23 0.00 -0.00 4.17 3.07 -1.98 -2.41 114.58 117.65 3ll6 h GLU 167 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 3ll6 h GLU 167 Cb 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 3ll6 h GLU 167 CO 0.02 0.00 -0.76 0.09 -1.40 0.00 0.00 179.01 176.96 3ll6 n ASN 168 N -2.44 1.15 -4.79 1.42 4.13 -0.81 -4.87 115.26 109.05 3ll6 n ASN 168 Ca -0.00 -1.08 -0.36 0.00 1.68 0.00 0.00 54.58 54.82 3ll6 n ASN 168 Cb 0.13 0.86 -0.05 0.00 -1.54 0.00 0.00 39.78 39.18 3ll6 n ASN 168 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3ll6 s LEU 169 N -2.73 4.15 0.22 3.41 1.43 -0.91 -4.51 118.68 119.73 3ll6 s LEU 169 Ca 0.10 1.92 0.09 0.00 -1.03 0.00 0.00 54.13 55.20 3ll6 s LEU 169 Cb 0.15 -4.22 -0.04 0.00 0.03 0.00 0.00 46.19 42.11 3ll6 s LEU 169 CO 0.70 -0.37 -0.01 -0.76 0.23 0.00 0.00 176.35 176.14 3ll6 s LEU 170 N -2.61 3.22 -0.17 1.79 1.43 -0.33 -1.48 118.68 120.53 3ll6 s LEU 170 Ca 0.57 -0.53 -0.06 0.00 -1.03 0.00 0.00 54.13 53.08 3ll6 s LEU 170 Cb -0.19 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 3ll6 s LEU 170 CO 0.24 0.05 0.03 -0.22 0.23 0.00 0.00 176.35 176.68 3ll6 s LEU 171 N -3.26 3.63 0.82 1.79 2.96 0.24 -1.13 118.68 123.74 3ll6 s LEU 171 Ca 0.29 0.02 -0.12 0.00 -0.22 0.00 0.00 54.13 54.10 3ll6 s LEU 171 Cb -0.08 -1.90 0.08 0.00 0.50 0.00 0.00 46.19 44.79 3ll6 s LEU 171 CO 0.19 0.18 1.14 -0.94 -1.32 0.00 0.00 176.35 175.60 3ll6 s SER 172 N 0.30 4.35 0.45 3.68 1.04 0.45 0.03 113.70 124.01 3ll6 s SER 172 Ca 0.01 1.00 0.31 0.00 0.48 0.00 0.00 55.95 57.74 3ll6 s SER 172 Cb -0.13 -1.61 1.45 0.00 0.10 0.00 0.00 66.02 65.83 3ll6 s SER 172 CO 0.01 -2.02 1.93 0.78 0.98 0.00 0.00 173.24 174.92 3ll6 h ASN 173 N -1.13 0.00 -0.21 7.02 2.35 -1.88 -0.92 115.58 120.81 3ll6 h ASN 173 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 3ll6 h ASN 173 Cb 1.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.68 3ll6 h ASN 173 CO 0.63 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.41 3ll6 n GLN 174 N -2.68 1.91 -2.13 0.81 3.00 -1.26 -4.94 117.38 112.10 3ll6 n GLN 174 Ca -0.00 -1.37 -0.01 0.00 -0.01 0.00 0.00 57.00 55.61 3ll6 n GLN 174 Cb 0.18 -1.42 0.00 0.00 0.00 0.00 0.00 30.24 29.00 3ll6 n GLN 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ll6 n GLY 175 N 1.22 0.46 3.44 1.08 0.00 -0.35 -4.58 105.19 106.46 3ll6 n GLY 175 Ca 0.17 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 45.15 3ll6 n GLY 175 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ll6 s THR 176 N -2.25 2.24 0.12 2.61 -4.23 -1.26 -0.33 115.64 112.54 3ll6 s THR 176 Ca 0.00 -2.34 -0.23 0.00 -1.18 0.00 0.00 61.69 57.95 3ll6 s THR 176 Cb -0.00 -2.26 -0.07 0.00 1.34 0.00 0.00 72.50 71.50 3ll6 s THR 176 CO 0.01 -0.43 0.69 -0.63 -0.54 0.00 0.00 174.62 173.71 3ll6 s ILE 177 N -2.65 4.56 -0.04 2.99 -1.09 -1.26 -0.41 121.20 123.29 3ll6 s ILE 177 Ca 0.28 1.49 0.03 0.00 -2.23 0.00 0.00 60.65 60.22 3ll6 s ILE 177 Cb -0.03 -4.03 0.01 0.00 -1.58 0.00 0.00 42.46 36.82 3ll6 s ILE 177 CO 0.13 0.52 -0.11 -0.54 -1.23 0.00 0.00 174.94 173.71 3ll6 s LYS 178 N -1.04 1.25 -0.00 2.79 -0.14 -0.28 -4.40 119.74 117.92 3ll6 s LYS 178 Ca 0.33 -0.37 -0.17 0.00 -1.36 0.00 0.00 55.97 54.40 3ll6 s LYS 178 Cb -0.21 -1.12 -0.06 0.00 -1.68 0.00 0.00 37.83 34.76 3ll6 s LYS 178 CO 0.23 0.11 0.47 -0.51 -0.76 0.00 0.00 175.35 174.89 3ll6 s LEU 179 N 0.30 4.45 0.00 3.17 1.43 -0.23 -1.19 118.68 126.62 3ll6 s LEU 179 Ca -0.06 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.07 3ll6 s LEU 179 Cb -0.11 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.41 3ll6 s LEU 179 CO 0.01 0.24 0.18 0.00 0.23 0.00 0.00 176.35 177.01 3ll6 s ASP 181 N -0.08 4.75 -0.23 0.00 -4.77 -1.26 -4.89 116.67 110.18 3ll6 s ASP 181 Ca 0.00 -3.58 0.14 0.00 -3.30 0.00 0.00 52.55 45.81 3ll6 s ASP 181 Cb 0.00 -1.66 0.70 0.00 -1.09 0.00 0.00 42.92 40.87 3ll6 s ASP 181 CO 0.00 -0.14 1.64 0.49 0.70 0.00 0.00 175.17 177.86 3ll6 n PHE 182 N 2.35 1.71 0.31 2.11 3.72 -1.26 -4.45 117.46 121.95 3ll6 n PHE 182 Ca 0.15 -0.88 0.17 0.00 -0.05 0.00 0.00 57.45 56.84 3ll6 n PHE 182 Cb 0.34 -0.47 0.69 0.00 -0.94 0.00 0.00 39.48 39.10 3ll6 n PHE 182 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3ll6 h GLY 183 N 2.93 0.00 -0.92 1.37 0.00 -1.91 -2.63 103.07 101.91 3ll6 h GLY 183 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3ll6 h GLY 183 CO 0.43 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.41 3ll6 n SER 184 N -2.89 2.03 -4.76 0.19 7.64 -1.26 -4.95 113.62 109.61 3ll6 n SER 184 Ca 0.01 -1.52 -0.32 0.00 1.01 0.00 0.00 58.87 58.05 3ll6 n SER 184 Cb 0.26 -0.03 0.09 0.00 -1.01 0.00 0.00 64.21 63.52 3ll6 n SER 184 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ll6 s ALA 185 N -0.92 2.25 0.15 -0.43 0.00 -0.99 -4.64 121.76 117.18 3ll6 s ALA 185 Ca 0.14 0.39 -0.14 0.00 0.00 0.00 0.00 51.96 52.35 3ll6 s ALA 185 Cb 0.09 -3.31 0.02 0.00 0.00 0.00 0.00 23.12 19.93 3ll6 s ALA 185 CO 0.14 -1.71 0.39 -0.08 0.00 0.00 0.00 175.76 174.50 3ll6 s THR 186 N -2.70 0.06 0.00 0.00 -1.32 -0.29 -4.99 115.64 106.41 3ll6 s THR 186 Ca 0.64 -0.90 0.00 0.00 -1.21 0.00 0.00 61.69 60.22 3ll6 s THR 186 Cb -0.19 -1.48 0.00 0.00 -1.51 0.00 0.00 72.50 69.32 3ll6 s THR 186 CO 0.52 -0.28 0.00 1.07 -2.21 0.00 0.00 174.62 173.72 3ll6 n THR 187 N -0.25 0.00 -4.05 5.08 5.66 -1.26 -0.84 114.28 118.62 3ll6 n THR 187 Ca -0.12 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.53 3ll6 n THR 187 Cb 0.63 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.29 3ll6 n THR 187 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 3ll6 s ILE 188 N -2.74 4.19 0.39 1.09 1.01 -1.26 -5.07 121.20 118.81 3ll6 s ILE 188 Ca 0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 60.65 60.21 3ll6 s ILE 188 Cb 0.00 -2.90 -0.10 0.00 0.01 0.00 0.00 42.46 39.47 3ll6 s ILE 188 CO 0.00 0.43 0.91 -0.44 0.00 0.00 0.00 174.94 175.84 3ll6 s SER 189 N 0.90 6.99 -0.81 3.58 0.01 -1.26 -4.43 113.70 118.69 3ll6 s SER 189 Ca 0.02 1.65 -0.03 0.00 1.31 0.00 0.00 55.95 58.90 3ll6 s SER 189 Cb -0.14 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.57 3ll6 s SER 189 CO 0.02 -0.28 0.69 1.41 0.41 0.00 0.00 173.24 175.50 3ll6 n HIS 190 N -0.36 -1.62 -2.61 2.43 8.25 -1.26 -4.98 115.22 115.06 3ll6 n HIS 190 Ca 0.05 0.62 -0.42 0.00 -0.26 0.00 0.00 57.72 57.71 3ll6 n HIS 190 Cb 0.53 -3.71 -0.03 0.00 1.12 0.00 0.00 29.99 27.90 3ll6 n HIS 190 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3ll6 s TYR 191 N -3.21 3.63 0.00 4.41 5.04 -1.26 -5.21 117.35 120.74 3ll6 s TYR 191 Ca 0.21 1.60 0.00 0.00 -2.44 0.00 0.00 57.07 56.45 3ll6 s TYR 191 Cb -0.09 -3.21 0.00 0.00 0.35 0.00 0.00 41.96 39.01 3ll6 s TYR 191 CO 0.46 -0.38 0.45 -0.35 -1.34 0.00 0.00 175.55 174.39 3ll6 n PRO 192 N 3.43 0.00 -1.66 4.97 -0.04 -1.26 -5.04 135.00 135.41 3ll6 n PRO 192 Ca 0.05 0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 3ll6 n PRO 192 Cb 0.49 -0.97 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 3ll6 n PRO 192 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 3ll6 n LEU 224 N -0.77 0.00 0.00 1.53 -0.00 -1.26 -5.12 117.00 111.38 3ll6 n LEU 224 Ca 0.00 0.27 0.00 0.00 -0.00 0.00 0.00 56.01 56.28 3ll6 n LEU 224 Cb 0.00 -0.64 0.00 0.00 -0.00 0.00 0.00 43.42 42.78 3ll6 n LEU 224 CO 0.00 0.00 -0.00 -1.22 -0.00 0.00 0.00 177.39 176.17 3ll6 n TYR 225 N -1.56 0.00 0.00 1.47 0.53 -1.26 -4.77 117.16 111.57 3ll6 n TYR 225 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 3ll6 n TYR 225 Cb 0.27 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.58 3ll6 n TYR 225 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 3ll6 n SER 226 N -0.46 0.00 0.18 7.72 2.88 -1.26 -1.91 113.62 120.77 3ll6 n SER 226 Ca 0.00 0.37 0.13 0.00 -1.33 0.00 0.00 58.87 58.03 3ll6 n SER 226 Cb 0.00 -0.37 0.30 0.00 -0.75 0.00 0.00 64.21 63.39 3ll6 n SER 226 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3ll6 h ASN 227 N 0.00 0.00 -3.19 -3.46 4.21 -2.09 -3.46 115.58 107.59 3ll6 h ASN 227 Ca 0.00 0.00 -0.59 0.00 1.21 0.00 0.00 56.30 56.92 3ll6 h ASN 227 Cb 0.00 