#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nx5 n ALA 2 N 0.00 5.08 0.00 2.24 0.00 -1.26 -4.74 120.51 121.82 2nx5 n ALA 2 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 53.44 51.94 2nx5 n ALA 2 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.05 2nx5 n ALA 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nx5 n GLY 3 N 0.65 2.58 3.75 0.00 0.00 -1.26 -4.97 105.19 105.93 2nx5 n GLY 3 Ca 0.27 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 2nx5 n GLY 3 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nx5 s ILE 4 N -0.97 3.96 -0.01 -0.61 1.01 -1.26 -3.54 121.20 119.78 2nx5 s ILE 4 Ca 0.00 1.85 0.06 0.00 0.00 0.00 0.00 60.65 62.55 2nx5 s ILE 4 Cb 0.00 -4.18 -0.01 0.00 0.01 0.00 0.00 42.46 38.28 2nx5 s ILE 4 CO 0.00 0.39 -0.18 -0.89 0.00 0.00 0.00 174.94 174.26 2nx5 s THR 5 N -0.79 1.40 -0.06 2.92 2.01 0.19 -4.59 115.64 116.72 2nx5 s THR 5 Ca 0.44 -0.80 0.02 0.00 0.31 0.00 0.00 61.69 61.67 2nx5 s THR 5 Cb -0.28 -1.18 0.01 0.00 0.01 0.00 0.00 72.50 71.07 2nx5 s THR 5 CO 0.34 0.37 -0.12 -1.58 -0.69 0.00 0.00 174.62 172.95 2nx5 s GLN 6 N -0.50 1.58 -0.11 4.92 0.74 -1.26 0.10 119.66 125.13 2nx5 s GLN 6 Ca 0.07 -0.39 -0.09 0.00 0.05 0.00 0.00 55.36 55.00 2nx5 s GLN 6 Cb -0.07 -1.33 0.03 0.00 1.10 0.00 0.00 33.01 32.75 2nx5 s GLN 6 CO -0.00 0.03 0.30 -1.54 -0.55 0.00 0.00 175.29 173.53 2nx5 s SER 7 N 0.63 -0.32 0.64 6.67 1.04 -0.65 -4.22 113.70 117.50 2nx5 s SER 7 Ca -0.13 0.61 -0.12 0.00 0.48 0.00 0.00 55.95 56.79 2nx5 s SER 7 Cb -0.15 0.59 -0.02 0.00 0.10 0.00 0.00 66.02 66.53 2nx5 s SER 7 CO 0.03 -0.12 1.04 -2.16 0.98 0.00 0.00 173.24 173.01 2nx5 s PRO 8 N 0.43 3.31 0.00 4.02 0.04 -1.26 -1.38 135.00 140.17 2nx5 s PRO 8 Ca -0.02 0.90 -0.07 0.00 0.04 0.00 0.00 61.00 61.84 2nx5 s PRO 8 Cb -0.04 -2.04 -0.30 0.00 0.04 0.00 0.00 34.50 32.16 2nx5 s PRO 8 CO -0.02 -0.80 0.87 0.00 0.04 0.00 0.00 177.00 177.09 2nx5 h ARG 9 N -0.33 0.34 -4.54 4.56 3.08 -1.87 -3.45 114.38 112.18 2nx5 h ARG 9 Ca -0.44 -0.58 -0.37 0.00 0.07 0.00 0.00 59.98 58.66 2nx5 h ARG 9 Cb 1.20 0.21 -0.29 0.00 0.08 0.00 0.00 29.97 31.18 2nx5 h ARG 9 CO 0.59 1.23 -0.77 -1.01 -1.07 0.00 0.00 179.97 178.94 2nx5 s HIS 10 N -2.61 0.70 -0.15 3.04 3.76 -1.26 -0.57 115.29 118.19 2nx5 s HIS 10 Ca -0.10 -0.14 -0.11 0.00 -0.15 0.00 0.00 55.06 54.57 2nx5 s HIS 10 Cb 0.06 -0.46 0.05 0.00 1.11 0.00 0.00 32.58 33.33 2nx5 s HIS 10 CO 0.87 -0.03 0.38 0.21 -0.85 0.00 0.00 174.74 175.33 2nx5 s LYS 11 N -0.09 0.40 -0.15 1.40 2.36 0.08 -4.97 119.74 118.77 2nx5 s LYS 11 Ca 0.02 0.66 0.00 0.00 -2.55 0.00 0.00 55.97 54.10 2nx5 s LYS 11 Cb -0.04 0.07 0.03 0.00 -1.05 0.00 0.00 37.83 36.83 2nx5 s LYS 11 CO -0.00 -0.12 -0.12 0.54 1.55 0.00 0.00 175.35 177.20 2nx5 s VAL 12 N 0.89 1.49 0.15 4.02 0.11 -1.26 -0.57 120.40 125.23 2nx5 s VAL 12 Ca -0.06 -0.65 -0.00 0.00 -2.93 0.00 0.00 61.98 58.34 2nx5 s VAL 12 Cb -0.06 -1.45 -0.04 0.00 -1.53 0.00 0.00 36.38 33.29 2nx5 s VAL 12 CO -0.07 0.38 0.04 0.28 -3.33 0.00 0.00 175.10 172.41 2nx5 s THR 13 N 1.51 0.28 0.38 5.04 -1.32 -0.82 -4.90 115.64 115.81 2nx5 s THR 13 Ca 0.04 -1.93 -0.07 0.00 -1.21 0.00 0.00 61.69 58.51 2nx5 s THR 13 Cb -0.13 -2.08 -0.05 0.00 -1.51 0.00 0.00 72.50 68.72 2nx5 s THR 13 CO -0.10 -0.46 0.70 -0.70 -2.21 0.00 0.00 174.62 171.85 2nx5 s GLU 14 N -4.01 3.67 0.38 7.08 2.12 -1.26 -1.44 118.70 125.24 2nx5 s GLU 14 Ca 0.24 0.24 -0.28 0.00 0.36 0.00 0.00 54.97 55.53 2nx5 s GLU 14 Cb 0.07 -2.48 -0.11 0.00 0.26 0.00 0.00 34.13 31.87 2nx5 s GLU 14 CO 0.03 0.02 1.48 2.41 -0.54 0.00 0.00 175.26 178.65 2nx5 n THR 15 N -1.40 2.05 -2.61 -1.70 -1.04 0.18 -3.62 114.28 106.14 2nx5 n THR 15 Ca 0.00 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.05 61.43 2nx5 n THR 15 Cb 0.54 -1.96 0.04 0.00 -1.82 0.00 0.00 70.33 67.13 2nx5 n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2nx5 n GLY 16 N 0.46 0.02 3.30 3.41 0.00 0.60 -4.89 105.19 108.09 2nx5 n GLY 16 Ca 0.02 -0.12 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 2nx5 n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nx5 s THR 17 N -3.18 -0.02 0.41 2.61 2.01 -1.24 -4.78 115.64 111.46 2nx5 s THR 17 Ca 0.05 0.07 -0.27 0.00 0.31 0.00 0.00 61.69 61.85 2nx5 s THR 17 Cb -0.01 -0.63 -0.10 0.00 0.01 0.00 0.00 72.50 71.78 2nx5 s THR 17 CO 0.35 0.03 1.45 -2.65 -0.69 0.00 0.00 174.62 173.12 2nx5 n PRO 18 N 3.96 2.46 -4.44 4.92 -0.02 -0.80 -2.71 135.00 138.38 2nx5 n PRO 18 Ca -0.21 0.87 -0.21 0.00 -2.02 0.00 0.00 63.50 61.92 2nx5 n PRO 18 Cb 0.56 -2.64 -0.14 0.00 -0.02 0.00 0.00 33.50 31.26 2nx5 n PRO 18 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2nx5 s VAL 19 N -1.15 1.23 -0.28 -1.45 1.01 -1.13 -4.99 120.40 113.64 2nx5 s VAL 19 Ca 0.57 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.56 2nx5 s VAL 19 Cb -0.47 -1.10 0.08 0.00 0.00 0.00 0.00 36.38 34.89 2nx5 s VAL 19 CO 0.61 0.07 -0.01 -0.89 0.00 0.00 0.00 175.10 174.88 2nx5 s THR 20 N -0.80 1.78 -0.22 3.92 2.01 -1.26 -3.02 115.64 118.05 2nx5 s THR 20 Ca 0.03 -1.67 -0.15 0.00 0.31 0.00 0.00 61.69 60.22 2nx5 s THR 20 Cb -0.08 -2.14 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 2nx5 s THR 20 CO 0.01 -0.33 0.35 -0.76 -0.69 0.00 0.00 174.62 173.20 2nx5 s LEU 21 N 1.22 4.12 -0.15 4.42 1.43 0.12 -4.44 118.68 125.40 2nx5 s LEU 21 Ca 0.01 0.39 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 2nx5 s LEU 21 Cb -0.19 -2.42 -0.00 0.00 0.03 0.00 0.00 46.19 43.61 2nx5 s LEU 21 CO -0.09 -0.07 -0.16 -0.60 0.23 0.00 0.00 176.35 175.65 2nx5 s ARG 22 N 1.43 3.20 -0.22 1.70 3.52 -0.48 -0.74 118.95 127.37 2nx5 s ARG 22 Ca 0.16 -0.76 -0.02 0.00 -0.13 0.00 0.00 55.73 54.98 2nx5 s ARG 22 Cb -0.15 -2.60 0.01 0.00 -1.56 0.00 0.00 34.95 30.66 2nx5 s ARG 22 CO 0.08 0.03 -0.09 0.00 -0.81 0.00 0.00 175.30 174.50 2nx5 s HIS 24 N 1.39 2.80 -0.13 0.00 5.04 0.12 -0.82 115.29 123.69 2nx5 s HIS 24 Ca 0.04 -0.14 -0.12 0.00 -1.54 0.00 0.00 55.06 53.30 2nx5 s HIS 24 Cb -0.14 -1.40 0.03 0.00 0.04 0.00 0.00 32.58 31.11 2nx5 s HIS 24 CO -0.06 0.49 0.35 -1.14 -2.34 0.00 0.00 174.74 172.03 2nx5 s GLN 25 N -2.65 0.41 -0.15 2.88 0.74 -0.12 -0.64 119.66 120.13 2nx5 s GLN 25 Ca 0.25 0.48 0.18 0.00 0.05 0.00 0.00 55.36 56.32 2nx5 s GLN 25 Cb -0.10 0.20 0.36 0.00 1.10 0.00 0.00 33.01 34.57 2nx5 s GLN 25 CO 0.17 -0.05 1.22 0.25 -0.55 0.00 0.00 175.29 176.33 2nx5 n THR 26 N 2.87 2.01 0.34 -0.34 -2.24 -1.23 -4.58 114.28 111.11 2nx5 n THR 26 Ca -0.13 -2.23 0.04 0.00 -2.27 0.00 0.00 64.05 59.47 2nx5 n THR 26 Cb 0.58 -0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 68.51 2nx5 n THR 26 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2nx5 n GLU 27 N -1.21 3.39 -1.95 -0.78 -0.58 -1.26 -5.03 120.64 113.22 2nx5 n GLU 27 Ca 0.18 -0.02 -0.13 0.00 -0.42 0.00 0.00 57.16 56.78 2nx5 n GLU 27 Cb 0.71 -0.97 -0.02 0.00 -0.57 0.00 0.00 31.44 30.58 2nx5 n GLU 27 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2nx5 n ASN 28 N -1.32 -4.16 -4.73 1.62 5.03 -1.26 -5.02 115.26 105.43 2nx5 n ASN 28 Ca 0.01 0.10 -0.37 0.00 0.87 0.00 0.00 54.58 55.18 2nx5 n ASN 28 Cb 0.16 -3.16 0.06 0.00 -1.02 0.00 0.00 39.78 35.82 2nx5 n ASN 28 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2nx5 n HIS 29 N -3.56 1.95 1.06 3.10 8.25 -1.26 -4.95 115.22 119.82 2nx5 n HIS 29 Ca -0.14 0.42 0.12 0.00 -0.26 0.00 0.00 57.72 57.86 2nx5 n HIS 29 Cb 0.55 -2.28 0.23 0.00 1.12 0.00 0.00 29.99 29.60 2nx5 n HIS 29 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2nx5 n ARG 30 N -1.70 0.27 -4.66 -0.41 1.74 -1.20 -4.85 116.66 105.85 2nx5 n ARG 30 Ca 0.15 -0.17 -0.33 0.00 -0.77 0.00 0.00 57.85 56.73 2nx5 n ARG 30 Cb 0.47 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.28 2nx5 n ARG 30 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2nx5 s TYR 31 N -2.85 2.87 -0.02 -1.55 2.02 -0.56 -2.70 117.35 114.57 2nx5 s TYR 31 Ca 0.14 -0.55 0.01 0.00 -0.37 0.00 0.00 57.07 56.30 2nx5 s TYR 31 Cb 0.18 -1.88 0.02 0.00 -0.40 0.00 0.00 41.96 39.88 2nx5 s TYR 31 CO 0.67 -0.17 -0.01 -1.64 -1.57 0.00 0.00 175.55 172.83 2nx5 s MET 32 N 0.37 0.36 0.11 -0.62 -1.94 -0.66 -0.88 119.30 116.04 2nx5 s MET 32 Ca -0.09 0.01 0.09 0.00 -1.71 0.00 0.00 55.69 53.99 2nx5 s MET 32 Cb -0.15 -0.48 -0.04 0.00 2.01 0.00 0.00 34.83 36.17 2nx5 s