#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vld s GLY 2 N 0.00 -0.09 0.75 3.03 0.00 -1.26 -4.98 107.32 104.77 1vld s GLY 2 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 44.72 44.65 1vld s GLY 2 CO 0.00 4.77 1.05 -0.54 0.00 0.00 0.00 173.10 178.38 1vld s GLU 3 N -2.07 1.77 -0.28 2.90 0.41 -1.26 -4.81 118.70 115.36 1vld s GLU 3 Ca 0.27 -0.58 -0.12 0.00 -0.41 0.00 0.00 54.97 54.13 1vld s GLU 3 Cb -0.01 -2.18 -0.05 0.00 -1.78 0.00 0.00 34.13 30.12 1vld s GLU 3 CO 0.00 -1.49 0.25 0.08 -0.49 0.00 0.00 175.26 173.62 1vld s VAL 4 N -3.30 5.26 -0.02 2.63 1.01 -1.26 -4.54 120.40 120.18 1vld s VAL 4 Ca 0.64 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.93 1vld s VAL 4 Cb -0.08 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1vld s VAL 4 CO 0.46 0.21 0.03 -0.69 0.00 0.00 0.00 175.10 175.11 1vld s VAL 5 N 1.87 4.40 -0.51 2.92 1.01 -0.96 -4.96 120.40 124.17 1vld s VAL 5 Ca 0.10 -0.47 -0.16 0.00 0.00 0.00 0.00 61.98 61.45 1vld s VAL 5 Cb -0.16 -2.96 0.10 0.00 0.00 0.00 0.00 36.38 33.36 1vld s VAL 5 CO 0.11 0.41 0.46 -0.60 0.00 0.00 0.00 175.10 175.47 1vld s ARG 6 N -1.51 2.99 0.69 2.72 3.52 -1.26 -2.15 118.95 123.95 1vld s ARG 6 Ca 0.20 -1.50 0.04 0.00 -0.13 0.00 0.00 55.73 54.33 1vld s ARG 6 Cb -0.12 -4.21 0.13 0.00 -1.56 0.00 0.00 34.95 29.19 1vld s ARG 6 CO 0.10 -1.19 0.95 -0.51 -0.81 0.00 0.00 175.30 173.84 1vld s LEU 7 N 1.69 2.96 0.04 -0.88 1.43 0.17 -4.90 118.68 119.20 1vld s LEU 7 Ca 0.04 -0.66 0.04 0.00 -1.03 0.00 0.00 54.13 52.52 1vld s LEU 7 Cb -0.27 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 1vld s LEU 7 CO 0.05 -1.77 -0.12 0.42 0.23 0.00 0.00 176.35 175.16 1vld s THR 8 N -3.00 0.92 0.00 5.49 -4.23 -1.26 -1.04 115.64 112.51 1vld s THR 8 Ca 0.66 -0.99 0.00 0.00 -1.18 0.00 0.00 61.69 60.19 1vld s THR 8 Cb -0.04 -0.86 0.00 0.00 1.34 0.00 0.00 72.50 72.93 1vld s THR 8 CO 0.43 -0.10 0.00 -3.20 -0.54 0.00 0.00 174.62 171.21 1vld n ASN 9 N 1.81 0.00 -1.84 3.99 2.85 -0.92 -1.38 115.26 119.78 1vld n ASN 9 Ca -0.19 -0.98 -0.05 0.00 -0.11 0.00 0.00 54.58 53.25 1vld n ASN 9 Cb 0.55 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.57 1vld n ASN 9 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1vld n SER 10 N -0.77 -0.87 -2.67 1.20 2.88 -1.26 -1.44 113.62 110.68 1vld n SER 10 Ca 0.00 -1.77 -0.09 0.00 -1.33 0.00 0.00 58.87 55.68 1vld n SER 10 Cb 0.00 1.50 0.02 0.00 -0.75 0.00 0.00 64.21 64.98 1vld n SER 10 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1vld n SER 11 N -1.49 -1.97 -0.03 -3.46 3.41 -1.03 -4.80 113.62 104.25 1vld n SER 11 Ca -0.02 -2.51 0.00 0.00 -0.26 0.00 0.00 58.87 56.07 1vld n SER 11 Cb 0.27 3.33 0.00 0.00 -0.26 0.00 0.00 64.21 67.55 1vld n SER 11 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1vld n THR 12 N -0.50 0.00 -0.17 6.66 -2.24 -1.26 -2.66 114.28 114.10 1vld n THR 12 Ca -0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1vld n THR 12 Cb 0.55 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1vld n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vld n GLY 13 N 0.45 -1.06 0.00 3.38 0.00 -1.26 -4.17 105.19 102.53 1vld n GLY 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1vld n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vld n GLY 14 N -0.00 3.37 3.76 -0.02 0.00 -1.09 -2.08 105.19 109.13 1vld n GLY 14 Ca 0.00 -1.88 -0.38 0.00 0.00 0.00 0.00 46.02 43.76 1vld n GLY 14 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1vld s PRO 15 N -2.70 3.52 -0.02 1.61 0.02 -1.26 -2.46 135.00 133.71 1vld s PRO 15 Ca 0.00 2.06 -0.02 0.00 0.02 0.00 0.00 61.00 63.06 1vld s PRO 15 Cb 0.00 -2.41 0.00 0.00 0.02 0.00 0.00 34.50 32.12 1vld s PRO 15 CO 0.00 -0.83 0.05 0.14 -0.33 0.00 0.00 177.00 176.03 1vld s VAL 16 N -1.38 0.01 -0.41 3.83 -7.23 -0.52 -4.43 120.40 110.27 1vld s VAL 16 Ca 0.66 -0.04 -0.20 0.00 -1.81 0.00 0.00 61.98 60.59 1vld s VAL 16 Cb -0.36 -0.09 0.02 0.00 0.56 0.00 0.00 36.38 36.51 1vld s VAL 16 CO 0.43 -0.02 0.59 -0.36 -0.31 0.00 0.00 175.10 175.43 1vld s PHE 17 N -0.05 3.11 -0.18 2.82 2.99 -0.10 -2.16 117.98 124.41 1vld s PHE 17 Ca -0.01 -0.04 -0.09 0.00 0.00 0.00 0.00 56.93 56.80 1vld s PHE 17 Cb -0.01 -3.19 -0.05 0.00 0.00 0.00 0.00 43.02 39.78 1vld s PHE 17 CO 0.00 -0.77 0.11 0.08 -0.00 0.00 0.00 175.22 174.64 1vld s VAL 18 N 2.63 5.21 -0.23 -0.44 1.01 -0.21 -1.94 120.40 126.43 1vld s VAL 18 Ca 0.20 0.12 -0.08 0.00 0.00 0.00 0.00 61.98 62.22 1vld s VAL 18 Cb -0.15 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1vld s VAL 18 CO 0.17 0.47 0.09 -0.31 0.00 0.00 0.00 175.10 175.51 1vld s TYR 19 N 0.19 3.17 0.05 5.22 1.51 -0.69 0.46 117.35 127.26 1vld s TYR 19 Ca 0.07 -0.14 0.08 0.00 -1.01 0.00 0.00 57.07 56.08 1vld s TYR 19 Cb -0.11 -2.20 -0.03 0.00 -0.11 0.00 0.00 41.96 39.51 1vld s TYR 19 CO -0.01 -0.13 -0.22 0.08 -1.11 0.00 0.00 175.55 174.16 1vld s VAL 20 N 1.16 1.82 -0.13 0.71 1.01 -0.91 0.35 120.40 124.41 1vld s VAL 20 Ca 0.05 -1.30 -0.04 0.00 0.00 0.00 0.00 61.98 60.69 1vld s VAL 20 Cb -0.14 -1.58 0.07 0.00 0.00 0.00 0.00 36.38 34.72 1vld s VAL 20 CO 0.04 0.22 0.21 -0.75 0.00 0.00 0.00 175.10 174.82 1vld s LYS 21 N -1.29 0.12 -1.25 2.72 2.20 0.87 -2.26 119.74 120.84 1vld s LYS 21 Ca 0.09 0.54 -0.01 0.00 -0.36 0.00 0.00 55.97 56.23 1vld s LYS 21 Cb -0.09 -0.43 -0.00 0.00 -1.51 0.00 0.00 37.83 35.79 1vld s LYS 21 CO 0.02 -0.39 0.82 -0.25 -0.36 0.00 0.00 175.35 175.19 1vld n ASP 22 N 5.33 -1.77 -1.17 1.43 8.00 -1.26 -2.45 116.55 124.67 1vld n ASP 22 Ca -0.05 -0.75 -0.12 0.00 0.71 0.00 0.00 54.79 54.58 1vld n ASP 22 Cb 0.50 -4.48 -0.02 0.00 -0.02 0.00 0.00 41.12 37.09 1vld n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vld n GLY 23 N -1.40 0.40 2.98 0.44 0.00 -1.26 -5.01 105.19 101.34 1vld n GLY 23 Ca -0.28 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.21 1vld n GLY 23 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vld s LYS 24 N -3.99 0.29 -0.15 1.61 2.20 -1.02 -4.67 119.74 114.00 1vld s LYS 24 Ca 0.00 -0.48 -0.19 0.00 -0.36 0.00 0.00 55.97 54.94 1vld s LYS 24 Cb 0.00 0.11 -0.04 0.00 -1.51 0.00 0.00 37.83 36.39 1vld s LYS 24 CO 0.00 -0.05 0.54 0.42 -0.36 0.00 0.00 175.35 175.90 1vld s ILE 25 N -1.21 5.12 -0.13 5.43 1.01 -1.26 -0.09 121.20 130.07 1vld s ILE 25 Ca -0.13 1.04 -0.12 0.00 0.00 0.00 0.00 60.65 61.44 1vld s ILE 25 Cb -0.08 -3.87 -0.26 0.00 0.01 0.00 0.00 42.46 38.27 1vld s ILE 25 CO -0.01 0.23 0.41 0.40 0.00 0.00 0.00 174.94 175.97 1vld h ILE 26 N 4.94 0.79 -2.01 2.92 2.04 -0.46 -3.48 117.51 122.25 1vld h ILE 26 Ca -0.37 -2.34 0.22 0.00 1.00 0.00 0.00 64.86 63.38 1vld h ILE 26 Cb 1.17 2.52 -0.10 0.00 -0.74 0.00 0.00 36.82 39.66 1vld h ILE 26 CO 0.75 0.75 0.61 0.00 0.00 0.00 0.00 178.15 180.26 1vld s ARG 27 N -2.51 0.87 -0.02 2.37 1.70 -1.22 -5.02 118.95 115.13 1vld s ARG 27 Ca -0.22 -0.47 0.02 0.00 -0.47 0.00 0.00 55.73 54.59 1vld s ARG 27 Cb 0.06 0.31 0.01 0.00 -0.57 0.00 0.00 34.95 