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 37.13 3ll6 h ASN 227 CO 0.00 0.00 -0.18 -0.36 -1.29 0.00 0.00 177.43 175.60 3ll6 s PHE 228 N -3.21 3.61 0.41 1.19 0.08 -0.80 -5.05 117.98 114.21 3ll6 s PHE 228 Ca 0.08 0.92 -0.26 0.00 0.12 0.00 0.00 56.93 57.78 3ll6 s PHE 228 Cb 0.08 -2.41 -0.09 0.00 -0.57 0.00 0.00 43.02 40.02 3ll6 s PHE 228 CO 0.63 0.39 1.39 -1.25 -0.10 0.00 0.00 175.22 176.28 3ll6 s PRO 229 N -0.19 3.90 -0.06 0.24 0.04 -1.26 -4.95 135.00 132.72 3ll6 s PRO 229 Ca 0.24 2.35 0.10 0.00 0.04 0.00 0.00 61.00 63.72 3ll6 s PRO 229 Cb -0.16 -2.78 0.15 0.00 0.04 0.00 0.00 34.50 31.76 3ll6 s PRO 229 CO 0.11 -0.62 1.08 0.44 0.04 0.00 0.00 177.00 178.05 3ll6 n ILE 230 N 0.10 0.88 0.00 0.56 -5.35 -1.26 -4.94 119.36 109.35 3ll6 n ILE 230 Ca 0.03 -1.12 0.00 0.00 -0.27 0.00 0.00 62.75 61.40 3ll6 n ILE 230 Cb 0.42 0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.50 3ll6 n ILE 230 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ll6 n GLY 231 N -0.64 0.72 0.37 3.28 0.00 -1.26 -4.98 105.19 102.69 3ll6 n GLY 231 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 3ll6 n GLY 231 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ll6 h GLU 232 N 0.00 0.66 0.00 1.61 3.07 -1.96 -2.82 114.58 115.15 3ll6 h GLU 232 Ca 0.00 -0.04 -0.12 0.00 -0.50 0.00 0.00 59.36 58.70 3ll6 h GLU 232 Cb 0.00 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 27.74 3ll6 h GLU 232 CO 0.00 0.44 -0.59 0.87 -1.40 0.00 0.00 179.01 178.33 3ll6 h LYS 233 N 0.68 0.00 -0.27 2.33 1.79 -1.93 -0.64 116.57 118.54 3ll6 h LYS 233 Ca 0.44 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.78 3ll6 h LYS 233 Cb 0.70 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.34 3ll6 h LYS 233 CO -0.19 0.59 -0.36 0.37 -1.08 0.00 0.00 179.45 178.78 3ll6 h GLN 234 N 0.00 0.61 -0.67 3.15 5.75 -1.89 -2.16 115.11 119.89 3ll6 h GLN 234 Ca -0.01 -0.29 -0.08 0.00 -0.15 0.00 0.00 58.65 58.12 3ll6 h GLN 234 Cb 1.18 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.70 3ll6 h GLN 234 CO 0.08 0.88 0.10 -0.44 -2.65 0.00 0.00 178.83 176.80 3ll6 h ASP 235 N 0.51 1.08 -0.49 -0.69 3.32 -1.20 -1.78 116.42 117.18 3ll6 h ASP 235 Ca 0.05 -0.26 0.02 0.00 0.02 0.00 0.00 57.03 56.85 3ll6 h ASP 235 Cb 0.86 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 40.09 3ll6 h ASP 235 CO 0.07 1.07 0.30 0.40 -1.72 0.00 0.00 179.24 179.37 3ll6 h ILE 236 N 1.04 1.08 -0.54 0.35 1.08 -1.02 0.19 117.51 119.70 3ll6 h ILE 236 Ca 0.20 -0.21 0.01 0.00 -0.39 0.00 0.00 64.86 64.48 3ll6 h ILE 236 Cb 0.45 0.42 -0.03 0.00 -3.07 0.00 0.00 36.82 34.59 3ll6 h ILE 236 CO 0.01 0.11 0.34 -0.25 -0.69 0.00 0.00 178.15 177.68 3ll6 h TRP 237 N 0.61 0.64 -0.87 1.37 2.91 -1.25 0.02 115.95 119.39 3ll6 h TRP 237 Ca 0.19 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.21 3ll6 h TRP 237 Cb -0.02 -0.21 -0.04 0.00 -0.51 0.00 0.00 29.16 28.37 3ll6 h TRP 237 CO -0.06 0.39 0.48 0.00 -1.03 0.00 0.00 178.44 178.22 3ll6 h ALA 238 N 1.22 1.22 -0.48 2.65 0.00 -0.87 -2.19 119.26 120.80 3ll6 h ALA 238 Ca 0.21 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 3ll6 h ALA 238 Cb -0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 3ll6 h ALA 238 CO -0.07 0.64 -0.17 -0.07 0.00 0.00 0.00 179.25 179.58 3ll6 h LEU 239 N 1.21 0.95 -0.77 0.00 3.38 -0.52 -2.44 115.31 117.12 3ll6 h LEU 239 Ca 0.31 -0.33 0.14 0.00 0.09 0.00 0.00 57.88 58.08 3ll6 h LEU 239 Cb 0.01 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 40.41 3ll6 h LEU 239 CO -0.05 1.10 0.35 1.23 0.09 0.00 0.00 178.44 181.16 3ll6 h GLY 240 N 0.93 1.20 1.00 0.83 0.00 -0.67 -0.56 103.07 105.80 3ll6 h GLY 240 Ca 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 3ll6 h GLY 240 CO 0.06 -0.06 0.35 0.00 0.00 0.00 0.00 176.54 176.89 3ll6 h ILE 242 N 0.92 1.08 -0.43 0.00 2.04 -0.74 -0.84 117.51 119.55 3ll6 h ILE 242 Ca 0.23 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.95 3ll6 h ILE 242 Cb 0.07 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 3ll6 h ILE 242 CO -0.03 0.08 0.28 0.25 