MET 32 CO 0.05 -0.08 -0.22 0.71 -0.01 0.00 0.00 175.02 175.47 2nx5 s TYR 33 N 0.75 1.87 -0.18 -0.03 2.02 0.74 -0.62 117.35 121.91 2nx5 s TYR 33 Ca -0.08 -0.41 -0.02 0.00 -0.37 0.00 0.00 57.07 56.19 2nx5 s TYR 33 Cb -0.11 -1.02 -0.01 0.00 -0.40 0.00 0.00 41.96 40.42 2nx5 s TYR 33 CO -0.01 0.23 -0.09 -1.58 -1.57 0.00 0.00 175.55 172.53 2nx5 s TRP 34 N -1.16 2.89 0.05 2.71 0.52 -0.56 -1.61 118.94 121.78 2nx5 s TRP 34 Ca 0.08 -0.84 0.08 0.00 0.02 0.00 0.00 56.10 55.44 2nx5 s TRP 34 Cb -0.10 -1.98 -0.03 0.00 -1.15 0.00 0.00 33.47 30.22 2nx5 s TRP 34 CO 0.05 -0.40 -0.22 0.71 0.02 0.00 0.00 176.95 177.10 2nx5 s TYR 35 N 0.94 1.92 0.15 -1.98 2.02 0.23 -1.06 117.35 119.58 2nx5 s TYR 35 Ca -0.01 -0.39 0.08 0.00 -0.37 0.00 0.00 57.07 56.38 2nx5 s TYR 35 Cb -0.15 -1.13 -0.04 0.00 -0.40 0.00 0.00 41.96 40.24 2nx5 s TYR 35 CO -0.00 0.12 -0.06 -0.98 -1.57 0.00 0.00 175.55 173.05 2nx5 s ARG 36 N -1.30 2.20 -0.07 -0.62 1.70 -0.94 0.07 118.95 119.99 2nx5 s ARG 36 Ca 0.08 -1.14 0.02 0.00 -0.47 0.00 0.00 55.73 54.23 2nx5 s ARG 36 Cb -0.09 -2.27 0.02 0.00 -0.57 0.00 0.00 34.95 32.03 2nx5 s ARG 36 CO 0.02 0.46 -0.11 -1.14 -1.08 0.00 0.00 175.30 173.45 2nx5 s GLN 37 N -2.67 1.68 -0.00 3.89 0.74 -0.04 -1.64 119.66 121.61 2nx5 s GLN 37 Ca 0.25 -0.39 0.00 0.00 0.05 0.00 0.00 55.36 55.27 2nx5 s GLN 37 Cb -0.10 -1.44 0.00 0.00 1.10 0.00 0.00 33.01 32.57 2nx5 s GLN 37 CO 0.16 -0.02 -0.00 -0.51 -0.55 0.00 0.00 175.29 174.37 2nx5 s ASP 38 N 0.84 0.01 0.34 6.67 1.01 -1.23 -3.49 116.67 120.82 2nx5 s ASP 38 Ca -0.11 -0.00 -0.29 0.00 0.71 0.00 0.00 52.55 52.86 2nx5 s ASP 38 Cb -0.15 -0.00 -0.12 0.00 1.01 0.00 0.00 42.92 43.66 2nx5 s ASP 38 CO 0.02 -0.00 1.43 -2.65 0.21 0.00 0.00 175.17 174.17 2nx5 n PRO 39 N 3.09 2.42 -0.27 8.23 -0.02 -1.26 -1.24 135.00 145.95 2nx5 n PRO 39 Ca -0.12 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 2nx5 n PRO 39 Cb 0.60 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 2nx5 n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nx5 n GLY 40 N 1.00 1.89 1.12 -1.23 0.00 -1.26 -4.98 105.19 101.74 2nx5 n GLY 40 Ca 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 2nx5 n GLY 40 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2nx5 n HIS 41 N -2.00 0.01 -0.01 1.61 8.25 -0.37 -5.18 115.22 117.53 2nx5 n HIS 41 Ca 0.00 -0.89 0.00 0.00 -0.26 0.00 0.00 57.72 56.57 2nx5 n HIS 41 Cb 0.00 0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.12 2nx5 n HIS 41 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nx5 n GLY 42 N 1.11 5.18 3.76 -1.41 0.00 -1.26 -4.64 105.19 107.93 2nx5 n GLY 42 Ca -0.01 -1.60 -0.40 0.00 0.00 0.00 0.00 46.02 44.01 2nx5 n GLY 42 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nx5 s LEU 43 N 0.00 4.57 -0.08 0.99 1.43 -1.26 -3.52 118.68 120.80 2nx5 s LEU 43 Ca 0.00 2.02 0.02 0.00 -1.03 0.00 0.00 54.13 55.14 2nx5 s LEU 43 Cb 0.00 -3.68 0.01 0.00 0.03 0.00 0.00 46.19 42.55 2nx5 s LEU 43 CO 0.00 0.03 -0.14 -0.13 0.23 0.00 0.00 176.35 176.35 2nx5 s ARG 44 N -1.40 1.92 0.28 1.70 0.52 -0.65 -4.97 118.95 116.35 2nx5 s ARG 44 Ca 0.44 -0.47 -0.29 0.00 -0.52 0.00 0.00 55.73 54.88 2nx5 s ARG 44 Cb -0.26 -1.61 -0.10 0.00 0.52 0.00 0.00 34.95 33.50 2nx5 s ARG 44 CO 0.33 -0.00 1.32 -1.17 0.02 0.00 0.00 175.30 175.80 2nx5 s LEU 45 N 0.79 4.42 -0.11 2.53 2.96 -1.26 -2.20 118.68 125.81 2nx5 s LEU 45 Ca -0.12 2.58 -0.10 0.00 -0.22 0.00 0.00 54.13 56.28 2nx5 s LEU 45 Cb -0.16 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.85 2nx5 s LEU 45 CO 0.02 -0.54 -0.22 -0.38 -1.32 0.00 0.00 176.35 173.91 2nx5 n ILE 46 N 1.62 1.20 -3.84 6.68 5.41 -0.22 -2.06 119.36 128.14 2nx5 n ILE 46 Ca 0.03 0.04 -0.10 0.00 1.00 0.00 0.00 62.75 63.72 2nx5 n ILE 46 Cb 0.42 -1.92 -0.06 0.00 -0.71 0.00 0.00 39.64 37.37 2nx5 n ILE 46 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 2nx5 s HIS 47 N -2.45 0.14 -0.01 1.39 3.76 -1.25 -0.82 115.29 116.05 2nx5 s HIS 47 Ca -0.20 -0.50 -0.14 0.00 -0.15 0.00 0.00 55.06 54.07 2nx5 s HIS 47 Cb 0.05 0.12 0.02 0.00 1.11 0.00 0.00 32.58 33.88 2nx5 s HIS 47 CO 0.28 -0.76 0.29 1.52 -0.85 0.00 0.00 174.74 175.22 2nx5 s TYR 48 N -3.91 -0.15 -0.04 1.40 -0.85 -1.07 -1.50 117.35 111.22 2nx5 s TYR 48 Ca 0.12 0.20 0.06 0.00 -0.52 0.00 0.00 57.07 56.93 2nx5 s TYR 48 Cb 0.02 0.08 -0.01 0.00 0.38 0.00 0.00 41.96 42.43 2nx5 s TYR 48 CO -0.04 -0.38 -0.23 0.45 -1.52 0.00 0.00 175.55 173.83 2nx5 s SER 49 N -1.37 2.76 -0.02 -0.18 0.15 0.20 -2.04 113.70 113.21 2nx5 s SER 49 Ca -0.13 -0.45 0.11 0.00 0.70 0.00 0.00 55.95 56.18 2nx5 s SER 49 Cb -0.05 -0.65 0.32 0.00 -1.71 0.00 0.00 66.02 63.93 2nx5 s SER 49 CO 0.04 0.23 1.27 0.00 1.20 0.00 0.00 173.24 175.98 2nx5 n TYR 50 N 2.89 0.51 0.00 3.44 0.18 -0.93 -1.65 117.16 121.59 2nx5 n TYR 50 Ca -0.17 -0.55 0.00 0.00 1.88 0.00 0.00 57.90 59.06 2nx5 n TYR 50 Cb 0.52 -0.07 0.00 0.00 -0.38 0.00 0.00 39.34 39.42 2nx5 n TYR 50 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2nx5 n GLY 51 N 0.34 2.43 3.53 -7.48 0.00 -1.10 -4.74 105.19 98.16 2nx5 n GLY 51 Ca 0.12 -0.86 -0.64 0.00 0.00 0.00 0.00 46.02 44.65 2nx5 n GLY 51 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2nx5 n VAL 52 N -0.77 0.02 0.00 1.61 0.31 -1.26 -0.20 118.33 118.04 2nx5 n VAL 52 Ca 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2nx5 n VAL 52 Cb 0.00 -0.57 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 2nx5 n VAL 52 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2nx5 n LYS 53 N 5.67 0.00 -2.68 5.55 4.76 -0.16 -4.95 118.16 126.35 2nx5 n LYS 53 Ca 0.41 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.43 2nx5 n LYS 53 Cb -0.03 -2.85 -0.03 0.00 -1.84 0.00 0.00 35.03 30.28 2nx5 n LYS 53 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2nx5 s ASP 54 N -2.78 6.36 0.24 4.39 1.01 0.72 -4.85 116.67 121.76 2nx5 s ASP 54 Ca 0.00 -0.18 0.06 0.00 0.71 0.00 0.00 52.55 53.14 2nx5 s ASP 54 Cb 0.00 -2.51 -0.05 0.00 1.01 0.00 0.00 42.92 41.37 2nx5 s ASP 54 CO 0.00 -1.44 -0.06 0.42 0.21 0.00 0.00 175.17 174.30 2nx5 s THR 55 N 4.66 1.45 0.03 -1.27 -4.23 -1.26 -2.20 115.64 112.82 2nx5 s THR 55 Ca 0.36 -2.11 -0.18 0.00 -1.18 0.00 0.00 61.69 58.59 2nx5 s THR 55 Cb -0.10 -2.30 0.03 0.00 1.34 0.00 0.00 72.50 71.48 2nx5 s THR 55 CO 0.21 -0.40 0.39 -0.62 -0.54 0.00 0.00 174.62 173.67 2nx5 s ASP 56 N -3.36 -0.26 1.05 3.99 2.15 -0.86 -5.01 116.67 114.35 2nx5 s ASP 56 Ca 0.27 0.02 -0.11 0.00 0.43 0.00 0.00 52.55 53.16 2nx5 s ASP 56 Cb 0.03 0.40 0.22 0.00 -0.30 0.00 0.00 42.92 43.27 2nx5 s ASP 56 CO 0.09 -0.62 1.09 -0.54 -0.17 0.00 0.00 175.17 175.02 2nx5 s LYS 57 N -2.23 -0.01 0.00 4.34 1.02 -1.26 -2.61 119.74 118.98 2nx5 s LYS 57 Ca -0.07 1.24 0.00 0.00 0.02 0.00 0.00 55.97 57.17 2nx5 s LYS 57 Cb -0.01 -1.63 0.00 0.00 -0.52 0.00 0.00 37.83 35.67 2nx5 s LYS 57 CO -0.01 -3.23 0.00 0.41 -0.92 0.00 0.00 175.35 171.60 2nx5 n GLY 58 N 0.61 3.96 0.03 -3.33 0.00 0.00 -4.70 105.19 101.76 2nx5 n GLY 58 Ca 0.08 -1.71 0.09 0.00 0.00 0.00 0.00 46.02 44.48 2nx5 n GLY 58 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2nx5 n GLU 59 N 0.00 0.66 -3.15 1.61 -0.00 -0.88 -4.52 120.64 114.36 2nx5 n GLU 59 Ca 0.00 -0.15 -0.20 0.00 -0.00 0.00 0.00 57.16 56.81 2nx5 n GLU 59 Cb 0.00 -1.56 -0.04 0.00 -0.00 0.00 0.00 31.44 29.85 2nx5 n GLU 59 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 2nx5 n VAL 60 N -2.35 0.48 1.87 3.84 0.24 -1.07 -4.91 118.33 116.43 2nx5 n VAL 60 Ca -0.06 -4.75 0.14 0.00 -2.04 0.00 0.00 64.34 57.63 2nx5 n VAL 60 Cb 0.61 -0.66 0.77 0.00 -1.47 0.00 0.00 33.84 33.09 2nx5 n VAL 60 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2nx5 n SER 61 N 0.28 0.35 -4.67 -1.34 3.41 -1.25 -4.67 113.62 105.73 2nx5 n SER 61 Ca 0.26 -1.20 -0.42 0.00 -0.26 0.00 0.00 58.87 57.25 2nx5 n SER 61 Cb 0.59 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 2nx5 n SER 61 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2nx5 s ASP 62 N -1.90 6.65 0.00 4.04 2.15 -1.26 -2.26 116.67 124.08 2nx5 s ASP 62 Ca 0.42 2.32 0.00 0.00 0.43 0.00 0.00 52.55 55.71 2nx5 s ASP 62 Cb 0.20 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 2nx5 s ASP 62 CO 0.33 -0.91 0.00 0.61 -0.17 0.00 0.00 175.17 175.03 2nx5 n GLY 64 N 4.11 0.83 3.63 2.66 0.00 -1.26 -5.03 105.19 