34.75 1vld s ARG 27 CO 0.74 -0.40 -0.06 -1.64 -1.08 0.00 0.00 175.30 172.86 1vld s MET 28 N -2.96 0.72 0.23 3.89 -1.94 -1.26 -1.70 119.30 116.28 1vld s MET 28 Ca 0.12 -0.20 -0.03 0.00 -1.71 0.00 0.00 55.69 53.87 1vld s MET 28 Cb 0.01 -0.70 -0.03 0.00 2.01 0.00 0.00 34.83 36.11 1vld s MET 28 CO -0.01 0.06 0.23 0.95 -0.01 0.00 0.00 175.02 176.24 1vld s THR 29 N 0.29 0.00 0.81 2.05 -4.23 -0.82 -4.96 115.64 108.78 1vld s THR 29 Ca -0.04 -1.86 -0.13 0.00 -1.18 0.00 0.00 61.69 58.48 1vld s THR 29 Cb -0.08 -2.45 0.21 0.00 1.34 0.00 0.00 72.50 71.52 1vld s THR 29 CO 0.00 0.00 0.53 -2.65 -0.54 0.00 0.00 174.62 171.97 1vld n PRO 30 N -0.34 -3.27 -4.61 3.99 -0.02 -1.26 -0.92 135.00 128.56 1vld n PRO 30 Ca 0.02 -0.88 -0.33 0.00 -2.02 0.00 0.00 63.50 60.28 1vld n PRO 30 Cb 0.65 -1.05 -0.15 0.00 -0.02 0.00 0.00 33.50 32.93 1vld n PRO 30 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1vld s MET 31 N -4.26 3.24 0.03 -0.52 -1.94 -1.26 -3.94 119.30 110.64 1vld s MET 31 Ca 0.39 -0.74 -0.17 0.00 -1.71 0.00 0.00 55.69 53.45 1vld s MET 31 Cb -0.06 -2.61 -0.06 0.00 2.01 0.00 0.00 34.83 34.11 1vld s MET 31 CO 0.32 0.06 0.49 -0.51 -0.01 0.00 0.00 175.02 175.37 1vld s ASP 32 N 0.71 6.93 -0.11 3.03 1.01 -1.26 -2.00 116.67 124.98 1vld s ASP 32 Ca -0.07 1.10 -0.17 0.00 0.71 0.00 0.00 52.55 54.12 1vld s ASP 32 Cb -0.16 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.42 1vld s ASP 32 CO 0.02 0.28 0.45 -0.36 0.21 0.00 0.00 175.17 175.76 1vld s PHE 33 N -0.97 3.54 -0.91 4.23 2.99 -1.08 -5.01 117.98 120.76 1vld s PHE 33 Ca 0.26 0.88 -0.18 0.00 0.00 0.00 0.00 56.93 57.89 1vld s PHE 33 Cb -0.18 -2.50 0.14 0.00 0.00 0.00 0.00 43.02 40.48 1vld s PHE 33 CO 0.16 0.24 1.08 0.34 -0.00 0.00 0.00 175.22 177.04 1vld s ASP 34 N 0.37 6.64 0.17 1.36 -1.08 -1.26 -4.87 116.67 117.99 1vld s ASP 34 Ca 0.25 -2.10 0.04 0.00 -0.52 0.00 0.00 52.55 50.22 1vld s ASP 34 Cb -0.15 -2.38 0.24 0.00 -1.46 0.00 0.00 42.92 39.18 1vld s ASP 34 CO 0.10 -1.01 0.91 0.47 0.52 0.00 0.00 175.17 176.16 1vld n ASP 35 N 6.26 0.12 0.15 -0.34 9.92 -1.26 0.66 116.55 132.05 1vld n ASP 35 Ca 0.22 0.33 0.12 0.00 -0.53 0.00 0.00 54.79 54.93 1vld n ASP 35 Cb 0.49 -0.27 0.13 0.00 -0.64 0.00 0.00 41.12 40.83 1vld n ASP 35 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1vld h ALA 36 N 0.78 0.76 0.00 2.24 0.00 -2.01 -3.38 119.26 117.66 1vld h ALA 36 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vld h ALA 36 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1vld h ALA 36 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.58 1vld n VAL 37 N -2.74 0.02 -4.39 0.00 0.24 0.21 -5.05 118.33 106.62 1vld n VAL 37 Ca 0.03 -0.14 -0.33 0.00 -2.04 0.00 0.00 64.34 61.86 1vld n VAL 37 Cb 0.52 1.67 -0.16 0.00 -1.47 0.00 0.00 33.84 34.40 1vld n VAL 37 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1vld s ASP 38 N -0.02 3.41 0.22 -1.34 1.01 0.30 -4.96 116.67 115.29 1vld s ASP 38 Ca 0.00 -0.55 -0.29 0.00 0.71 0.00 0.00 52.55 52.41 1vld s ASP 38 Cb 0.00 -1.52 -0.16 0.00 1.01 0.00 0.00 42.92 42.25 1vld s ASP 38 CO 0.00 0.05 0.82 0.00 0.21 0.00 0.00 175.17 176.25 1vld n ALA 39 N 4.30 -1.62 -0.76 5.23 0.00 -1.26 -4.57 120.51 121.82 1vld n ALA 39 Ca -0.20 0.43 -0.31 0.00 0.00 0.00 0.00 53.44 53.36 1vld n ALA 39 Cb 0.51 -1.83 0.16 0.00 0.00 0.00 0.00 19.45 18.29 1vld n ALA 39 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1vld s PRO 40 N -1.09 1.10 0.59 0.00 0.02 -1.26 -4.94 135.00 129.42 1vld s PRO 40 Ca 0.64 1.61 -0.03 0.00 0.02 0.00 0.00 61.00 63.24 1vld s PRO 40 Cb -0.85 -1.73 0.03 0.00 0.02 0.00 0.00 34.50 31.97 1vld s PRO 40 CO 0.57 -2.59 0.86 -1.12 -0.33 0.00 0.00 177.00 174.40 1vld s SER 41 N -2.54 5.26 0.91 2.53 0.01 -1.26 -4.35 113.70 114.26 1vld s SER 41 Ca 0.68 0.32 -0.12 0.00 1.31 0.00 0.00 55.95 58.14 1vld s SER 41 Cb -0.24 -1.20 0.14 0.00 0.21 0.00 0.00 66.02 64.93 1vld s SER 41 CO 0.57 -1.21 1.10 -1.66 0.41 0.00 0.00 173.24 172.44 1vld s TRP 42 N -2.93 2.36 0.06 2.43 1.48 -1.26 -4.99 118.94 116.09 1vld s TRP 42 Ca 0.56 1.10 0.01 0.00 -1.06 0.00 0.00 56.10 56.71 1vld s TRP 42 Cb -0.10 -3.22 -0.03 0.00 -1.16 0.00 0.00 33.47 28.96 1vld s TRP 42 CO 0.42 -2.44 -0.06 0.15 -4.06 0.00 0.00 176.95 170.96 1vld s LYS 43 N -5.03 0.59 -0.07 3.25 1.02 -1.26 -4.38 119.74 113.87 1vld s LYS 43 Ca 0.64 -0.97 -0.03 0.00 0.02 0.00 0.00 55.97 55.63 1vld s LYS 43 Cb -0.17 -0.11 0.04 0.00 -0.52 0.00 0.00 37.83 37.07 1vld s LYS 43 CO 0.56 -0.01 0.11 0.42 -0.92 0.00 0.00 175.35 175.51 1vld s ILE 44 N -2.45 -0.19 -0.43 2.17 1.01 -0.47 -4.96 121.20 115.87 1vld s ILE 44 Ca -0.02 0.38 -0.16 0.00 0.00 0.00 0.00 60.65 60.84 1vld s ILE 44 Cb -0.03 -0.24 0.03 0.00 0.01 0.00 0.00 42.46 42.24 1vld s ILE 44 CO -0.03 0.15 0.39 -1.61 0.00 0.00 0.00 174.94 173.84 1vld s GLU 45 N 2.23 3.03 -0.03 2.79 8.01 -1.26 -0.83 118.70 132.64 1vld s GLU 45 Ca 0.04 -0.96 -0.03 0.00 0.01 0.00 0.00 54.97 54.03 1vld s GLU 45 Cb -0.12 -4.01 0.01 0.00 -4.31 0.00 0.00 34.13 25.70 1vld s GLU 45 CO -0.05 -0.86 0.09 0.00 0.01 0.00 0.00 175.26 174.45 1vld s ALA 46 N 1.92 -0.22 -1.46 5.21 0.00 -0.47 -4.93 121.76 121.81 1vld s ALA 46 Ca 0.08 0.26 -0.03 0.00 0.00 0.00 0.00 51.96 52.28 1vld s ALA 46 Cb -0.19 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.78 1vld s ALA 46 CO 0.11 -0.05 0.24 0.54 0.00 0.00 0.00 175.76 176.60 1vld n ARG 47 N 3.07 -1.88 -1.24 0.00 1.74 -1.26 -1.12 116.66 115.96 1vld n ARG 47 Ca -0.13 0.23 -0.08 0.00 -0.77 0.00 0.00 57.85 57.10 1vld n ARG 47 Cb 0.59 -3.92 -0.04 0.00 -1.02 0.00 0.00 32.46 28.07 1vld n ARG 47 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vld n GLY 48 N -2.28 0.97 3.09 -0.13 0.00 -1.26 -5.00 105.19 100.58 1vld n GLY 48 Ca -0.30 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 1vld n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vld s LYS 49 N -2.45 0.60 -0.15 1.61 1.02 -0.28 -5.14 119.74 114.96 1vld s LYS 49 Ca 0.00 -0.91 -0.05 0.00 0.02 0.00 0.00 55.97 55.03 1vld s LYS 49 Cb 0.00 -0.24 -0.04 0.00 -0.52 0.00 0.00 37.83 37.03 1vld s LYS 49 CO 0.00 0.03 0.02 0.99 -0.92 0.00 0.00 175.35 175.47 1vld s THR 50 N -2.01 4.45 -0.12 2.17 2.01 -1.26 -1.37 115.64 119.51 1vld s THR 50 Ca -0.04 -0.17 0.03 0.00 0.31 0.00 0.00 61.69 61.82 1vld s THR 50 Cb -0.06 -2.95 0.01 0.00 0.01 0.00 0.00 72.50 69.50 1vld s THR 50 CO -0.01 0.52 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.85 1vld s PHE 51 N -0.05 2.62 -0.00 4.92 0.40 -0.01 -4.96 117.98 120.90 1vld s PHE 51 Ca 0.04 -1.21 0.00 0.00 -0.60 0.00 0.00 56.93 55.17 1vld s PHE 51 Cb -0.13 -1.77 0.00 0.00 0.51 0.00 0.00 43.02 41.64 1vld s PHE 51 CO 0.02 -0.52 -0.01 -0.08 0.70 0.00 0.00 175.22 175.32 1vld s THR 52 N 0.59 0.07 0.80 0.64 -1.32 -1.26 -1.37 115.64 113.79 1vld s THR 52 Ca -0.13 -0.03 -0.12 0.00 -1.21 0.00 0.00 61.69 60.20 1vld s THR 52 Cb -0.17 -0.08 0.07 0.00 -1.51 0.00 0.00 72.50 70.82 1vld s THR 52 CO 0.03 0.02 1.11 -2.16 -2.21 0.00 0.00 174.62 171.41 1vld s PRO 53 N 0.01 2.09 0.25 7.08 0.04 -1.26 -5.02 135.00 138.20 1vld s PRO 53 Ca 0.00 0.51 -0.30 0.00 0.04 0.00 0.00 61.00 61.26 1vld s PRO 53 Cb -0.01 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 32.51 1vld s PRO 53 CO -0.00 -1.59 1.33 -2.14 0.04 0.00 0.00 177.00 174.64 1vld s PRO 54 N -5.25 4.36 -0.45 0.56 0.02 -1.26 -4.86 135.00 128.12 1vld s PRO 54 Ca 0.61 2.15 -0.05 0.00 0.02 0.00 0.00 61.00 63.73 1vld s PRO 54 Cb -0.14 -3.14 -0.13 0.00 0.02 0.00 0.00 34.50 31.12 1vld s PRO 54 CO 0.53 -0.25 2.46 0.54 -0.33 0.00 0.00 177.00 179.95 1vld n ARG 55 N 1.94 1.79 -3.59 5.54 5.12 -1.26 -4.72 116.66 121.47 1vld n ARG 55 Ca 0.04 -1.06 -0.08 0.00 -1.93 0.00 0.00 57.85 54.82 1vld n ARG 55 Cb 0.42 -2.12 -0.02 0.00 -1.16 0.00 0.00 32.46 29.58 1vld n ARG 55 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1vld s LYS 56 N 2.28 1.18 0.40 5.56 2.20 -1.26 -2.63 119.74 127.47 1vld s LYS 56 Ca 0.45 -0.54 0.08 0.00 -0.36 0.00 0.00 55.97 55.60 1vld s LYS 56 Cb 0.17 0.48 -0.03 0.00 -1.51 0.00 0.00 37.83 36.94 1vld s LYS 56 CO -0.02 -0.53 0.28 0.95 -0.36 0.00 0.00 175.35 175.68 1vld s THR 57 N -3.45 2.64 0.26 3.43 -4.23 -0.85 -4.98 115.64 108.46 1vld s THR 57 Ca 0.07 -1.49 0.05 0.00 -1.18 0.00 0.00 61.69 59.14 1vld s THR 57 Cb -0.02 -3.01 -0.06 0.00 1.34 0.00 0.00 72.50 70.76 1vld s THR 57 CO -0.05 -0.03 -0.04 -0.94 -0.54 0.00 0.00 174.62 173.02 1vld s SER 58 N -4.02 2.40 0.24 3.99 1.04 -1.26 -4.18 113.70 111.90 1vld s SER 58 Ca 0.44 -1.19 0.04 0.00 0.48 0.00 0.00 55.95 55.72 1vld s SER 58 Cb -0.01 -0.10 -0.05 0.00 0.10 0.00 0.00 66.02 65.96 1vld s SER 58 CO 0.26 -0.40 -0.00 0.27 0.98 0.00 0.00 173.24 174.34 1vld s ILE 59 N -3.17 1.07 0.26 -1.02 -4.36 -1.26 -4.51 121.20 108.21 1vld s ILE 59 Ca 0.29 -2.04 0.06 0.00 -0.26 0.00 0.00 60.65 58.70 1vld s ILE 59 Cb 0.04 -2.37 -0.03 0.00 1.25 0.00 0.00 42.46 41.36 1vld s ILE 59 CO 0.10 -0.31 0.34 0.00 0.24 0.00 0.00 174.94 175.32 1vld s ALA 60 N -3.40 3.91 0.15 2.27 0.00 -0.88 -4.37 121.76 119.44 1vld s ALA 60 Ca 0.29 -1.32 -0.30 0.00 0.00 0.00 0.00 51.96 50.63 1vld s ALA 60 Cb 0.06 -1.62 -0.04 0.00 0.00 0.00 0.00 23.12 21.52 1vld s ALA 60 CO 0.09 0.19 1.56 -1.35 0.00 0.00 0.00 175.76 176.25 1vld h PRO 61 N 1.19 -0.28 -0.04 0.00 0.11 -1.93 0.09 132.00 131.15 1vld h PRO 61 Ca -0.50 0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.64 1vld h PRO 61 Cb 1.24 0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 1vld h PRO 61 CO 0.59 -0.18 0.17 0.10 -0.21 0.00 0.00 178.00 178.47 1vld h TYR 62 N -0.29 0.00 0.11 0.65 -0.00 -1.90 -1.04 116.97 114.50 1vld h TYR 62 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 58.73 58.50 1vld h TYR 62 Cb 0.56 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.27 1vld h TYR 62 CO -0.75 0.00 -1.98 2.41 -0.00 0.00 0.00 178.16 177.83 1vld n THR 63 N -3.15 1.76 -0.01 -0.90 -1.04 -0.39 -2.82 114.28 107.72 1vld n THR 63 Ca -0.02 -0.67 0.22 0.00 -2.04 0.00 0.00 64.05 61.54 1vld n THR 63 Cb 0.24 -1.66 0.71 0.00 -1.82 0.00 0.00 70.33 67.81 1vld n THR 63 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vld h ALA 64 N 0.16 2.48 0.00 2.41 0.00 0.31 0.05 119.26 124.67 1vld h ALA 64 Ca -0.42 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1vld h ALA 64 Cb 2.03 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.86 1vld h ALA 64 CO 0.08 -0.74 -0.15 0.41 0.00 0.00 0.00 179.25 178.86 1vld n GLY 65 N -1.62 4.92 0.36 0.00 0.00 -1.04 -4.77 105.19 103.03 1vld n GLY 65 Ca 0.11 -1.18 0.16 0.00 0.00 0.00 0.00 46.02 45.10 1vld n GLY 65 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1vld h PHE 66 N 0.29 0.17 -0.82 1.61 3.57 -0.81 -2.00 116.94 118.94 1vld h PHE 66 Ca -0.00 0.00 0.21 0.00 3.53 0.00 0.00 57.97 61.71 1vld h PHE 66 Cb 1.01 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 39.64 1vld h PHE 66 CO 0.22 0.08 0.57 -0.22 -2.23 0.00 0.00 178.31 176.73 1vld h LYS 67 N 0.16 0.21 0.00 1.11 3.64 -1.86 0.48 116.57 120.32 1vld h LYS 67 Ca 0.23 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1vld h LYS 67 Cb 0.72 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1vld h LYS 67 CO -0.03 0.14 0.00 -1.13 -2.27 0.00 0.00 179.45 176.16 1vld n SER 68 N -4.41 0.26 -0.00 4.20 3.41 -0.75 -2.47 113.62 113.85 1vld n SER 68 Ca 0.17 0.56 -0.18 0.00 -0.26 0.00 0.00 58.87 59.16 1vld n SER 68 Cb 0.74 -0.62 -0.14 0.00 -0.26 0.00 0.00 64.21 63.94 1vld n SER 68 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1vld n MET 69 N -1.78 0.72 -0.05 4.33 2.81 0.17 -2.92 117.12 120.39 1vld n MET 69 Ca 0.03 0.27 -0.11 0.00 -1.81 0.00 0.00 57.70 56.08 1vld n MET 69 Cb 0.21 -1.73 -0.05 0.00 -0.71 0.00 0.00 33.22 30.94 1vld n MET 69 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1vld h ILE 70 N 0.05 1.17 -0.47 2.02 2.04 -1.28 -2.91 117.51 118.13 1vld h ILE 70 Ca -0.39 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1vld h ILE 70 Cb 2.03 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 39.29 1vld h ILE 70 CO 0.08 0.17 0.00 -1.22 0.00 0.00 0.00 178.15 177.18 1vld n TYR 71 N -4.83 1.17 -1.68 1.37 4.01 -1.03 -4.95 117.16 111.22 1vld n TYR 71 Ca -0.04 -0.45 -0.39 0.00 -0.16 0.00 0.00 57.90 56.85 1vld n TYR 71 Cb 0.13 -0.23 0.04 0.00 -0.31 0.00 0.00 39.34 38.98 1vld n TYR 71 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1vld n SER 72 N 0.73 1.90 -0.27 7.72 2.88 -1.10 -4.90 113.62 120.58 1vld n SER 72 Ca 0.19 0.95 0.14 0.00 -1.33 0.00 0.00 58.87 58.83 1vld n SER 72 Cb 0.73 -1.48 0.59 0.00 -0.75 0.00 0.00 64.21 63.29 1vld n SER 72 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1vld n ASP 73 N -0.57 0.92 -0.49 -3.46 5.75 -1.26 -2.98 116.55 114.46 1vld n ASP 73 Ca 0.11 -1.08 0.12 0.00 -0.01 0.00 0.00 54.79 53.94 1vld n ASP 73 Cb 0.44 0.01 0.26 0.00 -1.03 0.00 0.00 41.12 40.79 1vld n ASP 73 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1vld n LEU 74 N -0.45 1.75 -4.69 -2.12 4.77 -1.26 -4.90 117.00 110.10 1vld n LEU 74 Ca 0.17 -0.58 -0.43 0.00 -0.03 0.00 0.00 56.01 55.14 1vld n LEU 74 Cb 0.30 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1vld n LEU 74 CO 0.20 0.31 1.43 -1.14 -1.33 0.00 0.00 177.39 176.86 1vld n ARG 75 N 0.05 2.67 -1.67 3.23 3.00 -1.16 -0.24 116.66 122.53 1vld n ARG 75 Ca 0.13 0.97 -0.45 0.00 -0.00 0.00 0.00 57.85 58.50 1vld n ARG 75 Cb 0.43 -2.84 -0.04 0.00 0.00 0.00 0.00 32.46 30.01 1vld n ARG 75 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1vld n ILE 76 N 4.47 0.69 0.10 5.15 5.41 -0.81 -4.79 119.36 129.58 1vld n ILE 76 Ca 0.18 -0.12 -0.05 0.00 1.00 0.00 0.00 62.75 63.75 1vld n ILE 76 Cb 0.35 -2.12 0.05 0.00 -0.71 0.00 0.00 39.64 37.22 1vld n ILE 76 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1vld h PRO 77 N 9.98 0.10 -1.53 0.38 0.13 -1.91 -3.45 132.00 135.71 1vld h PRO 77 Ca -0.49 -0.10 0.33 0.00 -0.87 0.00 0.00 66.00 64.87 1vld h PRO 77 Cb 1.25 0.02 -0.11 0.00 0.13 