0.00 0.00 0.00 178.15 178.73 3ll6 h LEU 243 N 0.44 0.48 -0.44 1.44 5.85 -0.88 0.00 115.31 122.21 3ll6 h LEU 243 Ca 0.12 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3ll6 h LEU 243 Cb -0.05 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 3ll6 h LEU 243 CO -0.03 0.35 0.27 0.22 -0.34 0.00 0.00 178.44 178.91 3ll6 h TYR 244 N 0.57 0.56 -0.51 1.25 3.20 -1.20 -2.29 116.97 118.56 3ll6 h TYR 244 Ca 0.16 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 3ll6 h TYR 244 Cb -0.06 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.00 3ll6 h TYR 244 CO -0.05 0.38 0.31 -0.07 -1.64 0.00 0.00 178.16 177.09 3ll6 h LEU 245 N 0.58 0.62 -1.01 2.82 3.38 -0.79 0.23 115.31 121.15 3ll6 h LEU 245 Ca 0.16 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3ll6 h LEU 245 Cb -0.03 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 3ll6 h LEU 245 CO -0.03 0.50 0.44 -0.07 0.09 0.00 0.00 178.44 179.37 3ll6 h LEU 246 N 0.69 1.02 -0.02 1.67 3.38 -0.79 0.12 115.31 121.37 3ll6 h LEU 246 Ca 0.18 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 3ll6 h LEU 246 Cb -0.00 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.49 3ll6 h LEU 246 CO -0.03 0.82 -0.15 0.00 0.09 0.00 0.00 178.44 179.16 3ll6 n PHE 248 N -4.60 0.00 -2.02 0.00 3.72 0.05 -4.87 117.46 109.73 3ll6 n PHE 248 Ca -0.09 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.11 3ll6 n PHE 248 Cb 0.43 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.93 3ll6 n PHE 248 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3ll6 n ARG 249 N 0.24 -1.49 -3.86 -1.08 5.12 0.40 -4.97 116.66 111.03 3ll6 n ARG 249 Ca 0.06 1.06 -0.11 0.00 -1.93 0.00 0.00 57.85 56.93 3ll6 n ARG 249 Cb 0.25 -5.55 -0.09 0.00 -1.16 0.00 0.00 32.46 25.91 3ll6 n ARG 249 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3ll6 s GLN 250 N -4.41 0.59 0.26 5.56 -0.21 -1.26 -5.06 119.66 115.14 3ll6 s GLN 250 Ca 0.00 -0.53 -0.30 0.00 0.02 0.00 0.00 55.36 54.55 3ll6 s GLN 250 Cb 0.00 0.25 -0.09 0.00 1.00 0.00 0.00 33.01 34.16 3ll6 s GLN 250 CO 0.00 -0.16 1.11 -1.58 -2.12 0.00 0.00 175.29 172.54 3ll6 s HIS 251 N -2.03 3.57 -1.14 0.91 5.65 -1.26 -3.91 115.29 117.08 3ll6 s HIS 251 Ca -0.09 1.67 0.08 0.00 0.25 0.00 0.00 55.06 56.97 3ll6 s HIS 251 Cb -0.04 -3.29 0.38 0.00 -1.18 0.00 0.00 32.58 28.44 3ll6 s HIS 251 CO -0.01 -0.61 1.23 -0.35 -0.65 0.00 0.00 174.74 174.35 3ll6 n PRO 252 N 1.44 0.04 -4.13 2.88 -0.04 -1.26 -5.03 135.00 128.89 3ll6 n PRO 252 Ca -0.00 0.31 -0.19 0.00 -0.04 0.00 0.00 63.50 63.58 3ll6 n PRO 252 Cb 0.45 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.25 3ll6 n PRO 252 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3ll6 s PHE 253 N -2.86 0.62 0.00 0.54 0.40 -1.26 -4.67 117.98 110.75 3ll6 s PHE 253 Ca 0.05 -0.15 0.00 0.00 -0.60 0.00 0.00 56.93 56.24 3ll6 s PHE 253 Cb 0.06 -0.56 0.00 0.00 0.51 0.00 0.00 43.02 43.03 3ll6 s PHE 253 CO 0.14 -0.15 0.00 2.48 0.70 0.00 0.00 175.22 178.40 3ll6 n TYR 266 N 3.88 0.00 -3.22 0.36 4.11 -1.26 -5.24 117.16 115.78 3ll6 n TYR 266 Ca -0.24 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 57.70 3ll6 n TYR 266 Cb 0.52 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.84 3ll6 n TYR 266 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 3ll6 s SER 267 N -0.64 -0.77 0.03 9.48 0.15 -1.26 -5.10 113.70 115.59 3ll6 s SER 267 Ca 0.00 0.60 -0.30 0.00 0.70 0.00 0.00 55.95 56.95 3ll6 s SER 267 Cb 0.00 1.69 -0.08 0.00 -1.71 0.00 0.00 66.02 65.93 3ll6 s SER 267 CO 0.00 -0.14 1.74 -0.63 1.20 0.00 0.00 173.24 175.41 3ll6 s ILE 268 N 2.82 3.14 -0.09 6.45 1.01 -1.26 -4.90 121.20 128.37 3ll6 s ILE 268 Ca 0.05 0.40 -0.36 0.00 0.00 0.00 0.00 60.65 60.74 3ll6 s ILE 268 Cb -0.11 -3.26 -0.13 0.00 0.01 0.00 0.00 42.46 38.97 3ll6 s ILE 268 CO -0.15 -0.02 1.76 -2.65 0.00 0.00 0.00 174.94 173.87 3ll6 n PRO 269 N 6.47 1.82 0.28 2.79 -0.02 -1.26 -4.85 135.00 140.23 3ll6 n PRO 269 Ca 0.17 0.66 0.16 0.00 -2.02 0.00 0.00 63.50 62.47 3ll6 n PRO 269 Cb 0.41 -2.44 0.91 0.00 -0.02 0.00 0.00 