110.12 2nx5 n GLY 64 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 2nx5 n GLY 64 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nx5 s TYR 65 N -3.22 2.53 0.16 1.61 2.02 -0.96 -4.12 117.35 115.37 2nx5 s TYR 65 Ca 0.00 -0.54 -0.23 0.00 -0.37 0.00 0.00 57.07 55.93 2nx5 s TYR 65 Cb 0.00 -1.64 0.07 0.00 -0.40 0.00 0.00 41.96 39.99 2nx5 s TYR 65 CO 0.00 0.43 0.60 0.45 -1.57 0.00 0.00 175.55 175.46 2nx5 s SER 66 N -3.73 -0.57 0.03 2.29 0.15 -0.58 -4.99 113.70 106.30 2nx5 s SER 66 Ca 0.36 -0.00 -0.03 0.00 0.70 0.00 0.00 55.95 56.98 2nx5 s SER 66 Cb 0.04 0.60 -0.02 0.00 -1.71 0.00 0.00 66.02 64.93 2nx5 s SER 66 CO 0.19 -0.97 0.03 0.68 1.20 0.00 0.00 173.24 174.38 2nx5 s VAL 67 N -3.74 0.13 -0.08 4.45 -7.23 -1.26 -1.37 120.40 111.30 2nx5 s VAL 67 Ca 0.01 -1.06 -0.02 0.00 -1.81 0.00 0.00 61.98 59.10 2nx5 s VAL 67 Cb -0.01 -0.66 0.04 0.00 0.56 0.00 0.00 36.38 36.31 2nx5 s VAL 67 CO -0.13 -0.58 0.05 -0.55 -0.31 0.00 0.00 175.10 173.57 2nx5 s SER 68 N -1.86 1.60 -0.77 4.85 0.15 -0.66 -4.96 113.70 112.05 2nx5 s SER 68 Ca -0.09 -0.15 0.02 0.00 0.70 0.00 0.00 55.95 56.43 2nx5 s SER 68 Cb -0.04 -0.28 0.33 0.00 -1.71 0.00 0.00 66.02 64.32 2nx5 s SER 68 CO -0.03 -0.25 1.34 -1.14 1.20 0.00 0.00 173.24 174.36 2nx5 n ARG 69 N 5.23 4.17 -0.28 5.44 3.00 -1.26 -1.34 116.66 131.62 2nx5 n ARG 69 Ca -0.05 -4.75 -0.02 0.00 -0.00 0.00 0.00 57.85 53.02 2nx5 n ARG 69 Cb 0.50 -2.34 0.04 0.00 0.00 0.00 0.00 32.46 30.66 2nx5 n ARG 69 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2nx5 h SER 70 N 3.49 -1.16 -1.47 6.15 4.64 -1.97 -0.40 113.55 122.82 2nx5 h SER 70 Ca 0.31 0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 2nx5 h SER 70 Cb 0.43 0.62 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2nx5 h SER 70 CO 0.98 -0.29 0.00 2.29 -0.87 0.00 0.00 176.83 178.94 2nx5 n LYS 71 N -5.47 1.55 0.12 4.77 2.85 -1.26 -4.56 118.16 116.15 2nx5 n LYS 71 Ca 0.08 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.12 2nx5 n LYS 71 Cb 0.38 0.00 -0.14 0.00 -0.65 0.00 0.00 35.03 34.63 2nx5 n LYS 71 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 2nx5 h THR 72 N 0.48 1.33 -0.07 0.58 2.02 -1.96 -3.35 112.91 111.95 2nx5 h THR 72 Ca 0.00 -2.69 -0.12 0.00 0.77 0.00 0.00 66.41 64.36 2nx5 h THR 72 Cb 0.00 2.89 -0.01 0.00 -1.74 0.00 0.00 68.15 69.28 2nx5 h THR 72 CO 0.00 0.81 -0.51 -0.33 0.37 0.00 0.00 175.52 175.85 2nx5 h GLU 73 N 0.18 0.19 -5.99 6.66 3.07 -1.93 -3.46 114.58 113.30 2nx5 h GLU 73 Ca -0.20 -0.11 -0.68 0.00 -0.50 0.00 0.00 59.36 57.86 2nx5 h GLU 73 Cb 2.03 0.01 -0.28 0.00 -0.84 0.00 0.00 28.75 29.66 2nx5 h GLU 73 CO 0.25 0.66 -0.83 -0.51 -1.40 0.00 0.00 179.01 177.18 2nx5 s ASP 74 N -6.88 3.55 -0.06 1.42 1.11 -1.26 -0.95 116.67 113.60 2nx5 s ASP 74 Ca -0.04 -0.38 0.02 0.00 0.18 0.00 0.00 52.55 52.34 2nx5 s ASP 74 Cb 0.13 -0.98 0.01 0.00 1.07 0.00 0.00 42.92 43.15 2nx5 s ASP 74 CO 0.78 0.26 -0.12 0.12 1.18 0.00 0.00 175.17 177.39 2nx5 s PHE 75 N -0.24 1.37 -0.25 4.23 5.36 0.00 -4.24 117.98 124.21 2nx5 s PHE 75 Ca -0.00 -0.47 0.01 0.00 -0.96 0.00 0.00 56.93 55.51 2nx5 s PHE 75 Cb -0.13 -1.00 0.07 0.00 -0.34 0.00 0.00 43.02 41.61 2nx5 s PHE 75 CO 0.03 -0.24 -0.04 -0.51 -1.46 0.00 0.00 175.22 173.00 2nx5 s LEU 76 N 0.57 2.78 -0.07 6.12 1.43 -0.45 -0.51 118.68 128.54 2nx5 s LEU 76 Ca -0.12 -1.30 -0.20 0.00 -1.03 0.00 0.00 54.13 51.48 2nx5 s LEU 76 Cb -0.15 -1.22 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 2nx5 s LEU 76 CO 0.03 -0.26 0.55 -0.22 0.23 0.00 0.00 176.35 176.68 2nx5 s LEU 77 N 1.35 4.33 -0.04 1.79 2.96 0.08 -1.65 118.68 127.50 2nx5 s LEU 77 Ca -0.04 0.98 0.01 0.00 -0.22 0.00 0.00 54.13 54.86 2nx5 s LEU 77 Cb -0.19 -2.83 0.02 0.00 0.50 0.00 0.00 46.19 43.70 2nx5 s LEU 77 CO -0.08 0.02 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.06 2nx5 s THR 78 N 0.38 0.36 -0.31 3.68 2.01 -0.47 0.12 115.64 121.41 2nx5 s THR 78 Ca 0.30 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.29 2nx5 s THR 78 Cb -0.16 -0.43 0.07 0.00 0.01 0.00 0.00 72.50 71.99 2nx5 s THR 78 CO 0.14 0.19 0.01 -1.48 -0.69 0.00 0.00 174.62 172.79 2nx5 s LEU 79 N 1.02 4.17 0.01 4.42 2.34 -1.17 -1.53 118.68 127.95 2nx5 s LEU 79 Ca -0.10 -1.62 -0.03 0.00 0.06 0.00 0.00 54.13 52.45 2nx5 s LEU 79 Cb -0.14 -1.67 -0.01 0.00 -0.56 0.00 0.00 46.19 43.81 2nx5 s LEU 79 CO -0.01 -0.31 1.04 -0.33 -1.06 0.00 0.00 176.35 175.68 2nx5 h GLU 80 N 7.86 -0.05 -3.60 1.48 5.08 -1.87 -2.98 114.58 120.50 2nx5 h GLU 80 Ca -0.16 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.48 2nx5 h GLU 80 Cb 1.04 0.01 -0.32 0.00 0.50 0.00 0.00 28.75 29.98 2nx5 h GLU 80 CO 0.54 -0.03 -0.15 0.45 -1.00 0.00 0.00 179.01 178.81 2nx5 s SER 81 N -2.72 5.88 0.11 1.42 0.15 -1.26 -1.90 113.70 115.37 2nx5 s SER 81 Ca -0.01 -2.99 -0.31 0.00 0.70 0.00 0.00 55.95 53.34 2nx5 s SER 81 Cb 0.01 -1.98 -0.10 0.00 -1.71 0.00 0.00 66.02 62.24 2nx5 s SER 81 CO 0.05 -0.39 1.78 0.00 1.20 0.00 0.00 173.24 175.88 2nx5 s ALA 82 N -0.27 3.75 0.26 5.45 0.00 -1.10 -4.52 121.76 125.34 2nx5 s ALA 82 Ca 0.20 1.40 0.11 0.00 0.00 0.00 0.00 51.96 53.66 2nx5 s ALA 82 Cb -0.15 -3.74 -0.05 0.00 0.00 0.00 0.00 23.12 19.18 2nx5 s ALA 82 CO -0.06 -1.18 -0.12 0.95 0.00 0.00 0.00 175.76 175.34 2nx5 s THR 83 N 2.63 2.87 -0.67 0.00 -4.23 -1.26 -0.29 115.64 114.69 2nx5 s THR 83 Ca 0.79 -2.16 0.17 0.00 -1.18 0.00 0.00 61.69 59.31 2nx5 s THR 83 Cb -0.45 -2.51 0.16 0.00 1.34 0.00 0.00 72.50 71.05 2nx5 s THR 83 CO 0.35 -0.36 1.51 -1.54 -0.54 0.00 0.00 174.62 174.05 2nx5 n SER 84 N -0.62 0.34 0.12 3.99 3.41 -1.26 -0.53 113.62 119.07 2nx5 n SER 84 Ca -0.06 0.61 -0.02 0.00 -0.26 0.00 0.00 58.87 59.14 2nx5 n SER 84 Cb 0.59 -0.67 0.19 0.00 -0.26 0.00 0.00 64.21 64.06 2nx5 n SER 84 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2nx5 h SER 85 N 0.00 0.11 -0.23 4.04 0.87 -1.95 -3.08 113.55 113.30 2nx5 h SER 85 Ca 0.00 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 2nx5 h SER 85 Cb 0.20 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 2nx5 h SER 85 CO 0.00 0.64 0.03 0.00 -0.53 0.00 0.00 176.83 176.97 2nx5 n GLN 86 N -3.89 2.32 -2.98 2.24 6.02 0.31 -4.79 117.38 116.61 2nx5 n GLN 86 Ca -0.02 -1.16 -0.42 0.00 -0.01 0.00 0.00 57.00 55.40 2nx5 n GLN 86 Cb 0.57 -1.74 -0.05 0.00 1.02 0.00 0.00 30.24 30.04 2nx5 n GLN 86 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2nx5 s THR 87 N -1.60 4.83 0.00 5.09 2.01 -1.17 -4.81 115.64 120.00 2nx5 s THR 87 Ca 0.20 1.12 0.00 0.00 0.31 0.00 0.00 61.69 63.32 2nx5 s THR 87 Cb 0.16 -4.11 0.00 0.00 0.01 0.00 0.00 72.50 68.56 2nx5 s THR 87 CO 0.06 -0.22 0.00 -1.54 -0.69 0.00 0.00 174.62 172.23 2nx5 n SER 88 N 6.12 0.00 -4.71 3.53 3.41 -0.91 -5.01 113.62 116.05 2nx5 n SER 88 Ca 0.03 -0.34 -0.35 0.00 -0.26 0.00 0.00 58.87 57.95 2nx5 n SER 88 Cb 0.48 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.34 2nx5 n SER 88 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2nx5 s VAL 89 N -2.37 4.54 -0.17 -3.33 1.01 -1.23 -1.60 120.40 117.25 2nx5 s VAL 89 Ca 0.00 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2nx5 s VAL 89 Cb 0.00 -2.93 0.02 0.00 0.00 0.00 0.00 36.38 33.47 2nx5 s VAL 89 CO 0.00 0.60 -0.19 -0.31 0.00 0.00 0.00 175.10 175.20 2nx5 s TYR 90 N -0.82 2.66 -0.08 5.22 2.02 0.07 -0.86 117.35 125.54 2nx5 s TYR 90 Ca 0.13 -1.52 0.02 0.00 -0.37 0.00 0.00 57.07 55.32 2nx5 s TYR 90 Cb -0.12 -1.85 -0.02 0.00 -0.40 0.00 0.00 41.96 39.58 2nx5 s TYR 90 CO 0.02 -0.75 -0.13 -0.06 -1.57 0.00 0.00 175.55 173.06 2nx5 s PHE 91 N 1.23 2.77 0.21 2.71 0.08 0.11 -1.13 117.98 123.95 2nx5 s PHE 91 Ca 0.03 -0.34 0.07 0.00 0.12 0.00 0.00 56.93 56.80 2nx5 s PHE 91 Cb -0.13 -1.73 -0.04 0.00 -0.57 0.00 0.00 43.02 40.55 2nx5 s PHE 91 CO -0.11 0.03 0.11 0.00 -0.10 0.00 0.00 175.22 175.16 2nx5 s ALA 93 N -1.94 -0.25 0.24 0.00 0.00 -0.63 -1.68 121.76 117.50 2nx5 s ALA 93 Ca 0.31 0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.55 2nx5 s ALA 93 Cb -0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 2nx5 s ALA 93 CO 0.23 -0.07 0.13 0.95 0.00 0.00 0.00 175.76 176.99 2nx5 s THR 94 N -0.18 4.18 -0.01 0.00 -4.23 -0.63 -0.18 115.64 114.58 2nx5 s THR 94 Ca -0.02 -1.47 -0.28 0.00 -1.18 0.00 0.00 61.69 58.73 2nx5 s THR 94 Cb -0.02 -3.23 0.10 0.00 1.34 