0.00 0.00 31.00 32.30 1vld h PRO 77 CO 0.94 0.82 0.84 1.52 -0.23 0.00 0.00 178.00 181.89 1vld s TYR 78 N -3.35 -0.03 0.06 1.56 -0.85 -1.26 -1.04 117.35 112.43 1vld s TYR 78 Ca -0.02 -0.07 -0.36 0.00 -0.52 0.00 0.00 57.07 56.10 1vld s TYR 78 Cb 0.11 0.55 -0.15 0.00 0.38 0.00 0.00 41.96 42.85 1vld s TYR 78 CO 0.80 -0.27 1.50 -2.30 -1.52 0.00 0.00 175.55 173.76 1vld n PRO 79 N -0.55 1.53 -4.46 -3.49 -0.02 -1.26 -4.70 135.00 122.05 1vld n PRO 79 Ca -0.07 0.55 -0.25 0.00 -2.02 0.00 0.00 63.50 61.72 1vld n PRO 79 Cb 0.62 -2.26 -0.10 0.00 -0.02 0.00 0.00 33.50 31.75 1vld n PRO 79 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1vld s MET 80 N 1.23 1.85 -0.08 -0.52 -1.94 -1.09 -1.97 119.30 116.78 1vld s MET 80 Ca 0.85 -1.81 -0.08 0.00 -1.71 0.00 0.00 55.69 52.94 1vld s MET 80 Cb -0.86 -1.80 0.02 0.00 2.01 0.00 0.00 34.83 34.20 1vld s MET 80 CO 0.46 0.22 0.22 0.21 -0.01 0.00 0.00 175.02 176.13 1vld s LYS 81 N -3.60 0.26 -0.16 2.03 2.20 -0.24 -2.19 119.74 118.04 1vld s LYS 81 Ca 0.32 0.32 -0.29 0.00 -0.36 0.00 0.00 55.97 55.95 1vld s LYS 81 Cb -0.01 0.12 -0.03 0.00 -1.51 0.00 0.00 37.83 36.40 1vld s LYS 81 CO 0.17 -0.04 1.45 0.50 -0.36 0.00 0.00 175.35 177.07 1vld s ARG 82 N 0.16 4.09 0.30 4.03 3.52 -0.60 -0.96 118.95 129.49 1vld s ARG 82 Ca -0.00 1.76 0.02 0.00 -0.13 0.00 0.00 55.73 57.38 1vld s ARG 82 Cb -0.02 -3.90 0.56 0.00 -1.56 0.00 0.00 34.95 30.03 1vld s ARG 82 CO 0.00 -0.92 1.89 0.87 -0.81 0.00 0.00 175.30 176.33 1vld h LYS 83 N 9.23 0.96 0.00 5.12 1.57 -1.78 -1.22 116.57 130.46 1vld h LYS 83 Ca -0.31 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1vld h LYS 83 Cb 1.13 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1vld h LYS 83 CO 0.98 0.64 0.00 -1.13 -0.57 0.00 0.00 179.45 179.37 1vld n SER 84 N -4.52 0.00 -4.46 0.86 3.41 -1.26 -4.69 113.62 102.97 1vld n SER 84 Ca 0.15 -0.64 -0.42 0.00 -0.26 0.00 0.00 58.87 57.70 1vld n SER 84 Cb 0.26 -0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.03 1vld n SER 84 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1vld s PHE 85 N -2.14 3.24 -0.37 7.33 5.36 -0.46 -4.27 117.98 126.67 1vld s PHE 85 Ca 0.36 -0.59 -0.00 0.00 -0.96 0.00 0.00 56.93 55.74 1vld s PHE 85 Cb 0.18 -2.53 0.10 0.00 -0.34 0.00 0.00 43.02 40.43 1vld s PHE 85 CO 0.33 -0.55 0.12 0.34 -1.46 0.00 0.00 175.22 173.99 1vld s ASP 86 N 1.66 5.01 0.32 6.13 2.15 -0.49 -4.85 116.67 126.60 1vld s ASP 86 Ca 0.05 -1.97 0.07 0.00 0.43 0.00 0.00 52.55 51.13 1vld s ASP 86 Cb -0.19 -1.73 0.92 0.00 -0.30 0.00 0.00 42.92 41.62 1vld s ASP 86 CO 0.09 -0.44 1.55 -2.65 -0.17 0.00 0.00 175.17 173.55 1vld n PRO 87 N 4.47 -0.07 -1.08 4.34 -0.02 -1.26 -0.08 135.00 141.29 1vld n PRO 87 Ca -0.02 1.44 -0.17 0.00 -2.02 0.00 0.00 63.50 62.74 1vld n PRO 87 Cb 0.42 -2.37 0.19 0.00 -0.02 0.00 0.00 33.50 31.72 1vld n PRO 87 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1vld n ASN 88 N -5.40 3.38 0.00 2.55 4.13 -1.26 -4.96 115.26 113.70 1vld n ASN 88 Ca 0.27 -3.65 0.00 0.00 1.68 0.00 0.00 54.58 52.89 1vld n ASN 88 Cb 0.91 -0.77 0.00 0.00 -1.54 0.00 0.00 39.78 38.38 1vld n ASN 88 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vld n GLY 89 N -1.09 3.62 3.67 7.41 0.00 0.89 -5.10 105.19 114.58 1vld n GLY 89 Ca 0.50 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 1vld n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vld s GLU 90 N 4.97 4.18 0.14 1.61 0.41 -1.25 -4.76 118.70 124.00 1vld s GLU 90 Ca 0.00 2.24 0.22 0.00 -0.41 0.00 0.00 54.97 57.02 1vld s GLU 90 Cb 0.00 -3.93 -0.08 0.00 -1.78 0.00 0.00 34.13 28.34 1vld s GLU 90 CO 0.00 -0.83 0.90 0.54 -0.49 0.00 0.00 175.26 175.38 1vld n ARG 91 N 6.88 0.62 -3.75 1.61 1.74 -1.26 -1.40 116.66 121.10 1vld n ARG 91 Ca 0.17 0.07 -0.25 0.00 -0.77 0.00 0.00 57.85 57.07 1vld n ARG 91 Cb 0.42 -1.77 0.01 0.00 -1.02 0.00 0.00 32.46 30.10 1vld n ARG 91 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1vld n ASN 92 N -2.63 -5.10 0.27 0.55 3.02 -1.26 -4.37 115.26 105.74 1vld n ASN 92 Ca -0.02 -0.92 0.12 0.00 -0.03 0.00 0.00 54.58 53.73 1vld n ASN 92 Cb 0.60 -2.15 0.74 0.00 -0.61 0.00 0.00 39.78 38.36 1vld n ASN 92 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1vld h PRO 93 N -0.60 0.00 0.00 3.52 0.11 -1.90 -2.06 132.00 131.07 1vld h PRO 93 Ca -0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.53 1vld h PRO 93 Cb 1.36 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1vld h PRO 93 CO 0.39 0.10 0.00 0.00 -0.21 0.00 0.00 178.00 178.28 1vld n GLN 94 N -3.82 0.13 -0.13 1.05 0.00 -1.26 -3.03 117.38 110.33 1vld n GLN 94 Ca -0.02 0.15 0.09 0.00 0.00 0.00 0.00 57.00 57.23 1vld n GLN 94 Cb 0.20 -1.50 0.16 0.00 0.00 0.00 0.00 30.24 29.10 1vld n GLN 94 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1vld n LEU 95 N -1.39 3.03 -4.74 2.61 4.77 -0.77 -4.83 117.00 115.68 1vld n LEU 95 Ca 0.06 -1.45 -0.41 0.00 -0.03 0.00 0.00 56.01 54.18 1vld n LEU 95 Cb 0.18 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1vld n LEU 95 CO 0.15 0.65 1.05 -0.13 -1.33 0.00 0.00 177.39 177.78 1vld s ARG 96 N -1.32 4.33 0.00 3.23 0.52 -1.17 -1.56 118.95 122.98 1vld s ARG 96 Ca 0.30 2.16 0.00 0.00 -0.52 0.00 0.00 55.73 57.67 1vld s ARG 96 Cb 0.18 -3.17 0.00 0.00 0.52 0.00 0.00 34.95 32.48 1vld s ARG 96 CO 0.25 -0.36 0.00 0.41 0.02 0.00 0.00 175.30 175.62 1vld n GLY 97 N 2.58 2.14 0.38 -3.53 0.00 -1.19 -4.80 105.19 100.77 1vld n GLY 97 Ca 0.08 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 1vld n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vld h ALA 98 N 0.00 -0.30 -0.41 4.61 0.00 -1.58 0.49 119.26 122.07 1vld h ALA 98 Ca 0.00 0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.13 1vld h ALA 98 Cb 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1vld h ALA 98 CO 0.00 -0.80 0.36 0.78 0.00 0.00 0.00 179.25 179.59 1vld h GLY 99 N -0.25 0.00 2.00 0.00 0.00 -1.81 0.65 103.07 103.66 1vld h GLY 99 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.44 1vld h GLY 99 CO -0.64 0.00 -0.34 -2.00 0.00 0.00 0.00 176.54 173.56 1vld h LEU 100 N 0.00 0.00 -0.10 3.11 5.85 -0.30 0.78 115.31 124.64 1vld h LEU 100 Ca 0.19 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.78 1vld h LEU 100 Cb 0.92 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 1vld h LEU 100 CO -0.00 0.34 -0.63 0.28 -0.34 0.00 0.00 178.44 178.09 1vld h SER 101 N 0.00 0.00 -0.71 1.25 0.02 0.16 -3.07 113.55 111.20 1vld h SER 101 Ca -0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.71 1vld h SER 101 Cb 1.16 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.56 1vld h SER 101 CO 0.04 0.63 0.27 2.29 -1.14 0.00 0.00 176.83 178.92 1vld n LYS 102 N -3.30 3.35 -4.09 3.45 2.85 -0.81 -4.18 118.16 115.43 1vld n LYS 102 Ca 0.01 -3.08 -0.31 0.00 -1.05 0.00 0.00 58.31 53.88 1vld n LYS 102 Cb 0.77 -2.16 -0.02 0.00 -0.65 0.00 0.00 35.03 32.97 1vld n LYS 102 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1vld