33.50 32.36 3ll6 n PRO 269 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3ll6 h PRO 270 N 7.81 0.00 -0.01 0.52 0.13 -2.05 -2.10 132.00 136.29 3ll6 h PRO 270 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3ll6 h PRO 270 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3ll6 h PRO 270 CO 0.93 0.00 -0.47 0.72 -0.23 0.00 0.00 178.00 178.95 3ll6 n HIS 271 N -3.83 0.00 -1.68 1.56 8.25 -1.26 -4.91 115.22 113.35 3ll6 n HIS 271 Ca -0.02 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.00 3ll6 n HIS 271 Cb 0.13 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.19 3ll6 n HIS 271 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3ll6 n ASP 272 N -0.17 3.86 0.00 0.41 2.03 -0.79 -4.83 116.55 117.06 3ll6 n ASP 272 Ca 0.09 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.37 3ll6 n ASP 272 Cb 0.45 -1.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.36 3ll6 n ASP 272 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3ll6 n THR 273 N 4.90 0.25 0.03 5.18 -2.24 -1.26 -4.79 114.28 116.35 3ll6 n THR 273 Ca 0.19 -0.61 -0.22 0.00 -2.27 0.00 0.00 64.05 61.15 3ll6 n THR 273 Cb 0.36 0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 69.34 3ll6 n THR 273 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3ll6 h GLN 274 N 0.00 0.29 -0.65 -0.78 4.15 -2.01 -3.38 115.11 112.73 3ll6 h GLN 274 Ca 0.00 -0.50 -0.00 0.00 0.77 0.00 0.00 58.65 58.92 3ll6 h GLN 274 Cb 0.14 0.19 -0.00 0.00 0.21 0.00 0.00 27.48 28.01 3ll6 h GLN 274 CO 0.00 1.24 0.00 0.66 -1.93 0.00 0.00 178.83 178.80 3ll6 n TYR 275 N -3.88 1.75 -0.32 3.99 4.01 -1.26 -4.61 117.16 116.85 3ll6 n TYR 275 Ca -0.23 -0.61 0.21 0.00 -0.16 0.00 0.00 57.90 57.11 3ll6 n TYR 275 Cb 0.93 -0.45 0.48 0.00 -0.31 0.00 0.00 39.34 39.99 3ll6 n TYR 275 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3ll6 h THR 276 N 3.32 0.57 0.00 -0.72 2.02 -1.87 -0.39 112.91 115.85 3ll6 h THR 276 Ca 0.00 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 3ll6 h THR 276 Cb 1.74 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 68.23 3ll6 h THR 276 CO 0.41 0.08 -0.08 -0.37 0.37 0.00 0.00 175.52 175.94 3ll6 h VAL 277 N 0.46 0.53 0.00 3.16 -1.51 -1.93 -1.34 116.25 115.60 3ll6 h VAL 277 Ca 0.57 -0.35 0.00 0.00 -1.23 0.00 0.00 66.70 65.70 3ll6 h VAL 277 Cb 1.35 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 31.74 3ll6 h VAL 277 CO -0.30 0.07 -0.61 0.49 -1.23 0.00 0.00 177.57 176.00 3ll6 n PHE 278 N -3.68 0.08 -0.22 5.19 3.72 -0.16 -4.63 117.46 117.77 3ll6 n PHE 278 Ca -0.02 0.02 -0.02 0.00 -0.05 0.00 0.00 57.45 57.38 3ll6 n PHE 278 Cb 0.18 -0.29 0.09 0.00 -0.94 0.00 0.00 39.48 38.53 3ll6 n PHE 278 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3ll6 h HIS 279 N 0.00 0.63 -0.00 1.38 3.86 -1.24 -1.35 115.15 118.42 3ll6 h HIS 279 Ca 0.00 0.02 -0.16 0.00 -1.16 0.00 0.00 60.37 59.07 3ll6 h HIS 279 Cb 0.55 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.81 3ll6 h HIS 279 CO 0.00 0.30 -0.76 0.66 0.86 0.00 0.00 177.93 178.98 3ll6 h SER 280 N 0.64 0.04 -0.15 2.45 4.64 -1.82 -1.45 113.55 117.91 3ll6 h SER 280 Ca 0.29 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.53 3ll6 h SER 280 Cb 0.19 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3ll6 h SER 280 CO -0.19 0.79 -0.07 0.25 -0.87 0.00 0.00 176.83 176.74 3ll6 h LEU 281 N 0.02 0.32 -0.49 5.97 5.85 -1.77 0.41 115.31 125.61 3ll6 h LEU 281 Ca -0.01 -0.41 0.10 0.00 0.84 0.00 0.00 57.88 58.40 3ll6 h LEU 281 Cb 1.35 -0.09 -0.10 0.00 0.37 0.00 0.00 40.66 42.19 3ll6 h LEU 281 CO 0.10 0.66 -0.19 0.40 -0.34 0.00 0.00 178.44 179.07 3ll6 h ILE 282 N -0.02 0.40 -0.53 4.05 2.04 -1.10 -1.53 117.51 120.81 3ll6 h ILE 282 Ca 0.03 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.84 3ll6 h ILE 282 Cb 0.54 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3ll6 h ILE 282 CO 0.02 0.00 0.10 0.03 0.00 0.00 0.00 178.15 178.31 3ll6 h ARG 283 N -0.07 0.86 0.00 2.37 3.08 -0.77 -1.34 114.38 118.50 3ll6 h ARG 283 Ca 0.23 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 