0.00 0.00 72.50 70.69 2nx5 s THR 94 CO 0.00 -0.30 0.86 -0.83 -0.54 0.00 0.00 174.62 173.81 2nx5 s GLY 95 N -3.64 -0.46 0.00 3.99 0.00 -0.06 -1.04 107.32 106.12 2nx5 s GLY 95 Ca 0.32 1.14 0.29 0.00 0.00 0.00 0.00 44.72 46.47 2nx5 s GLY 95 CO 0.23 0.47 1.92 -1.30 0.00 0.00 0.00 173.10 174.43 2nx5 n THR 96 N -0.02 0.00 -0.02 0.90 -2.24 -1.26 -1.49 114.28 110.15 2nx5 n THR 96 Ca -0.11 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2nx5 n THR 96 Cb 0.61 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 2nx5 n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nx5 n GLY 97 N 1.28 2.10 3.68 3.38 0.00 -1.26 -4.78 105.19 109.59 2nx5 n GLY 97 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2nx5 n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2nx5 s ASP 98 N -3.41 6.83 0.47 1.61 1.11 -1.26 -4.91 116.67 117.09 2nx5 s ASP 98 Ca 0.00 2.09 0.28 0.00 0.18 0.00 0.00 52.55 55.09 2nx5 s ASP 98 Cb 0.00 -2.55 1.33 0.00 1.07 0.00 0.00 42.92 42.77 2nx5 s ASP 98 CO 0.00 -0.76 1.77 0.77 1.18 0.00 0.00 175.17 178.13 2nx5 h SER 99 N 8.17 0.23 -0.59 0.27 4.64 -2.01 -1.95 113.55 122.31 2nx5 h SER 99 Ca -0.37 0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 60.89 2nx5 h SER 99 Cb 1.17 0.02 -0.07 0.00 -0.31 0.00 0.00 62.40 63.21 2nx5 h SER 99 CO 0.92 0.02 0.15 -0.46 -0.87 0.00 0.00 176.83 176.59 2nx5 n ASN 100 N -4.43 4.71 -4.24 4.97 6.94 -1.26 -4.93 115.26 117.02 2nx5 n ASN 100 Ca 0.27 -2.96 -0.23 0.00 -0.02 0.00 0.00 54.58 51.64 2nx5 n ASN 100 Cb 1.10 -0.70 -0.13 0.00 -2.36 0.00 0.00 39.78 37.69 2nx5 n ASN 100 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2nx5 s GLN 101 N -2.60 1.09 0.82 -3.83 -1.52 -0.73 -5.14 119.66 107.74 2nx5 s GLN 101 Ca 0.47 -1.02 -0.11 0.00 -1.95 0.00 0.00 55.36 52.75 2nx5 s GLN 101 Cb 0.37 -1.24 0.08 0.00 -0.22 0.00 0.00 33.01 32.00 2nx5 s GLN 101 CO 0.13 0.30 1.09 -1.25 -0.25 0.00 0.00 175.29 175.31 2nx5 s PRO 105 N -1.61 1.94 0.03 2.91 0.04 -1.26 -4.87 135.00 132.18 2nx5 s PRO 105 Ca 0.04 0.71 -0.17 0.00 0.04 0.00 0.00 61.00 61.63 2nx5 s PRO 105 Cb -0.09 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 2nx5 s PRO 105 CO 0.03 -1.74 0.48 -0.65 0.04 0.00 0.00 177.00 175.15 2nx5 s GLN 106 N -5.09 4.04 -0.26 4.56 -0.21 -1.26 -4.68 119.66 116.76 2nx5 s GLN 106 Ca 0.61 0.55 -0.08 0.00 0.02 0.00 0.00 55.36 56.46 2nx5 s GLN 106 Cb -0.15 -3.23 -0.03 0.00 1.00 0.00 0.00 33.01 30.60 2nx5 s GLN 106 CO 0.55 0.66 0.10 -1.01 -2.12 0.00 0.00 175.29 173.46 2nx5 s HIS 107 N -1.06 3.12 -0.01 0.91 3.76 -0.20 -4.95 115.29 116.86 2nx5 s HIS 107 Ca 0.26 -0.42 -0.10 0.00 -0.15 0.00 0.00 55.06 54.65 2nx5 s HIS 107 Cb -0.18 -2.27 -0.05 0.00 1.11 0.00 0.00 32.58 31.19 2nx5 s HIS 107 CO 0.16 -0.37 0.31 -0.06 -0.85 0.00 0.00 174.74 173.93 2nx5 s PHE 108 N 1.62 3.63 0.77 1.40 0.08 -1.26 -1.61 117.98 122.61 2nx5 s PHE 108 Ca 0.06 0.73 -0.12 0.00 0.12 0.00 0.00 56.93 57.73 2nx5 s PHE 108 Cb -0.16 -2.10 0.05 0.00 -0.57 0.00 0.00 43.02 40.24 2nx5 s PHE 108 CO 0.05 0.63 1.11 0.20 -0.10 0.00 0.00 175.22 177.11 2nx5 s GLY 109 N -1.39 1.62 0.64 4.36 0.00 -0.67 -4.72 107.32 107.15 2nx5 s GLY 109 Ca 0.25 -0.35 0.43 0.00 0.00 0.00 0.00 44.72 45.05 2nx5 s GLY 109 CO 0.13 0.07 2.32 -0.55 0.00 0.00 0.00 173.10 175.07 2nx5 h ASP 110 N -0.93 0.00 -5.00 1.64 3.32 -1.91 -3.45 116.42 110.09 2nx5 h ASP 110 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2nx5 h ASP 110 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2nx5 h ASP 110 CO 0.62 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.75 2nx5 n GLY 111 N -1.06 2.58 2.78 2.75 0.00 -1.26 -5.06 105.19 105.91 2nx5 n GLY 111 Ca -0.03 -1.92 -0.24 0.00 0.00 0.00 0.00 46.02 43.84 2nx5 n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nx5 s THR 112 N -2.94 0.45 -0.53 2.61 2.01 -0.29 -4.78 115.64 112.18 2nx5 s THR 112 Ca 0.00 0.02 -0.25 0.00 0.31 0.00 0.00 61.69 61.77 2nx5 s THR 112 Cb 0.00 -0.63 0.04 0.00 0.01 0.00 0.00 72.50 71.92 2nx5 s THR 112 CO 0.00 0.23 0.97 -0.13 -0.69 0.00 0.00 174.62 175.00 2nx5 s ARG 113 N 1.94 3.42 -0.23 4.92 0.52 0.26 -0.75 118.95 129.02 2nx5 s ARG 113 Ca 0.04 -0.06 -0.02 0.00 -0.52 0.00 0.00 55.73 55.18 2nx5 s ARG 113 Cb -0.13 -4.01 0.02 0.00 0.52 0.00 0.00 34.95 31.35 2nx5 s ARG 113 CO -0.06 -1.43 -0.08 -1.17 0.02 0.00 0.00 175.30 172.58 2nx5 s LEU 114 N 4.03 2.93 -0.21 2.53 2.96 -0.63 -0.74 118.68 129.55 2nx5 s LEU 114 Ca 0.34 -0.73 -0.01 0.00 -0.22 0.00 0.00 54.13 53.51 2nx5 s LEU 114 Cb -0.11 -1.64 0.01 0.00 0.50 0.00 0.00 46.19 44.94 2nx5 s LEU 114 CO 0.22 -0.08 -0.11 -0.55 -1.32 0.00 0.00 176.35 174.51 2nx5 s SER 115 N 1.35 3.81 -0.22 3.68 0.15 0.27 -2.15 113.70 120.59 2nx5 s SER 115 Ca 0.02 -0.59 -0.07 0.00 0.70 0.00 0.00 55.95 56.01 2nx5 s SER 115 Cb -0.15 -1.62 -0.03 0.00 -1.71 0.00 0.00 66.02 62.51 2nx5 s SER 115 CO -0.06 -0.03 0.05 -0.63 1.20 0.00 0.00 173.24 173.77 2nx5 s ILE 116 N 1.37 4.39 0.18 6.45 -1.09 -1.26 -1.95 121.20 129.29 2nx5 s ILE 116 Ca 0.04 -0.16 0.09 0.00 -2.23 0.00 0.00 60.65 58.40 2nx5 s ILE 116 Cb -0.14 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.68 2nx5 s ILE 116 CO -0.08 0.39 -0.19 -0.76 -1.23 0.00 0.00 174.94 173.08 2nx5 s LEU 117 N 1.10 2.45 -0.01 2.97 1.43 -0.52 -4.46 118.68 121.64 2nx5 s LEU 117 Ca 0.04 -0.88 -0.24 0.00 -1.03 0.00 0.00 54.13 52.02 2nx5 s LEU 117 Cb -0.14 -0.89 -0.19 0.00 0.03 0.00 0.00 46.19 45.00 2nx5 s LEU 117 CO 0.03 -0.01 1.29 -0.33 0.23 0.00 0.00 176.35 177.56 2nx5 h GLU 118 N 3.16 0.09 -4.13 1.70 4.39 -1.95 0.53 114.58 118.37 2nx5 h GLU 118 Ca -0.43 -0.05 -0.48 0.00 0.34 0.00 0.00 59.36 58.75 2nx5 h GLU 118 Cb 1.21 0.00 -0.36 0.00 -0.10 0.00 0.00 28.75 29.50 2nx5 h GLU 118 CO 0.51 0.55 -0.79 0.34 -1.16 0.00 0.00 179.01 178.46 2nx5 s ASP 119 N -5.80 1.69 0.15 1.42 2.15 -1.26 -4.57 116.67 110.45 2nx5 s ASP 119 Ca -0.15 -0.21 0.21 0.00 0.43 0.00 0.00 52.55 52.82 2nx5 s ASP 119 Cb 0.03 -0.66 0.85 0.00 -0.30 0.00 0.00 42.92 42.84 2nx5 s ASP 119 CO 0.69 -0.09 1.64 0.18 -0.17 0.00 0.00 175.17 177.42 2nx5 n LEU 120 N 4.55 0.41 0.00 -1.34 4.77 -1.26 -2.63 117.00 121.50 2nx5 n LEU 120 Ca -0.16 0.59 0.07 0.00 -0.03 0.00 0.00 56.01 56.48 2nx5 n LEU 120 Cb 0.51 -0.53 0.31 0.00 -2.33 0.00 0.00 43.42 41.38 2nx5 n LEU 120 CO 0.19 -0.40 0.70 -3.20 -1.33 0.00 0.00 177.39 173.34 2nx5 n ASN 121 N -1.95 0.00 -0.14 -1.43 2.85 -1.26 -2.22 115.26 111.11 2nx5 n ASN 121 Ca 0.03 0.31 0.15 0.00 -0.11 0.00 0.00 54.58 54.96 2nx5 n ASN 121 Cb 0.23 -0.40 0.68 0.00 1.24 0.00 0.00 39.78 41.53 2nx5 n ASN 121 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2nx5 n LYS 122 N -1.40 0.89 -3.10 1.20 4.76 -1.08 -4.80 118.16 114.63 2nx5 n LYS 122 Ca 0.05 -0.28 -0.41 0.00 -2.87 0.00 0.00 58.31 54.80 2nx5 n LYS 122 Cb 0.13 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 31.77 2nx5 n LYS 122 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2nx5 s VAL 123 N -2.30 4.90 0.11 -0.18 1.01 -0.94 -4.65 120.40 118.33 2nx5 s VAL 123 Ca 0.35 0.74 0.10 0.00 0.00 0.00 0.00 61.98 63.17 2nx5 s VAL 123 Cb 0.21 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 2nx5 s VAL 123 CO 0.43 -0.25 -0.26 -0.36 0.00 0.00 0.00 175.10 174.66 2nx5 s PHE 124 N 2.70 2.25 0.79 5.22 0.08 -1.04 -4.71 117.98 123.27 2nx5 s PHE 124 Ca 0.25 -0.39 -0.12 0.00 0.12 0.00 0.00 56.93 56.80 2nx5 s PHE 124 Cb -0.15 -1.25 0.07 0.00 -0.57 0.00 0.00 43.02 41.12 2nx5 s PHE 124 CO 0.14 0.28 1.11 -2.14 -0.10 0.00 0.00 175.22 174.50 2nx5 s PRO 125 N -1.85 2.13 0.33 0.24 0.02 -1.26 -2.60 135.00 132.02 2nx5 s PRO 125 Ca 0.13 0.54 -0.20 0.00 0.02 0.00 0.00 61.00 61.49 2nx5 s PRO 125 Cb -0.10 -1.93 -0.10 0.00 0.02 0.00 0.00 34.50 32.39 2nx5 s PRO 125 CO 0.05 -1.56 0.84 -1.25 -0.33 0.00 0.00 177.00 174.74 2nx5 s PRO 126 N -5.23 4.24 -0.14 5.54 0.04 -1.26 -3.90 135.00 134.28 2nx5 s PRO 126 Ca 0.61 0.98 -0.13 0.00 0.04 0.00 0.00 61.00 62.50 2nx5 s PRO 126 Cb -0.14 -2.53 -0.05 0.00 0.04 0.00 0.00 34.50 31.83 2nx5 s PRO 126 CO 0.53 0.18 0.27 -1.21 0.04 0.00 0.00 177.00 176.81 2nx5 s GLU 127 N -2.64 4.11 -0.08 4.56 2.02 0.53 -4.91 118.70 122.30 2nx5 s GLU 127 Ca 0.53 0.06 0.03 0.00 0.02 0.00 0.00 54.97 55.62 2nx5 s GLU 127 Cb -0.13 -3.37 -0.02 0.00 0.10 0.00 0.00 34.13 30.71 2nx5 s GLU 127 CO 0.18 0.36 -0.17 