n GLN 103 N -0.38 -3.43 -2.87 -1.58 3.00 -1.14 -4.90 117.38 106.08 1vld n GLN 103 Ca 0.41 0.40 -0.12 0.00 -0.01 0.00 0.00 57.00 57.69 1vld n GLN 103 Cb 1.37 -4.89 0.03 0.00 0.00 0.00 0.00 30.24 26.74 1vld n GLN 103 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1vld n ASP 104 N -2.81 -1.89 -0.11 1.08 2.03 0.27 -5.01 116.55 110.11 1vld n ASP 104 Ca -0.09 -3.23 -0.07 0.00 0.52 0.00 0.00 54.79 51.92 1vld n ASP 104 Cb 0.58 1.16 -0.00 0.00 -0.72 0.00 0.00 41.12 42.13 1vld n ASP 104 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1vld h PRO 105 N 3.75 -0.20 -0.98 -0.67 0.11 -1.79 -3.01 132.00 129.20 1vld h PRO 105 Ca -0.08 0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.13 1vld h PRO 105 Cb 1.01 0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.09 1vld h PRO 105 CO 0.33 -0.14 0.63 -1.49 -0.21 0.00 0.00 178.00 177.13 1vld h TRP 106 N -0.21 1.14 0.00 0.65 4.06 -1.96 -2.40 115.95 117.22 1vld h TRP 106 Ca 0.18 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.16 1vld h TRP 106 Cb 0.50 -0.37 0.00 0.00 -1.00 0.00 0.00 29.16 28.29 1vld h TRP 106 CO -0.48 0.54 0.34 0.66 -3.56 0.00 0.00 178.44 175.94 1vld h SER 107 N 1.07 0.00 1.35 -3.49 4.64 -1.90 -0.49 113.55 114.74 1vld h SER 107 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1vld h SER 107 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1vld h SER 107 CO -0.20 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 176.20 1vld h ASP 108 N 0.00 0.00 -4.11 4.97 3.32 -1.60 -3.46 116.42 115.54 1vld h ASP 108 Ca 0.00 0.00 -0.69 0.00 0.02 0.00 0.00 57.03 56.36 1vld h ASP 108 Cb 0.69 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.00 1vld h ASP 108 CO 0.00 0.00 -0.86 -0.31 -1.72 0.00 0.00 179.24 176.35 1vld s TYR 109 N -3.32 2.37 0.33 4.55 1.51 -0.19 -2.09 117.35 120.50 1vld s TYR 109 Ca 0.06 -0.37 0.09 0.00 -1.01 0.00 0.00 57.07 55.84 1vld s TYR 109 Cb 0.09 -1.36 -0.05 0.00 -0.11 0.00 0.00 41.96 40.53 1vld s TYR 109 CO 0.56 0.22 0.07 -1.83 -1.11 0.00 0.00 175.55 173.46 1vld s GLU 110 N -1.54 2.26 0.25 -0.62 -1.05 -0.13 -4.88 118.70 113.00 1vld s GLU 110 Ca 0.13 -1.59 -0.11 0.00 -0.15 0.00 0.00 54.97 53.25 1vld s GLU 110 Cb -0.10 -2.09 -0.08 0.00 -0.44 0.00 0.00 34.13 31.42 1vld s GLU 110 CO 0.04 0.17 0.60 0.50 0.95 0.00 0.00 175.26 177.51 1vld s ARG 111 N -3.77 3.85 0.19 -4.83 3.52 -1.26 -1.08 118.95 115.57 1vld s ARG 111 Ca 0.36 0.37 -0.13 0.00 -0.13 0.00 0.00 55.73 56.20 1vld s ARG 111 Cb -0.02 -2.59 0.01 0.00 -1.56 0.00 0.00 34.95 30.78 1vld s ARG 111 CO 0.21 0.28 0.41 0.96 -0.81 0.00 0.00 175.30 176.35 1vld s ILE 112 N -1.86 0.04 0.59 4.11 -4.36 -0.83 -4.89 121.20 114.00 1vld s ILE 112 Ca 0.49 -1.11 -0.06 0.00 -0.26 0.00 0.00 60.65 59.70 1vld s ILE 112 Cb -0.11 -1.76 0.00 0.00 1.25 0.00 0.00 42.46 41.85 1vld s ILE 112 CO 0.20 -0.19 0.91 -0.94 0.24 0.00 0.00 174.94 175.16 1vld s SER 113 N -2.93 5.64 0.28 4.36 1.04 -1.26 -4.11 113.70 116.73 1vld s SER 113 Ca 0.14 0.77 -0.02 0.00 0.48 0.00 0.00 55.95 57.31 1vld s SER 113 Cb 0.01 -1.77 0.40 0.00 0.10 0.00 0.00 66.02 64.75 1vld s SER 113 CO -0.00 -1.04 1.89 -0.50 0.98 0.00 0.00 173.24 174.56 1vld h TRP 114 N -0.18 0.98 -0.64 5.02 4.06 -1.96 -0.23 115.95 123.00 1vld h TRP 114 Ca -0.45 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.47 1vld h TRP 114 Cb 1.25 -0.31 -0.03 0.00 -1.00 0.00 0.00 29.16 29.07 1vld h TRP 114 CO 0.49 0.71 0.41 0.22 -3.56 0.00 0.00 178.44 176.71 1vld h ASP 115 N 0.99 0.74 0.61 -3.49 3.58 -1.99 0.79 116.42 117.65 1vld h ASP 115 Ca 0.24 -0.03 -0.24 0.00 0.42 0.00 0.00 57.03 57.42 1vld h ASP 115 Cb 0.09 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 40.95 1vld h ASP 115 CO -0.03 0.55 -1.07 -0.08 -2.88 0.00 0.00 179.24 175.73 1vld h GLU 116 N 0.86 0.25 0.32 0.28 4.81 -1.87 -2.54 114.58 116.69 1vld h GLU 116 Ca 0.23 -0.35 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 1vld h GLU 116 Cb -0.08 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1vld h GLU 116 CO -0.05 1.11 -0.16 0.00 -0.73 0.00 0.00 179.01 179.18 1vld h ALA 117 N 0.75 -0.43 0.00 2.92 0.00 -0.77 -2.35 119.26 119.37 1vld h ALA 117 Ca -0.09 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1vld h ALA 117 Cb 1.76 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.71 1vld h ALA 117 CO 0.17 -0.65 -0.27 1.79 0.00 0.00 0.00 179.25 180.28 1vld h THR 118 N -0.62 1.04 -0.48 0.00 1.35 -0.95 -2.53 112.91 110.72 1vld h THR 118 Ca -0.04 -0.99 -0.09 0.00 -0.55 0.00 0.00 66.41 64.73 1vld h THR 118 Cb 0.44 1.56 -0.02 0.00 -1.73 0.00 0.00 68.15 68.40 1vld h THR 118 CO 0.07 0.27 -0.06 0.44 -0.25 0.00 0.00 175.52 175.99 1vld h ASP 119 N 0.00 0.83 -0.28 5.36 5.19 -1.33 -1.55 116.42 124.64 1vld h ASP 119 Ca -0.00 -0.23 -0.09 0.00 -0.62 0.00 0.00 57.03 56.09 1vld h ASP 119 Cb 0.54 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.82 1vld h ASP 119 CO 0.04 0.93 -0.16 0.40 -3.12 0.00 0.00 179.24 177.33 1vld h ILE 120 N 0.77 1.30 -0.49 0.35 2.04 -1.01 -1.92 117.51 118.55 1vld h ILE 120 Ca 0.14 -1.27 -0.08 0.00 1.00 0.00 0.00 64.86 64.65 1vld h ILE 120 Cb 0.55 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 1vld h ILE 120 CO 0.03 0.40 -0.01 0.58 0.00 0.00 0.00 178.15 179.15 1vld h VAL 121 N 0.34 1.26 -0.78 1.67 2.07 -1.42 -1.86 116.25 117.54 1vld h VAL 121 Ca 0.06 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.46 1vld h VAL 121 Cb 0.68 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.42 1vld h VAL 121 CO 0.05 0.38 0.40 0.58 0.02 0.00 0.00 177.57 178.99 1vld h VAL 122 N 0.73 1.24 -0.66 2.57 2.07 -1.28 0.22 116.25 121.14 1vld h VAL 122 Ca 0.14 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 1vld h VAL 122 Cb 0.53 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1vld h VAL 122 CO 0.03 0.28 0.33 0.00 0.02 0.00 0.00 177.57 178.23 1vld h ALA 123 N 1.21 0.85 0.23 1.67 0.00 -1.13 -0.91 119.26 121.18 1vld h ALA 123 Ca 0.27 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1vld h ALA 123 Cb 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1vld h ALA 123 CO -0.04 0.40 -0.11 0.93 0.00 0.00 0.00 179.25 180.43 1vld h GLU 124 N 0.91 -0.30 -0.61 0.00 4.39 -0.83 -1.56 114.58 116.59 1vld h GLU 124 Ca 0.23 0.02 0.12 0.00 0.34 0.00 0.00 59.36 60.07 1vld h GLU 124 Cb 0.10 0.07 -0.11 0.00 -0.10 0.00 0.00 28.75 28.70 1vld h GLU 124 CO -0.03 0.02 -0.11 0.82 -1.16 0.00 0.00 179.01 178.55 1vld h ILE 125 N -0.64 0.42 -0.07 3.13 2.04 -0.45 -0.85 117.51 121.08 1vld h ILE 125 Ca -0.03 -0.01 -0.18 0.00 1.00 0.00 0.00 64.86 65.64 1vld h ILE 125 Cb 0.46 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1vld h ILE 125 CO 0.05 0.01 -0.71 0.78 0.00 0.00 0.00 178.15 178.27 1vld h ASN 126 N 0.03 0.43 -0.73 1.72 2.35 -1.19 -2.03 115.58 116.17 1vld h ASN 126 Ca 0.30 -0.28 -0.06 0.00 -0.55 0.00 0.00 56.30 55.71 1vld h ASN 126 Cb 0.47 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 1vld h ASN 126 CO -0.60 