3ll6 h ARG 283 Cb 0.44 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 3ll6 h ARG 283 CO -0.55 0.83 -0.02 0.00 -1.07 0.00 0.00 179.97 179.16 3ll6 h ALA 284 N 0.99 1.02 0.00 0.04 0.00 0.19 -3.01 119.26 118.49 3ll6 h ALA 284 Ca 0.16 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 3ll6 h ALA 284 Cb 0.37 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3ll6 h ALA 284 CO 0.01 0.03 -1.78 -1.33 0.00 0.00 0.00 179.25 176.18 3ll6 n MET 285 N -3.14 0.65 -0.90 0.00 2.81 -0.61 -3.00 117.12 112.92 3ll6 n MET 285 Ca -0.00 0.03 0.04 0.00 -1.81 0.00 0.00 57.70 55.96 3ll6 n MET 285 Cb 0.26 -1.66 0.37 0.00 -0.71 0.00 0.00 33.22 31.48 3ll6 n MET 285 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3ll6 n LEU 286 N -2.65 5.69 -4.68 4.03 4.77 -0.56 -3.87 117.00 119.72 3ll6 n LEU 286 Ca -0.13 -2.90 -0.44 0.00 -0.03 0.00 0.00 56.01 52.51 3ll6 n LEU 286 Cb 0.81 -0.70 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 3ll6 n LEU 286 CO 0.44 0.65 1.03 0.00 -1.33 0.00 0.00 177.39 178.18 3ll6 n GLN 287 N 0.45 2.09 -0.15 3.23 1.13 -1.14 -4.88 117.38 118.10 3ll6 n GLN 287 Ca 0.30 0.74 0.01 0.00 -1.94 0.00 0.00 57.00 56.11 3ll6 n GLN 287 Cb 1.21 -2.41 0.28 0.00 0.11 0.00 0.00 30.24 29.43 3ll6 n GLN 287 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3ll6 h VAL 288 N 3.05 1.18 -3.60 5.09 2.07 -1.94 -3.39 116.25 118.71 3ll6 h VAL 288 Ca -0.45 -0.40 -0.64 0.00 0.82 0.00 0.00 66.70 66.03 3ll6 h VAL 288 Cb 1.27 0.28 -0.14 0.00 -1.52 0.00 0.00 31.29 31.17 3ll6 h VAL 288 CO 0.75 0.19 -0.01 0.21 0.02 0.00 0.00 177.57 178.73 3ll6 s ASN 289 N -6.47 6.35 0.38 0.57 3.84 -1.26 -4.95 114.94 113.40 3ll6 s ASN 289 Ca -0.10 0.07 0.13 0.00 0.21 0.00 0.00 52.86 53.17 3ll6 s ASN 289 Cb 0.17 -2.28 0.95 0.00 -0.55 0.00 0.00 41.25 39.55 3ll6 s ASN 289 CO 0.77 -0.48 1.83 -0.65 -2.79 0.00 0.00 177.10 175.79 3ll6 h PRO 290 N 8.41 0.53 0.00 0.43 0.11 -1.95 0.22 132.00 139.74 3ll6 h PRO 290 Ca -0.28 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.78 3ll6 h PRO 290 Cb 1.12 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3ll6 h PRO 290 CO 0.78 0.35 -0.08 1.05 -0.21 0.00 0.00 178.00 179.89 3ll6 h GLU 291 N 0.55 0.00 -0.00 1.05 4.11 -1.94 -2.06 114.58 116.29 3ll6 h GLU 291 Ca 0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.93 3ll6 h GLU 291 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3ll6 h GLU 291 CO -0.24 0.08 -0.38 0.39 0.07 0.00 0.00 179.01 178.94 3ll6 n GLU 292 N -3.25 0.32 -2.23 1.06 1.02 0.76 -4.88 120.64 113.43 3ll6 n GLU 292 Ca -0.00 -0.18 -0.37 0.00 -0.02 0.00 0.00 57.16 56.59 3ll6 n GLU 292 Cb 0.32 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.24 3ll6 n GLU 292 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3ll6 s ARG 293 N -2.80 3.75 0.64 3.49 0.52 -0.78 -4.94 118.95 118.84 3ll6 s ARG 293 Ca 0.17 1.81 -0.17 0.00 -0.52 0.00 0.00 55.73 57.01 3ll6 s ARG 293 Cb 0.18 -2.43 -0.03 0.00 0.52 0.00 0.00 34.95 33.20 3ll6 s ARG 293 CO 0.62 -0.57 0.98 1.28 0.02 0.00 0.00 175.30 177.63 3ll6 n LEU 294 N -0.46 3.84 -4.89 2.53 4.77 -1.16 -5.04 117.00 116.58 3ll6 n LEU 294 Ca 0.07 0.76 -0.29 0.00 -0.03 0.00 0.00 56.01 56.52 3ll6 n LEU 294 Cb 0.48 -1.40 0.03 0.00 -2.33 0.00 0.00 43.42 40.19 3ll6 n LEU 294 CO 0.48 -1.87 0.66 -0.94 -1.33 0.00 0.00 177.39 174.38 3ll6 s SER 295 N -1.38 5.71 0.36 -1.43 1.04 -1.26 -4.93 113.70 111.81 3ll6 s SER 295 Ca 0.76 1.05 0.07 0.00 0.48 0.00 0.00 55.95 58.32 3ll6 s SER 295 Cb -0.39 -2.00 0.68 0.00 0.10 0.00 0.00 66.02 64.41 3ll6 s SER 295 CO 0.47 -1.10 1.88 -0.29 0.98 0.00 0.00 173.24 175.18 3ll6 h ILE 296 N -0.38 1.19 -0.64 -1.02 6.09 -1.96 -1.24 117.51 119.56 3ll6 h ILE 296 Ca -0.45 -0.84 0.00 0.00 -1.37 0.00 0.00 64.86 62.20 3ll6 h ILE 296 Cb 1.24 1.14 -0.03 0.00 0.47 0.00 0.00 36.82 39.64 3ll6 h ILE 296 CO 0.62 0.27 0.41 0.00 -3.07 0.00 0.00 178.15 176.38 3ll6 h ALA 297 N 1.56 0.81 -0.38 0.18 0.00 -1.97 -0.03 119.26 119.44 3ll6 h ALA 297 Ca 0.07 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 