0.08 0.02 0.00 0.00 175.26 175.73 2nx5 s VAL 128 N 0.11 2.75 -0.06 2.63 1.01 -1.26 -0.55 120.40 125.03 2nx5 s VAL 128 Ca 0.16 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 2nx5 s VAL 128 Cb -0.13 -2.09 0.02 0.00 0.00 0.00 0.00 36.38 34.18 2nx5 s VAL 128 CO 0.04 0.56 0.14 0.00 0.00 0.00 0.00 175.10 175.85 2nx5 s ALA 129 N -0.15 -0.33 -0.18 5.51 0.00 -0.13 -4.70 121.76 121.77 2nx5 s ALA 129 Ca -0.02 0.46 -0.07 0.00 0.00 0.00 0.00 51.96 52.33 2nx5 s ALA 129 Cb -0.14 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 2nx5 s ALA 129 CO 0.04 -0.09 0.07 0.08 0.00 0.00 0.00 175.76 175.86 2nx5 s VAL 130 N 0.32 4.84 -0.08 0.00 1.01 -1.26 -0.85 120.40 124.37 2nx5 s VAL 130 Ca -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 2nx5 s VAL 130 Cb -0.03 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 2nx5 s VAL 130 CO -0.01 0.47 -0.05 -0.36 0.00 0.00 0.00 175.10 175.15 2nx5 s PHE 131 N 0.25 2.99 0.40 5.22 0.08 0.53 -5.00 117.98 122.45 2nx5 s PHE 131 Ca 0.04 0.03 -0.20 0.00 0.12 0.00 0.00 56.93 56.92 2nx5 s PHE 131 Cb -0.12 -1.74 -0.11 0.00 -0.57 0.00 0.00 43.02 40.48 2nx5 s PHE 131 CO 0.00 0.33 0.90 -1.21 -0.10 0.00 0.00 175.22 175.14 2nx5 s GLU 132 N -0.73 4.20 0.49 0.44 2.02 -1.26 -3.01 118.70 120.85 2nx5 s GLU 132 Ca 0.11 1.03 -0.22 0.00 0.02 0.00 0.00 54.97 55.91 2nx5 s GLU 132 Cb -0.11 -2.26 -0.08 0.00 0.10 0.00 0.00 34.13 31.77 2nx5 s GLU 132 CO 0.02 0.03 1.02 -2.30 0.02 0.00 0.00 175.26 174.04 2nx5 n PRO 133 N -0.52 1.25 -2.10 0.39 -0.02 -1.23 -4.89 135.00 127.88 2nx5 n PRO 133 Ca 0.06 0.46 -0.43 0.00 -2.02 0.00 0.00 63.50 61.57 2nx5 n PRO 133 Cb 0.54 -2.14 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 2nx5 n PRO 133 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2nx5 s SER 134 N -0.91 6.40 0.58 2.55 0.15 -1.26 -4.87 113.70 116.34 2nx5 s SER 134 Ca 0.68 1.69 0.28 0.00 0.70 0.00 0.00 55.95 59.30 2nx5 s SER 134 Cb -0.49 -2.53 1.61 0.00 -1.71 0.00 0.00 66.02 62.90 2nx5 s SER 134 CO 0.53 -1.23 2.09 -0.33 1.20 0.00 0.00 173.24 175.51 2nx5 h GLU 135 N 10.62 0.00 -0.59 5.44 4.39 -1.99 0.02 114.58 132.48 2nx5 h GLU 135 Ca -0.34 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.27 2nx5 h GLU 135 Cb 1.16 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.78 2nx5 h GLU 135 CO 1.00 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 178.85 2nx5 h ALA 136 N 1.77 0.89 -0.14 3.43 0.00 -2.00 -2.80 119.26 120.41 2nx5 h ALA 136 Ca 0.10 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 2nx5 h ALA 136 Cb 0.53 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2nx5 h ALA 136 CO -0.00 0.66 -0.49 1.49 0.00 0.00 0.00 179.25 180.90 2nx5 h GLU 137 N 0.94 0.37 -0.68 0.00 4.81 -1.35 -2.87 114.58 115.79 2nx5 h GLU 137 Ca 0.17 -0.21 -0.08 0.00 -0.13 0.00 0.00 59.36 59.11 2nx5 h GLU 137 Cb 0.54 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 2nx5 h GLU 137 CO 0.03 0.78 0.11 0.82 -0.73 0.00 0.00 179.01 180.02 2nx5 h ILE 138 N 0.29 1.27 0.00 2.32 2.04 -1.12 0.45 117.51 122.76 2nx5 h ILE 138 Ca 0.01 -1.04 -0.18 0.00 1.00 0.00 0.00 64.86 64.65 2nx5 h ILE 138 Cb 0.97 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 2nx5 h ILE 138 CO 0.08 0.39 -0.88 0.77 0.00 0.00 0.00 178.15 178.52 2nx5 h SER 139 N 1.06 0.00 0.75 1.72 4.64 -1.54 -2.46 113.55 117.71 2nx5 h SER 139 Ca 0.21 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.33 2nx5 h SER 139 Cb 0.44 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.50 2nx5 h SER 139 CO 0.01 0.84 -1.37 -0.74 -0.87 0.00 0.00 176.83 174.70 2nx5 h HIS 140 N 0.00 0.00 0.00 4.77 -0.00 -1.38 -3.41 115.15 115.13 2nx5 h HIS 140 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.35 2nx5 h HIS 140 Cb 1.66 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.07 2nx5 h HIS 140 CO 0.00 0.70 -0.94 0.25 -0.00 0.00 0.00 177.93 177.95 2nx5 n THR 141 N -2.99 0.00 -1.35 6.26 -2.24 0.14 -4.99 114.28 109.10 2nx5 n THR 141 Ca -0.10 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 2nx5 n THR 141 Cb 0.89 0.37 -0.05 0.00 -2.10 0.00 0.00 70.33 69.43 2nx5 n THR 141 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nx5 n GLN 142 N -1.44 -1.13 -4.61 -0.78 3.00 -0.92 -5.00 117.38 106.50 2nx5 n GLN 142 Ca 0.00 0.89 -0.22 0.00 -0.01 0.00 0.00 57.00 57.66 2nx5 n GLN 142 Cb 0.03 -5.02 -0.15 0.00 0.00 0.00 0.00 30.24 25.10 2nx5 n GLN 142 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 2nx5 s LYS 143 N -2.90 1.19 -0.13 -1.09 1.02 -1.26 -0.23 119.74 116.34 2nx5 s LYS 143 Ca 0.00 -0.47 0.02 0.00 0.02 0.00 0.00 55.97 55.54 2nx5 s LYS 143 Cb 0.00 -1.12 -0.00 0.00 -0.52 0.00 0.00 37.83 36.19 2nx5 s LYS 143 CO 0.00 0.24 -0.18 0.00 -0.92 0.00 0.00 175.35 174.49 2nx5 s ALA 144 N -0.13 2.38 -0.17 5.17 0.00 0.62 -3.95 121.76 125.68 2nx5 s ALA 144 Ca 0.02 -1.01 -0.04 0.00 0.00 0.00 0.00 51.96 50.93 2nx5 s ALA 144 Cb -0.07 -1.07 -0.02 0.00 0.00 0.00 0.00 23.12 21.96 2nx5 s ALA 144 CO 0.00 0.10 -0.03 0.99 0.00 0.00 0.00 175.76 176.82 2nx5 s THR 145 N 0.61 3.78 -0.24 0.00 2.01 -1.26 -1.79 115.64 118.75 2nx5 s THR 145 Ca -0.10 -0.38 -0.11 0.00 0.31 0.00 0.00 61.69 61.41 2nx5 s THR 145 Cb -0.16 -2.68 -0.05 0.00 0.01 0.00 0.00 72.50 69.62 2nx5 s THR 145 CO 0.03 0.47 0.17 -0.76 -0.69 0.00 0.00 174.62 173.83 2nx5 s LEU 146 N 0.67 4.12 -0.14 4.42 1.02 -0.06 -3.55 118.68 125.16 2nx5 s LEU 146 Ca -0.02 0.13 -0.06 0.00 0.02 0.00 0.00 54.13 54.19 2nx5 s LEU 146 Cb -0.14 -2.12 -0.04 0.00 0.02 0.00 0.00 46.19 43.91 2nx5 s LEU 146 CO 0.02 0.06 0.10 -0.69 0.02 0.00 0.00 176.35 175.86 2nx5 s VAL 147 N 1.04 5.12 -0.16 -1.59 1.01 -1.16 0.11 120.40 124.77 2nx5 s VAL 147 Ca 0.08 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.14 2nx5 s VAL 147 Cb -0.13 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.01 2nx5 s VAL 147 CO 0.04 0.56 -0.19 0.00 0.00 0.00 0.00 175.10 175.51 2nx5 s LEU 149 N 1.03 3.45 -0.20 0.00 1.43 -0.03 -0.92 118.68 123.45 2nx5 s LEU 149 Ca -0.01 -0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 52.97 2nx5 s LEU 149 Cb -0.14 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.20 2nx5 s LEU 149 CO -0.06 0.12 -0.07 0.00 0.23 0.00 0.00 176.35 176.57 2nx5 s ALA 150 N 0.67 2.75 0.17 4.21 0.00 0.60 -0.96 121.76 129.20 2nx5 s ALA 150 Ca 0.01 -1.11 0.03 0.00 0.00 0.00 0.00 51.96 50.89 2nx5 s ALA 150 Cb -0.14 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.37 2nx5 s ALA 150 CO 0.02 -0.28 -0.04 0.95 0.00 0.00 0.00 175.76 176.41 2nx5 s THR 151 N 1.22 0.90 -0.80 0.00 -4.23 0.28 -0.35 115.64 112.67 2nx5 s THR 151 Ca 0.03 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.53 2nx5 s THR 151 Cb -0.14 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.68 2nx5 s THR 151 CO -0.02 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.08 2nx5 n GLY 152 N -0.23 0.96 3.84 3.99 0.00 -1.01 -0.34 105.19 112.39 2nx5 n GLY 152 Ca -0.08 -0.63 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 2nx5 n GLY 152 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nx5 s PHE 153 N -2.26 3.37 -0.16 1.61 -0.12 -1.18 -4.51 117.98 114.73 2nx5 s PHE 153 Ca 0.00 0.22 -0.13 0.00 -0.05 0.00 0.00 56.93 56.96 2nx5 s PHE 153 Cb 0.00 -1.73 0.05 0.00 -0.63 0.00 0.00 43.02 40.70 2nx5 s PHE 153 CO 0.00 0.57 0.42 0.12 -0.05 0.00 0.00 175.22 176.29 2nx5 s PHE 154 N -1.35 -0.51 0.27 3.49 5.36 -1.07 0.59 117.98 124.76 2nx5 s PHE 154 Ca 0.28 1.19 -0.05 0.00 -0.96 0.00 0.00 56.93 57.40 2nx5 s PHE 154 Cb -0.12 0.19 0.06 0.00 -0.34 0.00 0.00 43.02 42.81 2nx5 s PHE 154 CO 0.20 -0.26 0.34 -0.35 -1.46 0.00 0.00 175.22 173.69 2nx5 n PRO 155 N 3.23 -0.54 -0.04 10.12 -0.04 -1.26 -2.49 135.00 143.98 2nx5 n PRO 155 Ca -0.16 -0.53 0.00 0.00 -0.04 0.00 0.00 63.50 62.78 2nx5 n PRO 155 Cb 0.57 -0.37 0.00 0.00 -0.04 0.00 0.00 33.50 33.66 2nx5 n PRO 155 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2nx5 n ASP 156 N -3.27 2.85 -4.29 3.54 5.68 -1.26 -4.70 116.55 115.10 2nx5 n ASP 156 Ca 0.04 -1.82 -0.44 0.00 -0.50 0.00 0.00 54.79 52.07 2nx5 n ASP 156 Cb 0.15 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 39.64 2nx5 n ASP 156 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2nx5 n HIS 157 N 0.65 4.50 -4.23 2.11 8.25 -1.26 -4.98 115.22 120.25 2nx5 n HIS 157 Ca 0.00 -3.39 -0.13 0.00 -0.26 0.00 0.00 57.72 53.94 2nx5 n HIS 157 Cb 0.44 -1.88 -0.10 0.00 1.12 0.00 0.00 29.99 29.57 2nx5 n HIS 157 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2nx5 s VAL 158 N -0.09 0.63 -0.15 1.59 -7.23 -1.26 -2.43 120.40 111.46 2nx5 s VAL 158 Ca 0.37 -1.97 -0.02 0.00 -1.81 0.00 0.00 61.98 58.54 2nx5 s VAL 158 Cb -0.03 -2.09 0.05 0.00 0.56 0.00 0.00 36.38 34.87 2nx5 s VAL 158 CO -0.01 -0.49 0.03 -1.61 -0.31 0.00 0.00 175.10 172.70 2nx5 s GLU 159 N -3.92 0.60 -0.02 4.82 2.02 -0.06 -4.97 118.70 117.17 2nx5 s GLU 159 Ca 0.23 -0.20 -0.08 0.00 0.02 0.00 0.00 54.97 54.95 2nx5 s GLU 159 Cb 0.06 -1.67 -0.05 0.00 0.10 0.00 0.00 34.13 32.57 2nx5 s GLU 159 CO 0.03 -0.52 0.26 -1.17 0.02 0.00 0.00 175.26 173.89 2nx5 s LEU 160 N 1.92 4.39 -0.13 1.80 0.20 -1.26 -0.53 118.68 125.07 2nx5 s LEU 160 Ca 0.02 0.59 -0.17 0.00 0.69 0.00 0.00 54.13 55.26 2nx5 s LEU 160 Cb -0.15 -2.56 0.04 0.00 -0.43 0.00 0.00 46.19 43.09 2nx5 s LEU 160 CO -0.07 0.29 0.44 -0.94 -0.29 0.00 0.00 176.35 175.78 2nx5 s SER 161 N -1.51 -0.43 -0.15 3.68 1.04 0.10 -5.00 113.70 111.43 2nx5 s SER 161 Ca 0.25 0.73 -0.07 0.00 0.48 0.00 0.00 55.95 57.35 2nx5 s SER 161 Cb -0.13 0.77 -0.04 0.00 0.10 0.00 0.00 66.02 66.72 2nx5 s SER 161 CO 0.14 -0.25 0.08 0.26 0.98 0.00 0.00 173.24 174.44 2nx5 s TRP 162 N -0.19 3.35 -0.14 5.02 0.52 -1.26 0.32 118.94 126.55 2nx5 s TRP 162 Ca -0.04 0.25 0.00 0.00 0.02 0.00 0.00 56.10 56.34 2nx5 s TRP 162 Cb -0.03 -2.00 0.02 0.00 -1.15 0.00 0.00 33.47 30.32 2nx5 s TRP 162 CO 0.02 0.39 -0.11 -1.58 0.02 0.00 0.00 176.95 175.69 2nx5 s TRP 163 N -0.25 1.92 -0.18 -1.98 0.52 0.11 -1.17 118.94 117.91 2nx5 s TRP 163 Ca 0.09 -1.06 -0.01 0.00 0.02 0.00 0.00 56.10 55.13 2nx5 s TRP 163 Cb -0.12 -1.46 0.00 0.00 -1.15 0.00 0.00 33.47 30.74 2nx5 s TRP 163 CO 0.01 -0.62 -0.12 0.08 0.02 0.00 0.00 176.95 176.32 2nx5 s VAL 164 N 1.57 2.80 -1.09 4.03 1.01 -0.62 -0.69 120.40 127.40 2nx5 s VAL 164 Ca 0.05 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2nx5 s VAL 164 Cb -0.13 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 34.03 2nx5 s VAL 164 CO -0.10 0.49 0.00 0.59 0.00 0.00 0.00 175.10 176.08 2nx5 n ASN 165 N 4.42 -2.97 0.00 3.32 3.02 -0.68 -2.18 115.26 120.18 2nx5 n ASN 165 Ca -0.19 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2nx5 n ASN 165 Cb 0.51 -2.80 0.00 0.00 -0.61 0.00 0.00 39.78 36.88 2nx5 n ASN 165 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2nx5 n GLY 166 N -0.32 1.14 2.88 7.41 0.00 -1.26 -5.04 105.19 110.00 2nx5 n GLY 166 Ca -0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 2nx5 n GLY 166 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nx5 s LYS 167 N -0.45 0.13 0.30 1.61 2.36 -0.92 -5.13 119.74 117.64 2nx5 s LYS 167 Ca 0.00 -0.03 -0.30 0.00 -2.55 0.00 0.00 55.97 53.10 2nx5 s LYS 167 Cb 0.00 -0.17 -0.11 0.00 -1.05 0.00 0.00 37.83 36.50 2nx5 s LYS 167 CO 0.00 0.00 1.59 -2.00 1.55 0.00 0.00 175.35 176.49 2nx5 s GLU 168 N 0.15 4.12 0.15 4.03 2.12 -1.26 -1.59 118.70 126.42 2nx5 s GLU 168 Ca -0.01 2.58 0.10 0.00 0.36 0.00 0.00 54.97 57.99 2nx5 s GLU 168 Cb -0.03 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.30 2nx5 s GLU 168 CO -0.00 -0.63 -0.17 0.14 -0.54 0.00 0.00 175.26 174.06 2nx5 s VAL 169 N -0.06 2.81 0.00 3.70 -7.23 -0.32 -4.91 120.40 114.40 2nx5 s VAL 169 Ca 0.63 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 2nx5 s VAL 169 Cb -0.48 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.13 2nx5 s VAL 169 CO 0.49 -0.00 0.00 1.41 -0.31 0.00 0.00 175.10 176.68 2nx5 n HIS 170 N 0.48 0.00 -1.97 2.82 -0.00 -1.26 -4.49 115.22 110.80 2nx5 n HIS 170 Ca -0.14 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.17 2nx5 n HIS 170 Cb 0.54 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.52 2nx5 n HIS 170 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 2nx5 s SER 171 N -2.31 6.58 0.00 0.41 0.01 -1.26 -2.47 113.70 114.66 2nx5 s SER 171 Ca 0.00 2.83 0.00 0.00 1.31 0.00 0.00 55.95 60.09 2nx5 s SER 171 Cb 0.00 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.58 2nx5 s SER 171 CO 0.00 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.56 2nx5 n GLY 172 N 0.92 0.13 3.79 3.44 0.00 -1.26 -4.70 105.19 107.51 2nx5 n GLY 172 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2nx5 n GLY 172 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nx5 s VAL 173 N -1.32 5.00 -0.19 1.61 1.01 -1.03 -0.36 120.40 125.12 2nx5 s VAL 173 Ca 0.00 0.99 -0.04 0.00 0.00 0.00 0.00 61.98 62.93 2nx5 s VAL 173 Cb 0.00 -3.80 0.09 0.00 0.00 0.00 0.00 36.38 32.66 2nx5 s VAL 173 CO 0.00 0.48 0.20 0.00 0.00 0.00 0.00 175.10 175.78 2nx5 s THR 175 N 2.29 3.52 0.31 0.00 2.01 -1.26 0.31 115.64 122.81 2nx5 s THR 175 Ca 0.06 -0.86 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 2nx5 s THR 175 Cb -0.16 -2.53 -0.11 0.00 0.01 0.00 0.00 72.50 69.71 2nx5 s THR 175 CO -0.11 0.37 1.59 -1.81 -0.69 0.00 0.00 174.62 173.96 2nx5 s ASP 176 N -1.47 6.34 0.15 3.53 1.01 -0.97 -4.92 116.67 120.33 2nx5 s ASP 176 Ca 0.17 3.00 -0.13 0.00 0.71 0.00 0.00 52.55 56.29 2nx5 s ASP 176 Cb -0.11 -2.64 0.03 0.00 1.01 0.00 0.00 42.92 41.20 2nx5 s ASP 176 CO 0.08 -0.93 1.66 -0.65 0.21 0.00 0.00 175.17 175.53 2nx5 h PRO 177 N 4.50 0.78 -5.72 8.23 0.11 -1.98 -3.44 132.00 134.48 2nx5 h PRO 177 Ca -0.48 -0.19 -0.55 0.00 0.11 0.00 0.00 66.00 64.90 2nx5 h PRO 177 Cb 1.22 -0.10 -0.28 0.00 0.11 0.00 0.00 31.00 31.95 2nx5 h PRO 177 CO 0.77 0.76 -0.83 -0.65 -0.21 0.00 0.00 178.00 177.83 2nx5 s GLN 178 N -5.31 1.38 0.75 1.05 -1.52 -1.26 -5.14 119.66 109.61 2nx5 s GLN 178 Ca -0.13 -0.69 -0.13 0.00 -1.95 0.00 0.00 55.36 52.46 2nx5 s GLN 178 Cb 0.11 -1.37 0.05 0.00 -0.22 0.00 0.00 33.01 31.58 2nx5 s GLN 178 CO 0.79 0.37 1.14 -2.14 -0.25 0.00 0.00 175.29 175.20 2nx5 s PRO 179 N -0.59 2.18 -0.13 2.91 0.02 -1.26 -4.99 135.00 133.14 2nx5 s PRO 179 Ca 0.06 1.49 -0.04 0.00 0.02 0.00 0.00 61.00 62.53 2nx5 s PRO 179 Cb -0.07 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 2nx5 s PRO 179 CO -0.00 -1.74 0.03 -1.17 -0.33 0.00 0.00 177.00 173.78 2nx5 s LEU 180 N -5.46 3.70 -0.01 -5.54 0.20 0.71 -4.90 118.68 107.39 2nx5 s LEU 180 Ca 0.68 0.13 -0.30 0.00 0.69 0.00 0.00 54.13 55.33 2nx5 s LEU 180 Cb -0.23 -1.89 -0.04 0.00 -0.43 0.00 0.00 46.19 43.60 2nx5 s LEU 180 CO 0.48 0.29 1.18 -0.54 -0.29 0.00 0.00 176.35 177.47 2nx5 s LYS 181 N -0.35 4.40 0.51 1.98 1.02 -1.26 0.19 119.74 126.23 2nx5 s LYS 181 Ca 0.08 1.68 0.30 0.00 0.02 0.00 0.00 55.97 58.05 2nx5 s LYS 181 Cb -0.12 -3.48 1.00 0.00 -0.52 0.00 0.00 37.83 34.71 2nx5 s LYS 181 CO 0.02 -0.35 1.85 0.93 -0.92 0.00 0.00 175.35 176.88 2nx5 h GLU 182 N 7.18 0.00 -2.67 1.68 5.08 -1.73 -3.32 114.58 120.80 2nx5 h GLU 182 Ca -0.37 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.39 2nx5 h GLU 182 Cb 1.18 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.04 2nx5 h GLU 182 CO 0.85 0.01 -0.84 -0.65 -1.00 0.00 0.00 179.01 177.38 2nx5 s GLN 183 N -3.51 0.98 0.38 2.33 -0.21 -1.26 -5.01 119.66 113.36 2nx5 s GLN 183 Ca 0.03 -1.88 0.11 0.00 0.02 0.00 0.00 55.36 53.65 2nx5 s GLN 183 Cb 0.08 -1.76 0.89 0.00 1.00 0.00 0.00 33.01 33.22 2nx5 s GLN 183 CO 0.59 -1.25 1.89 -1.35 -2.12 0.00 0.00 175.29 173.05 2nx5 h PRO 184 N 6.43 0.58 0.01 2.91 0.11 -1.97 -2.49 132.00 137.58 2nx5 h PRO 184 Ca 0.11 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 2nx5 h PRO 184 Cb 0.93 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.90 2nx5 h PRO 184 CO 0.38 0.39 -0.00 0.00 -0.21 0.00 0.00 178.00 178.56 2nx5 h ALA 185 N 1.61 -0.01 -2.93 -0.75 0.00 -1.95 -3.45 119.26 111.79 2nx5 h ALA 185 Ca 0.41 -0.23 -0.54 0.00 0.00 0.00 0.00 54.91 54.55 2nx5 h ALA 185 Cb 0.74 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.64 2nx5 h ALA 185 CO -0.17 -0.27 0.79 -1.17 0.00 0.00 0.00 179.25 178.44 2nx5 s LEU 186 N -9.26 4.32 0.43 0.00 2.96 -0.94 -4.99 118.68 111.19 2nx5 s LEU 186 Ca -0.16 3.06 -0.22 0.00 -0.22 0.00 0.00 54.13 56.59 2nx5 s LEU 186 Cb 0.02 -3.67 -0.10 0.00 0.50 0.00 0.00 46.19 42.94 2nx5 s LEU 186 CO 0.67 -0.89 0.99 0.20 -1.32 0.00 0.00 176.35 176.00 2nx5 s ASN 187 N -0.08 6.79 -1.60 3.68 0.01 -1.26 -3.81 114.94 118.67 2nx5 s ASN 187 Ca 0.54 1.85 -0.14 0.00 -0.71 0.00 0.00 