1.01 0.23 -0.09 -1.65 0.00 0.00 177.43 176.33 1vld h ARG 127 N 0.25 1.14 -0.12 0.81 2.43 -0.59 -2.65 114.38 115.65 1vld h ARG 127 Ca -0.03 -0.25 -0.15 0.00 -0.81 0.00 0.00 59.98 58.74 1vld h ARG 127 Cb 1.28 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 30.67 1vld h ARG 127 CO 0.12 0.97 -0.53 0.82 -1.51 0.00 0.00 179.97 179.84 1vld h ILE 128 N 1.08 1.35 -0.54 1.20 2.04 -1.16 -2.89 117.51 118.60 1vld h ILE 128 Ca 0.24 -1.82 0.01 0.00 1.00 0.00 0.00 64.86 64.28 1vld h ILE 128 Cb 0.31 2.13 -0.03 0.00 -0.74 0.00 0.00 36.82 38.49 1vld h ILE 128 CO -0.01 0.55 0.36 0.11 0.00 0.00 0.00 178.15 179.17 1vld h LYS 129 N 0.20 0.71 0.00 2.37 1.57 -1.31 0.61 116.57 120.72 1vld h LYS 129 Ca -0.03 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1vld h LYS 129 Cb 1.16 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1vld h LYS 129 CO 0.11 0.47 -0.23 0.72 -0.57 0.00 0.00 179.45 179.95 1vld n HIS 130 N -4.45 0.40 -0.05 -1.35 8.25 -1.01 -1.49 115.22 115.52 1vld n HIS 130 Ca 0.05 0.12 -0.04 0.00 -0.26 0.00 0.00 57.72 57.59 1vld n HIS 130 Cb 0.05 -0.62 -0.09 0.00 1.12 0.00 0.00 29.99 30.45 1vld n HIS 130 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vld n ALA 131 N -1.66 1.80 0.00 -1.41 0.00 -0.72 -4.82 120.51 113.70 1vld n ALA 131 Ca 0.05 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1vld n ALA 131 Cb 0.39 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1vld n ALA 131 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1vld n TYR 132 N -2.36 0.00 0.00 0.00 4.01 0.21 -5.08 117.16 113.94 1vld n TYR 132 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1vld n TYR 132 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.83 1vld n TYR 132 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vld n GLY 133 N 0.57 0.38 0.38 2.72 0.00 -0.56 -4.49 105.19 104.19 1vld n GLY 133 Ca 0.00 -1.81 0.19 0.00 0.00 0.00 0.00 46.02 44.40 1vld n GLY 133 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1vld h PRO 134 N 0.00 0.12 0.00 1.61 0.11 -1.86 -1.88 132.00 130.09 1vld h PRO 134 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1vld h PRO 134 Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 1vld h PRO 134 CO 0.00 0.08 0.00 -1.13 -0.21 0.00 0.00 178.00 176.74 1vld n SER 135 N -4.41 0.38 0.12 -2.05 3.41 -1.26 -1.74 113.62 108.07 1vld n SER 135 Ca 0.11 0.62 0.13 0.00 -0.26 0.00 0.00 58.87 59.47 1vld n SER 135 Cb 0.57 -0.69 0.43 0.00 -0.26 0.00 0.00 64.21 64.26 1vld n SER 135 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vld h ALA 136 N 2.23 1.00 -1.96 7.33 0.00 -1.55 -3.38 119.26 122.92 1vld h ALA 136 Ca 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.20 1vld h ALA 136 Cb 0.21 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 17.80 1vld h ALA 136 CO 0.00 0.00 0.17 0.42 0.00 0.00 0.00 179.25 179.84 1vld s ILE 137 N -3.17 4.85 0.25 0.00 1.01 -0.71 -0.65 121.20 122.78 1vld s ILE 137 Ca 0.09 -1.12 -0.27 0.00 0.00 0.00 0.00 60.65 59.35 1vld s ILE 137 Cb 0.11 -4.51 -0.09 0.00 0.01 0.00 0.00 42.46 37.98 1vld s ILE 137 CO 0.55 -1.16 0.88 -0.22 0.00 0.00 0.00 174.94 174.99 1vld s LEU 138 N 2.55 4.51 0.02 2.97 2.96 0.39 -1.21 118.68 130.86 1vld s LEU 138 Ca 0.13 1.79 -0.23 0.00 -0.22 0.00 0.00 54.13 55.60 1vld s LEU 138 Cb -0.22 -3.66 0.05 0.00 0.50 0.00 0.00 46.19 42.86 1vld s LEU 138 CO 0.04 0.09 0.52 -0.55 -1.32 0.00 0.00 176.35 175.13 1vld s SER 139 N -1.35 -0.45 -0.30 3.68 0.15 -0.89 -0.16 113.70 114.39 1vld s SER 139 Ca 0.43 0.28 -0.19 0.00 0.70 0.00 0.00 55.95 57.17 1vld s SER 139 Cb -0.22 0.47 0.19 0.00 -1.71 0.00 0.00 66.02 64.75 1vld s SER 139 CO 0.27 -0.65 1.25 0.28 1.20 0.00 0.00 173.24 175.59 1vld s THR 140 N -1.99 0.00 0.00 6.45 -1.32 -1.11 -2.65 115.64 115.02 1vld s THR 140 Ca -0.08 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 1vld s THR 140 Cb -0.01 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 1vld s THR 140 CO 0.02 0.00 0.00 -0.81 -2.21 0.00 0.00 174.62 171.62 1vld n PRO 141 N 2.71 1.48 -4.08 7.08 -0.04 -1.26 -2.60 135.00 138.29 1vld n PRO 141 Ca -0.15 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.18 1vld n PRO 141 Cb 0.57 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.97 1vld n PRO 141 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1vld s SER 142 N -1.00 0.61 0.23 3.54 0.01 -1.26 -4.78 113.70 111.05 1vld s SER 142 Ca 0.00 -1.35 -0.06 0.00 1.31 0.00 0.00 55.95 55.85 1vld s SER 142 Cb 0.00 0.61 0.37 0.00 0.21 0.00 0.00 66.02 67.21 1vld s SER 142 CO 0.00 -1.20 1.77 0.28 0.41 0.00 0.00 173.24 174.50 1vld h SER 143 N 2.20 0.45 -1.93 2.44 0.02 -2.00 -3.44 113.55 111.30 1vld h SER 143 Ca -0.29 0.07 -0.55 0.00 -0.84 0.00 0.00 61.79 60.18 1vld h SER 143 Cb 1.24 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 63.69 1vld h SER 143 CO 0.40 0.24 -0.57 -1.00 -1.14 0.00 0.00 176.83 174.76 1vld s HIS 144 N -6.05 2.68 0.12 3.45 3.76 -1.26 -5.11 115.29 112.88 1vld s HIS 144 Ca -0.13 -0.37 -0.14 0.00 -0.15 0.00 0.00 55.06 54.27 1vld s HIS 144 Cb 0.19 -1.56 0.02 0.00 1.11 0.00 0.00 32.58 32.34 1vld s HIS 144 CO 0.76 0.40 0.35 -1.58 -0.85 0.00 0.00 174.74 173.83 1vld s HIS 145 N -2.43 -0.08 0.36 1.40 2.46 -1.26 -5.06 115.29 110.68 1vld s HIS 145 Ca 0.36 -0.27 -0.27 0.00 0.47 0.00 0.00 55.06 55.35 1vld s HIS 145 Cb -0.02 0.18 -0.12 0.00 -0.13 0.00 0.00 32.58 32.49 1vld s HIS 145 CO 0.22 -0.68 1.29 -1.33 -2.47 0.00 0.00 174.74 171.76 1vld n MET 146 N -0.19 2.09 -1.68 2.88 2.81 -1.26 -4.84 117.12 116.93 1vld n MET 146 Ca -0.15 0.74 -0.37 0.00 -1.81 0.00 0.00 57.70 56.11 1vld n MET 146 Cb 0.63 -2.35 0.07 0.00 -0.71 0.00 0.00 33.22 30.86 1vld n MET 146 CO 0.00 0.00 0.00 -0.46 1.51 0.00 0.00 175.97 177.02 1vld s TRP 147 N -1.12 2.04 0.00 2.03 -0.00 -1.26 -4.73 118.94 115.90 1vld s TRP 147 Ca 0.57 1.50 0.00 0.00 -0.00 0.00 0.00 56.10 58.16 1vld s TRP 147 Cb -0.55 -3.69 0.00 0.00 -0.00 0.00 0.00 33.47 29.23 1vld s TRP 147 CO 0.61 -2.95 0.00 0.41 -0.00 0.00 0.00 176.95 175.02 1vld n GLY 148 N 0.88 2.84 0.26 5.86 0.00 -1.26 -4.72 105.19 109.05 1vld n GLY 148 Ca 0.16 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 1vld n GLY 148 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1vld h ASN 149 N 0.00 -0.61 -0.66 1.61 4.21 -1.68 0.23 115.58 118.67 1vld h ASN 149 Ca 0.00 0.07 -0.06 0.00 1.21 0.00 0.00 56.30 57.52 1vld h ASN 149 Cb 0.00 0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 37.39 1vld h ASN 149 CO 0.00 -0.32 0.19 0.58 -1.29 0.00 0.00 177.43 176.59 1vld h VAL 150 N -0.44 1.25 0.00 2.81 2.07 -1.95 -2.74 116.25 117.24 1vld h VAL 150 Ca 0.01 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1vld h VAL 150 Cb 0.44 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1vld h VAL 150 CO -0.09 0.35 -0.12 0.61 0.02 0.00 0.00 177.57 178.34 1vld n GLY 151 N -0.76 -1.51 3.61 2.17 0.00 -1.13 -3.32 105.19 104.24 1vld n GLY 151 Ca 0.05 