3ll6 h ALA 297 Cb 0.39 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3ll6 h ALA 297 CO 0.02 0.26 -0.30 0.93 0.00 0.00 0.00 179.25 180.16 3ll6 h GLU 298 N 0.86 0.82 -0.01 0.00 5.08 -1.80 -1.25 114.58 118.27 3ll6 h GLU 298 Ca 0.23 -0.38 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 3ll6 h GLU 298 Cb -0.07 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3ll6 h GLU 298 CO -0.05 1.01 0.01 0.28 -1.00 0.00 0.00 179.01 179.26 3ll6 h VAL 299 N 0.69 1.06 -0.75 3.13 2.07 -0.87 -1.13 116.25 120.45 3ll6 h VAL 299 Ca 0.08 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3ll6 h VAL 299 Cb 0.85 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 3ll6 h VAL 299 CO 0.07 0.05 0.43 0.58 0.02 0.00 0.00 177.57 178.72 3ll6 h VAL 300 N -0.06 1.22 -0.22 2.57 2.07 -0.93 -0.96 116.25 119.94 3ll6 h VAL 300 Ca 0.00 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.04 3ll6 h VAL 300 Cb 0.07 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.02 3ll6 h VAL 300 CO -0.00 0.24 0.03 -0.74 0.02 0.00 0.00 177.57 177.12 3ll6 h HIS 301 N 1.02 0.06 -0.70 1.57 6.17 -0.96 -0.51 115.15 121.80 3ll6 h HIS 301 Ca 0.26 0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.33 3ll6 h HIS 301 Cb -0.00 0.01 -0.03 0.00 2.52 0.00 0.00 27.41 29.91 3ll6 h HIS 301 CO -0.01 0.01 0.34 1.96 0.71 0.00 0.00 177.93 180.95 3ll6 h GLN 302 N 0.12 1.01 -0.72 5.26 4.20 -0.81 -1.46 115.11 122.70 3ll6 h GLN 302 Ca 0.10 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 3ll6 h GLN 302 Cb 0.11 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 3ll6 h GLN 302 CO -0.14 0.79 0.32 -0.07 -0.67 0.00 0.00 178.83 179.06 3ll6 h LEU 303 N 0.98 0.95 -0.80 1.46 3.38 -0.88 0.52 115.31 120.92 3ll6 h LEU 303 Ca 0.24 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3ll6 h LEU 303 Cb 0.11 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3ll6 h LEU 303 CO -0.03 0.82 0.17 1.56 0.09 0.00 0.00 178.44 181.05 3ll6 h GLN 304 N 1.03 1.07 -0.23 1.13 4.20 -0.53 0.63 115.11 122.41 3ll6 h GLN 304 Ca 0.25 -0.24 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3ll6 h GLN 304 Cb 0.14 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 3ll6 h GLN 304 CO -0.03 0.94 -0.13 0.93 -0.67 0.00 0.00 178.83 179.87 3ll6 h GLU 305 N 1.02 0.50 -0.76 1.46 4.39 -1.00 -1.34 114.58 118.86 3ll6 h GLU 305 Ca 0.22 -0.23 0.14 0.00 0.34 0.00 0.00 59.36 59.83 3ll6 h GLU 305 Cb 0.35 -0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 28.89 3ll6 h GLU 305 CO -0.00 0.78 0.31 0.82 -1.16 0.00 0.00 179.01 179.76 3ll6 h ILE 306 N 0.21 0.66 -0.42 3.13 2.04 -0.61 -2.37 117.51 120.15 3ll6 h ILE 306 Ca 0.05 -0.16 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 3ll6 h ILE 306 Cb 0.64 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3ll6 h ILE 306 CO 0.04 0.08 0.07 0.00 0.00 0.00 0.00 178.15 178.34 3ll6 h ALA 307 N 1.55 0.56 -0.67 1.87 0.00 -0.58 -2.72 119.26 119.28 3ll6 h ALA 307 Ca 0.42 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3ll6 h ALA 307 Cb 0.63 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3ll6 h ALA 307 CO -0.40 0.27 0.37 0.00 0.00 0.00 0.00 179.25 179.49 3ll6 h ALA 308 N 0.94 0.86 0.00 0.00 0.00 -1.08 -0.88 119.26 119.09 3ll6 h ALA 308 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3ll6 h ALA 308 Cb 0.37 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3ll6 h ALA 308 CO 0.01 0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.63 3ll6 n ALA 309 N -2.33 1.79 -0.51 0.00 0.00 -0.91 -1.90 120.51 116.65 3ll6 n ALA 309 Ca 0.05 -0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.49 3ll6 n ALA 309 Cb 0.09 -1.25 0.15 0.00 0.00 0.00 0.00 19.45 18.44 3ll6 n ALA 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ll6 n ARG 310 N -1.36 2.67 -2.86 0.00 1.74 -0.45 -4.99 116.66 111.40 3ll6 n ARG 310 Ca 0.06 -2.24 -0.05 0.00 -0.77 0.00 0.00 57.85 54.84 3ll6 n ARG 310 Cb 0.14 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 3ll6 n ARG 310 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3ll6 