52.86 54.40 2nx5 s ASN 187 Cb -0.47 -2.56 0.11 0.00 0.41 0.00 0.00 41.25 38.74 2nx5 s ASN 187 CO 0.62 -0.47 0.80 0.47 -1.51 0.00 0.00 177.10 177.01 2nx5 n ASP 188 N -0.46 -3.31 -4.76 -1.22 8.00 -1.26 -4.93 116.55 108.61 2nx5 n ASP 188 Ca 0.07 -0.93 -0.37 0.00 0.71 0.00 0.00 54.79 54.26 2nx5 n ASP 188 Cb 0.52 -3.18 0.01 0.00 -0.02 0.00 0.00 41.12 38.45 2nx5 n ASP 188 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2nx5 s SER 189 N -3.48 5.73 0.51 -2.24 0.15 -1.25 -5.01 113.70 108.12 2nx5 s SER 189 Ca 0.60 2.44 -0.20 0.00 0.70 0.00 0.00 55.95 59.49 2nx5 s SER 189 Cb -0.32 -2.61 -0.07 0.00 -1.71 0.00 0.00 66.02 61.31 2nx5 s SER 189 CO 0.89 -1.23 1.07 -0.13 1.20 0.00 0.00 173.24 175.04 2nx5 s ARG 190 N -2.89 3.63 0.24 5.44 0.52 -1.26 -4.84 118.95 119.77 2nx5 s ARG 190 Ca 0.69 1.43 0.05 0.00 -0.52 0.00 0.00 55.73 57.38 2nx5 s ARG 190 Cb -0.32 -2.06 -0.03 0.00 0.52 0.00 0.00 34.95 33.06 2nx5 s ARG 190 CO 0.38 -0.59 0.31 0.71 0.02 0.00 0.00 175.30 176.13 2nx5 s TYR 191 N -1.94 3.37 0.02 -0.53 2.02 0.20 -2.01 117.35 118.47 2nx5 s TYR 191 Ca 0.69 -0.03 0.04 0.00 -0.37 0.00 0.00 57.07 57.40 2nx5 s TYR 191 Cb -0.19 -1.54 -0.02 0.00 -0.40 0.00 0.00 41.96 39.82 2nx5 s TYR 191 CO 0.23 0.47 -0.13 0.00 -1.57 0.00 0.00 175.55 174.54 2nx5 s ALA 192 N -2.00 1.10 -0.01 3.71 0.00 0.13 -2.40 121.76 122.29 2nx5 s ALA 192 Ca 0.34 -0.70 -0.01 0.00 0.00 0.00 0.00 51.96 51.59 2nx5 s ALA 192 Cb -0.09 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.82 2nx5 s ALA 192 CO 0.28 0.23 0.03 -1.17 0.00 0.00 0.00 175.76 175.13 2nx5 s LEU 193 N -0.76 1.66 0.19 0.00 2.96 0.53 -0.21 118.68 123.06 2nx5 s LEU 193 Ca 0.03 0.06 0.10 0.00 -0.22 0.00 0.00 54.13 54.10 2nx5 s LEU 193 Cb -0.07 0.06 -0.04 0.00 0.50 0.00 0.00 46.19 46.64 2nx5 s LEU 193 CO 0.00 -0.04 -0.22 -0.94 -1.32 0.00 0.00 176.35 173.84 2nx5 s SER 194 N 0.31 3.19 0.04 3.68 1.04 -1.26 -0.29 113.70 120.41 2nx5 s SER 194 Ca -0.02 -0.88 -0.05 0.00 0.48 0.00 0.00 55.95 55.47 2nx5 s SER 194 Cb -0.04 -0.23 -0.01 0.00 0.10 0.00 0.00 66.02 65.85 2nx5 s SER 194 CO -0.01 0.06 0.09 -0.55 0.98 0.00 0.00 173.24 173.81 2nx5 s SER 195 N -2.75 0.19 -0.04 7.02 0.15 -0.10 -2.30 113.70 115.88 2nx5 s SER 195 Ca 0.20 -0.54 0.05 0.00 0.70 0.00 0.00 55.95 56.36 2nx5 s SER 195 Cb -0.07 0.22 -0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2nx5 s SER 195 CO 0.09 -0.50 -0.20 -0.13 1.20 0.00 0.00 173.24 173.70 2nx5 s ARG 196 N -2.59 1.93 -0.21 5.44 3.00 0.15 -0.37 118.95 126.29 2nx5 s ARG 196 Ca -0.05 -0.73 0.01 0.00 0.00 0.00 0.00 55.73 54.97 2nx5 s ARG 196 Cb -0.01 -1.72 0.03 0.00 0.00 0.00 0.00 34.95 33.25 2nx5 s ARG 196 CO -0.05 0.35 -0.16 -1.17 0.00 0.00 0.00 175.30 174.28 2nx5 s LEU 197 N -0.20 2.67 -0.40 2.53 2.96 0.12 -0.62 118.68 125.74 2nx5 s LEU 197 Ca 0.01 -0.92 -0.09 0.00 -0.22 0.00 0.00 54.13 52.91 2nx5 s LEU 197 Cb -0.11 -1.52 0.07 0.00 0.50 0.00 0.00 46.19 45.13 2nx5 s LEU 197 CO 0.01 -0.07 0.23 -0.13 -1.32 0.00 0.00 176.35 175.07 2nx5 s ARG 198 N 1.23 2.63 0.28 1.98 1.81 0.52 -0.88 118.95 126.52 2nx5 s ARG 198 Ca -0.00 -1.37 0.11 0.00 -1.72 0.00 0.00 55.73 52.75 2nx5 s ARG 198 Cb -0.16 -3.73 -0.05 0.00 -0.45 0.00 0.00 34.95 30.56 2nx5 s ARG 198 CO -0.09 -0.88 -0.12 0.14 -0.68 0.00 0.00 175.30 173.66 2nx5 s VAL 199 N 1.44 2.82 0.66 3.52 -7.23 -0.74 -4.52 120.40 116.35 2nx5 s VAL 199 Ca 0.02 -2.22 -0.18 0.00 -1.81 0.00 0.00 61.98 57.79 2nx5 s VAL 199 Cb -0.22 -2.51 -0.01 0.00 0.56 0.00 0.00 36.38 34.21 2nx5 s VAL 199 CO 0.03 -0.38 1.29 -0.94 -0.31 0.00 0.00 175.10 174.79 2nx5 s SER 200 N -3.57 4.54 0.40 4.85 1.04 -1.26 -0.27 113.70 119.41 2nx5 s SER 200 Ca 0.31 2.61 0.08 0.00 0.48 0.00 0.00 55.95 59.43 2nx5 s SER 200 Cb -0.05 -2.62 0.82 0.00 0.10 0.00 0.00 66.02 64.27 2nx5 s SER 200 CO 0.17 -2.05 1.98 0.00 0.98 0.00 0.00 173.24 174.32 2nx5 h ALA 201 N 0.46 1.60 -0.13 5.32 0.00 -0.91 -2.12 119.26 123.49 2nx5 h ALA 201 Ca -0.51 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.18 2nx5 h ALA 201 Cb 1.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2nx5 h ALA 201 CO 0.53 0.31 -0.39 0.00 0.00 0.00 0.00 179.25 179.69 2nx5 h THR 202 N 0.38 1.30 -0.05 0.00 1.03 -1.91 -0.54 112.91 113.12 2nx5 h THR 202 Ca 0.09 -1.49 -0.23 0.00 -0.01 0.00 0.00 66.41 64.78 2nx5 h THR 202 Cb 0.17 1.64 0.02 0.00 -1.07 0.00 0.00 68.15 68.91 2nx5 h THR 202 CO -0.00 0.45 -0.85 0.15 -0.01 0.00 0.00 175.52 175.26 2nx5 h PHE 203 N 0.23 0.95 -0.32 0.00 3.57 -1.77 -3.27 116.94 116.34 2nx5 h PHE 203 Ca 0.02 -0.48 -0.10 0.00 3.53 0.00 0.00 57.97 60.94 2nx5 h PHE 203 Cb 0.80 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 2nx5 h PHE 203 CO 0.02 1.31 -0.19 2.35 -2.23 0.00 0.00 178.31 179.56 2nx5 h TRP 204 N 0.33 0.80 0.00 0.41 2.91 -1.44 -3.22 115.95 115.74 2nx5 h TRP 204 Ca -0.09 -0.21 0.00 0.00 1.13 0.00 0.00 58.89 59.72 2nx5 h TRP 204 Cb 1.50 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.97 2nx5 h TRP 204 CO 0.11 0.93 0.00 1.04 -1.03 0.00 0.00 178.44 179.48 2nx5 n GLN 205 N -4.33 0.35 -4.09 2.65 6.02 -0.21 -3.11 117.38 114.66 2nx5 n GLN 205 Ca -0.03 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.64 2nx5 n GLN 205 Cb 0.41 -1.17 -0.16 0.00 1.02 0.00 0.00 30.24 30.35 2nx5 n GLN 205 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2nx5 s ASN 206 N -0.70 3.58 0.00 1.08 2.47 -1.22 -4.37 114.94 115.77 2nx5 s ASN 206 Ca 0.00 -0.92 0.09 0.00 0.42 0.00 0.00 52.86 52.45 2nx5 s ASN 206 Cb 0.00 -1.47 0.47 0.00 -1.45 0.00 0.00 41.25 38.80 2nx5 s ASN 206 CO 0.00 -0.08 1.09 -0.81 -3.72 0.00 0.00 177.10 173.58 2nx5 n PRO 207 N 4.57 0.18 0.20 0.43 -0.04 -1.24 -2.12 135.00 136.97 2nx5 n PRO 207 Ca -0.18 0.14 0.12 0.00 -0.04 0.00 0.00 63.50 63.54 2nx5 n PRO 207 Cb 0.47 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.67 2nx5 n PRO 207 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nx5 h ARG 208 N 0.00 0.00 -6.31 0.54 3.08 -1.94 -3.40 114.38 106.35 2nx5 h ARG 208 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.51 2nx5 h ARG 208 Cb 0.05 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 2nx5 h ARG 208 CO 0.00 0.00 0.19 -0.80 -1.07 0.00 0.00 179.97 178.29 2nx5 s ASN 209 N -5.83 7.24 -0.33 7.04 0.01 -0.90 -5.00 114.94 117.16 2nx5 s ASN 209 Ca 0.08 1.48 0.04 0.00 -0.71 0.00 0.00 52.86 53.74 2nx5 s ASN 209 Cb 0.07 -2.49 0.09 0.00 0.41 0.00 0.00 41.25 39.34 2nx5 s ASN 209 CO 0.65 -0.03 0.03 -2.28 -1.51 0.00 0.00 177.10 173.96 2nx5 s HIS 210 N 0.14 3.68 0.07 2.20 5.65 -1.26 -2.53 115.29 123.24 2nx5 s HIS 210 Ca 0.41 -2.88 -0.20 0.00 0.25 0.00 0.00 55.06 52.64 2nx5 s HIS 210 Cb -0.21 -2.78 -0.07 0.00 -1.18 0.00 0.00 32.58 28.35 2nx5 s HIS 210 CO 0.24 -0.94 0.59 -0.06 -0.65 0.00 0.00 174.74 173.92 2nx5 s PHE 211 N 0.94 3.80 -0.07 3.88 0.08 -0.72 -1.69 117.98 124.20 2nx5 s PHE 211 Ca 0.08 1.29 -0.04 0.00 0.12 0.00 0.00 56.93 58.38 2nx5 s PHE 211 Cb -0.19 -2.53 0.03 0.00 -0.57 0.00 0.00 43.02 39.76 2nx5 s PHE 211 CO -0.07 0.55 0.17 0.50 -0.10 0.00 0.00 175.22 176.27 2nx5 s ARG 212 N -1.00 0.14 -0.21 0.44 3.52 0.14 -1.12 118.95 120.86 2nx5 s ARG 212 Ca 0.30 0.36 -0.10 0.00 -0.13 0.00 0.00 55.73 56.16 2nx5 s ARG 212 Cb -0.20 -0.10 -0.05 0.00 -1.56 0.00 0.00 34.95 33.05 2nx5 s ARG 212 CO 0.19 -0.13 0.12 0.00 -0.81 0.00 0.00 175.30 174.68 2nx5 s GLN 214 N 0.51 2.69 -0.20 0.00 0.74 0.15 -1.62 119.66 121.94 2nx5 s GLN 214 Ca 0.07 -0.71 -0.02 0.00 0.05 0.00 0.00 55.36 54.74 2nx5 s GLN 214 Cb -0.12 -2.35 -0.01 0.00 1.10 0.00 0.00 33.01 31.64 2nx5 s GLN 214 CO -0.00 -0.20 -0.08 0.08 -0.55 0.00 0.00 175.29 174.54 2nx5 s VAL 215 N 1.31 3.13 -0.35 1.34 1.01 -0.81 0.00 120.40 126.03 2nx5 s VAL 215 Ca 0.03 -0.58 -0.18 0.00 0.00 0.00 0.00 61.98 61.25 2nx5 s VAL 215 Cb -0.13 -2.