n ASN 311 N -0.29 -0.85 -4.24 0.55 6.94 -0.80 -4.99 115.26 111.57 3ll6 n ASN 311 Ca 0.13 -0.19 -0.31 0.00 -0.02 0.00 0.00 54.58 54.19 3ll6 n ASN 311 Cb 0.56 -0.29 -0.16 0.00 -2.36 0.00 0.00 39.78 37.52 3ll6 n ASN 311 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3ll6 s VAL 312 N -2.47 1.94 -0.55 3.53 1.01 -0.51 -5.04 120.40 118.31 3ll6 s VAL 312 Ca 0.01 -1.01 -0.22 0.00 0.00 0.00 0.00 61.98 60.77 3ll6 s VAL 312 Cb -0.01 -1.65 0.06 0.00 0.00 0.00 0.00 36.38 34.78 3ll6 s VAL 312 CO 0.17 0.54 0.80 0.21 0.00 0.00 0.00 175.10 176.82 3ll6 s ASN 313 N -0.13 6.26 0.00 3.32 2.47 -1.26 -4.31 114.94 121.29 3ll6 s ASN 313 Ca -0.04 -0.75 0.23 0.00 0.42 0.00 0.00 52.86 52.73 3ll6 s ASN 313 Cb -0.13 -2.37 1.03 0.00 -1.45 0.00 0.00 41.25 38.33 3ll6 s ASN 313 CO 0.03 -1.12 1.74 -0.81 -3.72 0.00 0.00 177.10 173.23 3ll6 n PRO 314 N 6.91 0.10 0.10 0.43 -0.04 -1.26 -2.12 135.00 139.12 3ll6 n PRO 314 Ca -0.03 0.10 0.13 0.00 -0.04 0.00 0.00 63.50 63.65 3ll6 n PRO 314 Cb 0.46 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.84 3ll6 n PRO 314 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3ll6 n LYS 315 N -1.44 0.24 -1.66 0.54 5.02 -1.26 -4.62 118.16 114.99 3ll6 n LYS 315 Ca 0.07 0.23 -0.30 0.00 -2.02 0.00 0.00 58.31 56.29 3ll6 n LYS 315 Cb 0.24 -1.80 0.07 0.00 -0.02 0.00 0.00 35.03 33.52 3ll6 n LYS 315 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3ll6 s SER 316 N -4.44 4.92 0.31 4.39 1.04 -0.90 -4.95 113.70 114.07 3ll6 s SER 316 Ca 0.10 1.29 -0.28 0.00 0.48 0.00 0.00 55.95 57.54 3ll6 s SER 316 Cb 0.12 -2.07 -0.13 0.00 0.10 0.00 0.00 66.02 64.04 3ll6 s SER 316 CO 0.57 -1.70 1.18 -2.65 0.98 0.00 0.00 173.24 171.62 3ll6 n PRO 317 N -3.25 1.77 -2.76 4.02 -0.02 -1.26 -4.86 135.00 128.64 3ll6 n PRO 317 Ca 0.07 0.62 -0.44 0.00 -2.02 0.00 0.00 63.50 61.74 3ll6 n PRO 317 Cb 0.56 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 3ll6 n PRO 317 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3ll6 n ILE 318 N 0.40 4.22 0.26 4.25 5.41 0.55 -4.85 119.36 129.59 3ll6 n ILE 318 Ca 0.07 -4.55 0.09 0.00 1.00 0.00 0.00 62.75 59.36 3ll6 n ILE 318 Cb 0.34 -2.44 0.65 0.00 -0.71 0.00 0.00 39.64 37.48 3ll6 n ILE 318 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 3ll6 h THR 319 N 4.54 0.98 0.00 1.39 1.35 -1.89 -1.67 112.91 117.60 3ll6 h THR 319 Ca 0.35 0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 66.16 3ll6 h THR 319 Cb 0.82 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 3ll6 h THR 319 CO 1.36 0.00 -0.28 1.05 -0.25 0.00 0.00 175.52 177.40 3ll6 h GLU 320 N 0.00 0.00 0.00 4.72 9.09 -1.98 -1.75 114.58 124.66 3ll6 h GLU 320 Ca 0.01 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.25 3ll6 h GLU 320 Cb 0.02 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.10 3ll6 h GLU 320 CO -0.00 0.28 -0.81 -0.07 0.05 0.00 0.00 179.01 178.46 3ll6 h LEU 321 N 0.00 0.00 -0.31 3.06 3.38 -1.70 -3.35 115.31 116.38 3ll6 h LEU 321 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ll6 h LEU 321 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 3ll6 h LEU 321 CO 0.04 0.80 0.00 0.25 0.09 0.00 0.00 178.44 179.62 3ll6 h LEU 322 N 0.00 0.00 -1.61 1.67 5.85 -1.16 -1.61 115.31 118.45 3ll6 h LEU 322 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3ll6 h LEU 322 Cb 1.62 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.65 3ll6 h LEU 322 CO 0.10 0.00 0.00 -1.84 -0.34 0.00 0.00 178.44 176.36 3ll6 n GLU 323 N -2.67 2.03 -3.46 1.25 0.28 -1.06 -4.91 120.64 112.10 3ll6 n GLU 323 Ca 0.04 -1.58 -0.19 0.00 -0.16 0.00 0.00 57.16 55.27 3ll6 n GLU 323 Cb 0.42 -1.40 -0.00 0.00 1.43 0.00 0.00 31.44 31.89 3ll6 n GLU 323 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 3ll6 s GLN 324 N -1.53 3.11 0.00 3.44 -1.52 -0.61 -5.13 119.66 117.41 3ll6 s GLN 324 Ca 0.33 -1.02 0.29 0.00 -1.95 0.00 0.00 55.36 53.01 3ll6 s GLN 324 Cb 0.18 -2.82 1.34 0.00 -0.22 0.00 0.00 33.01 31.49 3ll6 s GLN 324 CO 0.24 0.05 1.91 -1.71 -0.25 0.00 0.00 175.29 175.54