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.85 2nx5 s VAL 215 CO -0.11 0.46 0.52 -1.58 0.00 0.00 0.00 175.10 174.40 2nx5 s GLN 216 N 1.23 3.61 -0.17 2.72 2.00 0.31 -1.38 119.66 127.98 2nx5 s GLN 216 Ca 0.03 -0.16 -0.09 0.00 -2.00 0.00 0.00 55.36 53.14 2nx5 s GLN 216 Cb -0.14 -3.81 -0.05 0.00 0.80 0.00 0.00 33.01 29.81 2nx5 s GLN 216 CO -0.03 -0.66 0.14 0.12 -0.50 0.00 0.00 175.29 174.36 2nx5 s PHE 217 N 2.42 3.47 -0.40 1.67 5.36 0.77 -0.88 117.98 130.39 2nx5 s PHE 217 Ca 0.19 0.40 -0.14 0.00 -0.96 0.00 0.00 56.93 56.42 2nx5 s PHE 217 Cb -0.15 -2.09 0.02 0.00 -0.34 0.00 0.00 43.02 40.46 2nx5 s PHE 217 CO 0.13 0.43 0.28 0.71 -1.46 0.00 0.00 175.22 175.31 2nx5 s TYR 218 N -0.08 3.24 0.00 10.12 2.02 -1.02 -1.35 117.35 130.28 2nx5 s TYR 218 Ca 0.10 -0.69 0.00 0.00 -0.37 0.00 0.00 57.07 56.11 2nx5 s TYR 218 Cb -0.11 -2.55 0.00 0.00 -0.40 0.00 0.00 41.96 38.90 2nx5 s TYR 218 CO 0.00 -0.61 0.00 0.41 -1.57 0.00 0.00 175.55 173.78 2nx5 n GLY 219 N 5.12 3.71 3.79 0.71 0.00 -1.26 -4.86 105.19 112.41 2nx5 n GLY 219 Ca -0.11 -1.79 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 2nx5 n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nx5 s LEU 220 N 0.00 4.03 0.98 0.99 1.43 -0.73 -4.62 118.68 120.77 2nx5 s LEU 220 Ca 0.00 1.91 -0.16 0.00 -1.03 0.00 0.00 54.13 54.85 2nx5 s LEU 220 Cb 0.00 -4.35 0.22 0.00 0.03 0.00 0.00 46.19 42.09 2nx5 s LEU 220 CO 0.00 -0.51 1.34 -0.94 0.23 0.00 0.00 176.35 176.47 2nx5 s SER 221 N -1.82 2.89 0.39 2.29 1.04 -1.26 -3.86 113.70 113.37 2nx5 s SER 221 Ca 0.61 0.14 0.10 0.00 0.48 0.00 0.00 55.95 57.27 2nx5 s SER 221 Cb -0.17 -0.11 0.79 0.00 0.10 0.00 0.00 66.02 66.63 2nx5 s SER 221 CO 0.22 -2.86 1.92 1.05 0.98 0.00 0.00 173.24 174.54 2nx5 h GLU 222 N -1.71 0.23 0.00 4.02 4.11 -2.03 -3.04 114.58 116.15 2nx5 h GLU 222 Ca -0.44 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2nx5 h GLU 222 Cb 1.22 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2nx5 h GLU 222 CO 0.33 0.37 0.00 0.09 0.07 0.00 0.00 179.01 179.87 2nx5 n ASN 223 N -4.27 0.43 -4.66 3.06 4.13 -1.26 -4.74 115.26 107.93 2nx5 n ASN 223 Ca -0.01 0.58 -0.43 0.00 1.68 0.00 0.00 54.58 56.41 2nx5 n ASN 223 Cb 0.27 -0.68 -0.02 0.00 -1.54 0.00 0.00 39.78 37.80 2nx5 n ASN 223 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2nx5 s ASP 224 N -3.79 6.86 0.05 6.41 1.01 -1.15 -4.98 116.67 121.07 2nx5 s ASP 224 Ca 0.07 1.89 -0.31 0.00 0.71 0.00 0.00 52.55 54.92 2nx5 s ASP 224 Cb 0.11 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.45 2nx5 s ASP 224 CO 0.41 -0.79 1.24 -0.70 0.21 0.00 0.00 175.17 175.53 2nx5 s GLU 225 N 3.48 4.40 -0.13 8.23 2.12 -1.26 -4.99 118.70 130.54 2nx5 s GLU 225 Ca 0.61 1.81 0.02 0.00 0.36 0.00 0.00 54.97 57.77 2nx5 s GLU 225 Cb -0.26 -3.38 0.00 0.00 0.26 0.00 0.00 34.13 30.75 2nx5 s GLU 225 CO 0.20 -0.33 -0.20 -0.46 -0.54 0.00 0.00 175.26 173.94 2nx5 s TRP 226 N 1.32 2.68 -0.23 5.30 -0.11 -1.26 -5.00 118.94 121.64 2nx5 s TRP 226 Ca 0.59 -1.10 0.02 0.00 1.22 0.00 0.00 56.10 56.84 2nx5 s TRP 226 Cb -0.30 -1.81 0.01 0.00 -1.50 0.00 0.00 33.47 29.88 2nx5 s TRP 226 CO 0.28 -0.47 0.49 0.25 -4.62 0.00 0.00 176.95 172.88 2nx5 n THR 227 N 3.84 0.00 -1.89 5.86 -2.24 -1.26 -5.08 114.28 113.51 2nx5 n THR 227 Ca -0.19 -0.49 -0.29 0.00 -2.27 0.00 0.00 64.05 60.80 2nx5 n THR 227 Cb 0.52 1.04 0.14 0.00 -2.10 0.00 0.00 70.33 69.93 2nx5 n THR 227 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2nx5 s GLN 228 N -0.31 1.26 -0.03 -0.78 -1.52 -1.26 -5.03 119.66 111.98 2nx5 s GLN 228 Ca 0.02 -0.13 -0.08 0.00 -1.95 0.00 0.00 55.36 53.23 2nx5 s GLN 228 Cb 0.02 -1.89 -0.04 0.00 -0.22 0.00 0.00 33.01 30.87 2nx5 s GLN 228 CO 0.03 -2.04 0.42 0.22 -0.25 0.00 0.00 175.29 173.68 2nx5 h ASP 229 N -1.37 -0.23 -3.87 5.90 1.82 -2.03 -3.47 116.42 113.16 2nx5 h ASP 229 Ca -0.45 0.01 -0.53 0.00 -0.39 0.00 0.00 57.03 55.66 2nx5 h ASP 229 Cb 1.29 0.06 0.20 0.00 0.68 0.00 0.00 39.33 41.56 2nx5 h ASP 229 CO 0.52 0.06 -0.07 -2.11 -1.61 0.00 0.00 179.24 176.03 2nx5 n ARG 230 N -4.01 -0.18 -1.07 0.28 1.85 -1.26 -4.94 116.66 107.33 2nx5 n ARG 230 Ca -0.03 0.01 -0.34 0.00 -1.00 0.00 0.00 57.85 56.48 2nx5 n ARG 230 Cb 0.11 -2.17 0.11 0.00 -1.05 0.00 0.00 32.46 29.46 2nx5 n ARG 230 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2nx5 n ALA 231 N -3.64 -1.15 -2.16 2.89 0.00 -1.26 -4.89 120.51 110.30 2nx5 n ALA 231 Ca 0.10 -0.38 -0.43 0.00 0.00 0.00 0.00 53.44 52.74 2nx5 n ALA 231 Cb 0.52 -2.01 -0.02 0.00 0.00 0.00 0.00 19.45 17.93 2nx5 n ALA 231 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2nx5 s LYS 232 N -3.58 3.84 -0.63 0.00 2.20 -1.26 -4.89 119.74 115.42 2nx5 s LYS 232 Ca 0.67 1.63 -0.21 0.00 -0.36 0.00 0.00 55.97 57.69 2nx5 s LYS 232 Cb -0.29 -4.00 -0.18 0.00 -1.51 0.00 0.00 37.83 31.85 2nx5 s LYS 232 CO 0.57 -1.24 1.86 -0.35 -0.36 0.00 0.00 175.35 175.84 2nx5 n PRO 233 N 7.56 1.27 -1.76 4.03 -0.04 -1.26 -4.90 135.00 139.90 2nx5 n PRO 233 Ca 0.18 -1.63 -0.29 0.00 -0.04 0.00 0.00 63.50 61.72 2nx5 n PRO 233 Cb 0.45 -2.78 0.14 0.00 -0.04 0.00 0.00 33.50 31.28 2nx5 n PRO 233 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2nx5 s VAL 234 N 5.18 1.97 0.18 0.52 -7.23 -1.26 -1.77 120.40 117.98 2nx5 s VAL 234 Ca 0.56 0.00 -0.31 0.00 -1.81 0.00 0.00 61.98 60.42 2nx5 s VAL 234 Cb 0.14 -2.90 -0.10 0.00 0.56 0.00 0.00 36.38 34.08 2nx5 s VAL 234 CO 0.14 0.00 1.54 -0.89 -0.31 0.00 0.00 175.10 175.58 2nx5 s THR 235 N -3.56 2.66 0.28 5.32 2.01 -1.25 -4.16 115.64 116.94 2nx5 s THR 235 Ca 0.67 0.49 -0.15 0.00 0.31 0.00 0.00 61.69 63.00 2nx5 s THR 235 Cb -0.09 -3.31 0.01 0.00 0.01 0.00 0.00 72.50 69.11 2nx5 s THR 235 CO 0.52 0.04 0.59 0.00 -0.69 0.00 0.00 174.62 175.09 2nx5 s GLN 236 N 0.88 1.72 -0.25 4.92 -2.07 -0.46 -4.90 119.66 119.50 2nx5 s GLN 236 Ca 0.68 -1.20 0.03 0.00 -1.82 0.00 0.00 55.36 53.04 2nx5 s GLN 236 Cb -0.43 0.53 0.05 0.00 -1.09 0.00 0.00 33.01 32.08 2nx5 s GLN 236 CO 0.33 -0.75 -0.12 0.42 -1.32 0.00 0.00 175.29 173.85 2nx5 s ILE 237 N -3.77 2.13 -0.26 3.63 1.01 -1.26 -0.16 121.20 122.52 2nx5 s ILE 237 Ca 0.18 -1.51 -0.12 0.00 0.00 0.00 0.00 60.65 59.20 2nx5 s ILE 237 Cb -0.03 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 2nx5 s ILE 237 CO 0.09 0.06 0.23 -0.69 0.00 0.00 0.00 174.94 174.63 2nx5 s VAL 238 N 1.14 5.29 0.31 2.92 1.01 -0.48 -4.97 120.40 125.63 2nx5 s VAL 238 Ca -0.07 0.29 0.07 0.00 0.00 0.00 0.00 61.98 62.27 2nx5 s VAL 238 Cb -0.19 -3.57 -0.06 0.00 0.00 0.00 0.00 36.38 32.56 2nx5 s VAL 238 CO -0.06 0.26 -0.06 -0.94 0.00 0.00 0.00 175.10 174.30 2nx5 s SER 239 N 1.48 3.04 -0.09 3.32 1.04 -1.26 -1.93 113.70 119.30 2nx5 s SER 239 Ca 0.10 -1.21 -0.08 0.00 0.48 0.00 0.00 55.95 55.23 2nx5 s SER 239 Cb -0.15 -0.22 0.02 0.00 0.10 0.00 0.00 66.02 65.77 2nx5 s SER 239 CO 0.09 -0.33 0.23 0.00 0.98 0.00 0.00 173.24 174.21 2nx5 s ALA 240 N -2.91 -0.58 0.13 5.32 0.00 -0.64 -4.87 121.76 118.21 2nx5 s ALA 240 Ca 0.31 0.64 0.04 0.00 0.00 0.00 0.00 51.96 52.96 2nx5 s ALA 240 Cb 0.04 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 2nx5 s ALA 240 CO 0.14 -0.11 -0.10 -1.83 0.00 0.00 0.00 175.76 173.85 2nx5 s GLU 241 N 0.08 1.00 0.06 0.00 -1.05 -1.26 -0.41 118.70 117.11 2nx5 s GLU 241 Ca -0.00 -1.37 -0.04 0.00 -0.15 0.00 0.00 54.97 53.41 2nx5 s GLU 241 Cb -0.02 -0.59 -0.02 0.00 -0.44 0.00 0.00 34.13 33.05 2nx5 s GLU 241 CO 0.00 0.08 0.05 0.00 0.95 0.00 0.00 175.26 176.34 2nx5 s ALA 242 N -3.09 0.20 0.06 -0.84 0.00 -0.28 -4.88 121.76 112.93 2nx5 s ALA 242 Ca 0.14 -0.91 0.07 0.00 0.00 0.00 0.00 51.96 51.25 2nx5 s ALA 242 Cb 0.01 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 2nx5 s ALA 242 CO 0.00 -0.38 -0.19 -1.58 0.00 0.00 0.00 175.76 173.61 2nx5 s TRP 243 N -3.52 1.62 0.51 0.00 0.52 -1.26 -1.75 118.94 115.05 2nx5 s TRP 243 Ca 0.03 -0.38 -0.21 0.00 0.02 0.00 0.00 56.10 55.55 2nx5 s TRP 243 Cb 0.05 -0.94 -0.07 0.00 -1.15 0.00 0.00 33.47 31.35 2nx5 s TRP 243 CO -0.09 0.10 1.04 0.41 0.02 0.00 0.00 176.95 178.43 2nx5 n GLY 244 N 1.68 -0.12 3.82 0.98 0.00 -1.05 -4.96 105.19 105.55 2nx5 n GLY 244 Ca -0.18 0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 2nx5 n GLY 244 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2nx5 s ARG 245 N -2.44 3.29 -0.05 1.61 6.06 -1.18 -3.73 118.95 122.51 2nx5 s ARG 245 Ca 0.69 -0.26 -0.25 0.00 -2.50 0.00 0.00 55.73 53.42 2nx5 s ARG 245 Cb -0.47 -3.05 -0.04 0.00 0.06 0.00 0.00 34.95 31.45 2nx5 s ARG 245 CO 0.52 0.74 0.76 0.00 -2.50 0.00 0.00 175.30 174.81 2nx5 s ALA 246 N -1.05 3.30 -2.00 6.12 0.00 -1.26 -3.85 121.76 123.02 2nx5 s ALA 246 Ca 0.17 0.22 0.25 0.00 0.00 0.00 0.00 51.96 52.60 2nx5 s ALA 246 Cb -0.12 -3.03 1.51 0.00 0.00 0.00 0.00 23.12 21.48 2nx5 s ALA 246 CO 0.06 -0.12 1.87 -3.47 0.00 0.00 0.00 175.76 174.10