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1vld n GLY 151 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1vld n TYR 152 N -1.74 0.50 0.23 1.61 9.36 0.78 -4.52 117.16 123.38 1vld n TYR 152 Ca 0.06 0.38 0.16 0.00 3.32 0.00 0.00 57.90 61.82 1vld n TYR 152 Cb 0.37 -2.04 0.84 0.00 -0.63 0.00 0.00 39.34 37.88 1vld n TYR 152 CO 0.00 0.00 0.00 0.07 0.22 0.00 0.00 176.86 177.15 1vld h ARG 153 N -0.66 0.00 0.00 2.98 0.11 -1.89 -0.44 114.38 114.47 1vld h ARG 153 Ca -0.46 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.51 1vld h ARG 153 Cb 1.32 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.38 1vld h ARG 153 CO 0.45 0.00 -0.50 0.45 0.10 0.00 0.00 179.97 180.47 1vld h HIS 154 N 0.00 0.00 0.00 4.08 3.86 -1.90 -2.97 115.15 118.22 1vld h HIS 154 Ca 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1vld h HIS 154 Cb 0.35 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.82 1vld h HIS 154 CO 0.00 0.50 0.00 0.45 0.86 0.00 0.00 177.93 179.74 1vld n SER 155 N -3.61 0.00 -0.02 2.45 2.88 -0.22 -4.43 113.62 110.67 1vld n SER 155 Ca -0.00 0.02 -0.12 0.00 -1.33 0.00 0.00 58.87 57.44 1vld n SER 155 Cb 0.58 -0.05 -0.07 0.00 -0.75 0.00 0.00 64.21 63.92 1vld n SER 155 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1vld h THR 156 N 0.00 1.22 0.12 2.46 2.02 -1.44 -1.72 112.91 115.58 1vld h THR 156 Ca 0.00 -0.68 0.01 0.00 0.77 0.00 0.00 66.41 66.51 1vld h THR 156 Cb 0.00 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 1vld h THR 156 CO 0.00 0.19 -0.22 0.22 0.37 0.00 0.00 175.52 176.08 1vld h TYR 157 N -0.13 -0.57 -0.24 3.16 3.20 -1.71 -2.17 116.97 118.51 1vld h TYR 157 Ca 0.02 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1vld h TYR 157 Cb 0.29 0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 1vld h TYR 157 CO 0.02 -0.31 0.11 0.74 -1.64 0.00 0.00 178.16 177.08 1vld h PHE 158 N -0.41 0.35 -0.96 -3.82 0.05 -1.59 0.74 116.94 111.30 1vld h PHE 158 Ca 0.02 -0.02 0.17 0.00 3.82 0.00 0.00 57.97 61.96 1vld h PHE 158 Cb 0.43 -0.11 -0.09 0.00 2.00 0.00 0.00 35.95 38.18 1vld h PHE 158 CO -0.20 0.34 0.61 -0.09 -0.18 0.00 0.00 178.31 178.79 1vld h ARG 159 N 0.26 0.70 0.02 1.51 2.43 -1.16 0.17 114.38 118.30 1vld h ARG 159 Ca 0.08 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.14 1vld h ARG 159 Cb 0.13 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1vld h ARG 159 CO -0.01 0.46 -0.36 0.35 -1.51 0.00 0.00 179.97 178.90 1vld h PHE 160 N 0.72 0.08 -0.07 2.20 3.57 -1.11 -3.34 116.94 118.98 1vld h PHE 160 Ca 0.51 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.92 1vld h PHE 160 Cb 0.84 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 1vld h PHE 160 CO -0.00 1.14 -0.10 0.52 -2.23 0.00 0.00 178.31 177.63 1vld h MET 161 N -0.90 0.10 0.00 1.11 2.86 -0.64 -2.06 114.93 115.40 1vld h MET 161 Ca -0.09 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 1vld h MET 161 Cb 1.16 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.79 1vld h MET 161 CO -0.02 0.21 -0.18 -0.91 1.06 0.00 0.00 176.91 177.08 1vld h ASN 162 N 0.10 0.00 0.19 1.22 -0.26 -1.11 -0.74 115.58 114.97 1vld h ASN 162 Ca 0.02 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1vld h ASN 162 Cb 0.25 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.51 1vld h ASN 162 CO 0.02 0.18 -0.47 0.23 -1.06 0.00 0.00 177.43 176.33 1vld n MET 163 N -4.15 0.66 -0.09 0.81 2.81 -0.81 -4.57 117.12 111.78 1vld n MET 163 Ca -0.02 -0.46 -0.18 0.00 -1.81 0.00 0.00 57.70 55.23 1vld n MET 163 Cb 0.25 -1.49 -0.06 0.00 -0.71 0.00 0.00 33.22 31.21 1vld n MET 163 CO 0.00 0.00 0.00 -0.12 1.51 0.00 0.00 175.97 177.36 1vld n MET 164 N -0.77 0.42 0.00 0.03 0.00 -0.78 -5.10 117.12 110.93 1vld n MET 164 Ca 0.09 0.18 0.00 0.00 -0.00 0.00 0.00 57.70 57.97 1vld n MET 164 Cb 0.37 -1.22 0.00 0.00 0.00 0.00 0.00 33.22 32.38 1vld n MET 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1vld n GLY 165 N 1.80 3.27 0.00 -5.12 0.00 -0.36 -4.92 105.19 99.86 1vld n GLY 165 Ca -0.32 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1vld n GLY 165 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1vld n PHE 166 N 0.00 0.00 -3.21 1.61 1.16 -1.25 -4.81 117.46 110.95 1vld n PHE 166 Ca 0.00 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.17 1vld n PHE 166 Cb 0.00 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 37.79 1vld n PHE 166 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 1vld s THR 167 N -2.00 4.99 0.19 1.97 2.01 -0.35 -4.37 115.64 118.08 1vld s THR 167 Ca 0.00 0.40 -0.21 0.00 0.31 0.00 0.00 61.69 62.19 1vld s THR 167 Cb 0.00 -3.99 -0.08 0.00 0.01 0.00 0.00 72.50 68.44 1vld s THR 167 CO 0.00 -0.24 0.72 -0.47 -0.69 0.00 0.00 174.62 173.94 1vld s TYR 168 N 2.46 3.72 -1.06 4.92 5.04 -1.25 -2.08 117.35 129.09 1vld s TYR 168 Ca 0.20 1.43 -0.08 0.00 -2.44 0.00 0.00 57.07 56.17 1vld s TYR 168 Cb -0.15 -2.63 0.27 0.00 0.35 0.00 0.00 41.96 39.79 1vld s TYR 168 CO 0.14 0.40 1.04 0.00 -1.34 0.00 0.00 175.55 175.79 1vld s ALA 169 N -1.40 4.63 0.77 3.97 0.00 -1.09 -1.26 121.76 127.39 1vld s ALA 169 Ca 0.40 -3.82 -0.15 0.00 0.00 0.00 0.00 51.96 48.39 1vld s ALA 169 Cb -0.18 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.51 1vld s ALA 169 CO 0.22 -2.20 0.74 -3.47 0.00 0.00 0.00 175.76 171.06 1vld n ASP 170 N 2.69 -0.51 -4.84 0.00 -0.08 -0.65 -4.39 116.55 108.77 1vld n ASP 170 Ca 0.23 0.57 -0.37 0.00 -1.51 0.00 0.00 54.79 53.71 1vld n ASP 170 Cb 0.39 -1.32 -0.06 0.00 2.34 0.00 0.00 41.12 42.48 1vld n ASP 170 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 1vld s HIS 171 N -2.00 3.68 0.43 -0.67 3.76 -1.26 -1.45 115.29 117.77 1vld s HIS 171 Ca 0.67 0.95 -0.23 0.00 -0.15 0.00 0.00 55.06 56.30 1vld s HIS 171 Cb -0.32 -2.26 -0.08 0.00 1.11 0.00 0.00 32.58 31.03 1vld s HIS 171 CO 0.56 0.59 1.08 0.54 -0.85 0.00 0.00 174.74 176.66 1vld s ASN 172 N -1.32 6.54 -1.01 1.40 4.22 -1.26 -3.49 114.94 120.02 1vld s ASN 172 Ca 0.28 2.09 -0.11 0.00 -2.14 0.00 0.00 52.86 52.97 1vld s ASN 172 Cb -0.16 -2.59 -0.08 0.00 1.28 0.00 0.00 41.25 39.71 1vld s ASN 172 CO 0.15 -0.64 2.17 -0.81 -2.04 0.00 0.00 177.10 175.93 1vld n PRO 173 N -0.31 2.19 -0.37 3.55 -0.04 -1.26 -4.73 135.00 134.03 1vld n PRO 173 Ca 0.06 -1.75 -0.06 0.00 -0.04 0.00 0.00 63.50 61.71 1vld n PRO 173 Cb 0.50 -2.69 -0.04 0.00 -0.04 0.00 0.00 33.50 31.23 1vld n PRO 173 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1vld n ASP 174 N 5.16 -0.82 0.26 3.54 5.68 -1.26 0.55 116.55 129.66 1vld n ASP 174 Ca 0.51 1.62 0.09 0.00 -0.50 0.00 0.00 54.79 56.51 1vld n ASP 174 Cb 0.24 -0.27 0.68 0.00 -1.14 0.00 0.00 41.12 40.62 1vld n ASP 174 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1vld h SER 175 N 0.00 0.00 0.00 -1.12 0.02 -1.98 -3.21 113.55 107.25 1vld h SER 175 Ca 0.21 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.92 1vld h SER 175 Cb 0.44 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.94 1vld h SER 175 CO -0.88 0.06 -2.16 0.79 -1.14 0.00 0.00 176.83 173.50 1vld n TRP 176 N -4.23 0.00 0.00 3.45 8.01 -0.18 -4.40 117.44 120.09 1vld n TRP 176 Ca -0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.16 1vld n TRP 176 Cb 0.14 -0.79 0.00 0.00 -2.01 0.00 0.00 31.31 28.66 1vld n TRP 176 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 1vld n GLU 177 N -2.55 0.00 -0.25 -0.99 -0.58 0.19 0.12 120.64 116.59 1vld n GLU 177 Ca -0.23 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.47 1vld n GLU 177 Cb 0.95 0.00 0.07 0.00 -0.57 0.00 0.00 31.44 31.88 1vld n GLU 177 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1vld h GLY 178 N 0.00 0.99 2.00 0.62 0.00 -1.06 0.40 103.07 106.02 1vld h GLY 178 Ca 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 1vld h GLY 178 CO 0.00 0.31 -0.19 1.49 0.00 0.00 0.00 176.54 178.15 1vld h TRP 179 N 0.89 0.00 0.00 5.60 4.06 0.70 -0.81 115.95 126.39 1vld h TRP 179 Ca 0.27 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.22 1vld h TRP 179 Cb -0.04 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.12 1vld h TRP 179 CO -0.03 0.19 -0.08 1.25 -3.56 0.00 0.00 178.44 176.21 1vld h HIS 180 N 0.00 0.00 -0.00 0.49 2.76 -1.01 -0.25 115.15 117.14 1vld h HIS 180 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1vld h HIS 180 Cb 0.84 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.80 1vld h HIS 180 CO 0.00 0.01 -0.04 0.91 -1.30 0.00 0.00 177.93 177.51 1vld n TRP 181 N -4.75 0.00 0.00 5.26 7.02 0.06 -4.18 117.44 120.85 1vld n TRP 181 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 1vld n TRP 181 Cb 0.05 -0.17 0.00 0.00 -2.42 0.00 0.00 31.31 28.77 1vld n TRP 181 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1vld n GLY 182 N 1.21 0.03 0.43 6.99 0.00 -0.41 -4.89 105.19 108.55 1vld n GLY 182 Ca 0.17 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.43 1vld n GLY 182 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vld h GLY 183 N 0.00 0.32 0.56 -0.02 0.00 -1.25 -1.98 103.07 100.70 1vld h GLY 183 Ca 0.00 -0.07 0.11 0.00 0.00 0.00 0.00 47.33 47.38 1vld h GLY 183 CO 0.00 -0.01 0.61 1.98 0.00 0.00 0.00 176.54 179.13 1vld h MET 184 N 0.14 0.92 0.00 4.80 -1.53 -1.20 0.13 114.93 118.20 1vld h MET 184 Ca 0.43 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.63 1vld h MET 184 Cb 1.45 -0.21 0.00 0.00 -0.55 0.00 0.00 31.60 32.29 1vld h MET 184 CO -0.07 0.61 0.00 0.72 0.14 0.00 0.00 176.91 178.31 1vld n HIS 185 N -4.58 0.45 -0.04 1.39 8.25 -0.74 0.41 115.22 120.36 1vld n HIS 185 Ca 0.18 0.16 -0.16 0.00 -0.26 0.00 0.00 57.72 57.63 1vld n HIS 185 Cb 0.35 -0.75 -0.14 0.00 1.12 0.00 0.00 29.99 30.57 1vld n HIS 185 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1vld n MET 186 N -1.89 0.70 -0.24 -0.41 0.00 0.42 -4.60 117.12 111.10 1vld n MET 186 Ca 0.04 0.22 0.00 0.00 0.00 0.00 0.00 57.70 57.96 1vld n MET 186 Cb 0.28 -1.68 0.00 0.00 0.00 0.00 0.00 33.22 31.82 1vld n MET 186 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 175.97 173.30 1vld n TRP 187 N -3.23 0.00 0.00 1.12 4.27 -0.90 -0.31 117.44 118.39 1vld n TRP 187 Ca -0.30 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.31 1vld n TRP 187 Cb 1.05 0.01 0.00 0.00 -1.36 0.00 0.00 31.31 31.02 1vld n TRP 187 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1vld n GLY 188 N 0.00 2.66 3.07 -1.67 0.00 0.17 -4.39 105.19 105.02 1vld n GLY 188 Ca 0.00 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 1vld n GLY 188 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vld n PHE 189 N 12.78 -1.99 -0.12 1.61 3.01 -1.26 -4.34 117.46 127.14 1vld n PHE 189 Ca 0.00 0.54 0.15 0.00 1.01 0.00 0.00 57.45 59.15 1vld n PHE 189 Cb 0.00 -4.40 0.54 0.00 -0.01 0.00 0.00 39.48 35.60 1vld n PHE 189 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1vld h SER 190 N -1.41 0.31 0.40 4.37 4.64 -1.89 -0.04 113.55 119.93 1vld h SER 190 Ca -0.53 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1vld h SER 190 Cb 1.36 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1vld h SER 190 CO 0.57 0.17 0.00 -2.67 -0.87 0.00 0.00 176.83 174.03 1vld n TRP 191 N -4.46 0.00 -0.81 4.77 2.14 -1.20 -1.10 117.44 116.78 1vld n TRP 191 Ca 0.12 0.00 0.07 0.00 2.07 0.00 0.00 57.50 59.76 1vld n TRP 191 Cb 0.51 -0.30 0.10 0.00 -0.81 0.00 0.00 31.31 30.80 1vld n TRP 191 CO 0.00 0.00 0.00 0.54 2.07 0.00 0.00 177.69 180.30 1vld n ARG 192 N -1.30 1.68 -2.12 -2.67 1.74 -0.16 -4.34 116.66 109.49 1vld n ARG 192 Ca 0.09 -2.20 -0.12 0.00 -0.77 0.00 0.00 57.85 54.85 1vld n ARG 192 Cb 0.17 -1.31 -0.02 0.00 -1.02 0.00 0.00 32.46 30.27 1vld n ARG 192 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1vld n LEU 193 N -1.11 -1.05 0.00 0.55 4.77 -0.26 -1.71 117.00 118.19 1vld n LEU 193 Ca 0.11 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 1vld n LEU 193 Cb 0.53 -2.05 0.00 0.00 -2.33 0.00 0.00 43.42 39.58 1vld n LEU 193 CO 0.01 -0.28 0.00 0.61 -1.33 0.00 0.00 177.39 176.40 1vld n GLY 194 N -0.63 2.20 3.80 -0.72 0.00 -0.40 -3.00 105.19 106.44 1vld n GLY 194 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1vld n GLY 194 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vld s ASN 195 N -1.11 4.96 0.59 1.61 0.01 -0.69 -4.74 114.94 115.57 1vld s ASN 195 Ca 0.00 1.68 -0.04 0.00 -0.71 0.00 0.00 52.86 53.79 1vld s ASN 195 Cb 0.00 -2.48 0.03 0.00 0.41 0.00 0.00 41.25 39.21 1vld s ASN 195 CO 0.00 -1.72 0.87 -2.16 -1.51 0.00 0.00 177.10 172.58 1vld s PRO 196 N -4.99 2.65 0.72 -0.60 0.04 -1.26 -4.72 135.00 126.84 1vld s PRO 196 Ca 0.59 -0.32 -0.12 0.00 0.04 0.00 0.00 61.00 61.19 1vld s PRO 196 Cb -0.15 -2.33 0.03 0.00 0.04 0.00 0.00 34.50 32.08 1vld s PRO 196 CO 0.55 -0.79 1.09 -2.00 0.04 0.00 0.00 177.00 175.90 1vld s GLU 197 N -4.95 2.55 0.00 4.56 2.12 -1.26 -4.95 118.70 116.78 1vld s GLU 197 Ca 0.55 1.22 0.00 0.00 0.36 0.00 0.00 54.97 57.11 1vld s GLU 197 Cb -0.10 -1.93 0.00 0.00 0.26 0.00 0.00 34.13 32.36 1vld s GLU 197 CO 0.42 -1.42 0.05 1.04 -0.54 0.00 0.00 175.26 174.81 1vld n GLN 198 N -3.05 0.00 -1.47 4.30 1.13 -1.26 -4.86 117.38 112.16 1vld n GLN 198 Ca 0.09 -0.05 -0.43 0.00 -1.94 0.00 0.00 57.00 54.68 1vld n GLN 198 Cb 0.53 -0.45 0.00 0.00 0.11 0.00 0.00 30.24 30.43 1vld n GLN 198 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1vld n TYR 199 N 0.00 -0.20 -2.62 1.08 4.02 -1.26 -3.07 117.16 115.12 1vld n TYR 199 Ca 0.00 0.65 -0.07 0.00 -0.01 0.00 0.00 57.90 58.47 1vld n TYR 199 Cb 0.28 -2.03 -0.01 0.00 -0.02 0.00 0.00 39.34 37.56 1vld n TYR 199 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1vld n ASP 200 N 1.32 -2.08 0.13 7.72 10.43 -1.25 -1.98 116.55 130.83 1vld n ASP 200 Ca 0.12 0.28 0.02 0.00 2.57 0.00 0.00 54.79 57.78 1vld n ASP 200 Cb 0.37 -1.86 0.01 0.00 1.84 0.00 0.00 41.12 41.49 1vld n ASP 200 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 1vld h LEU 201 N -0.09 0.00 0.04 0.64 3.38 -1.47 -3.33 115.31 114.48 1vld h LEU 201 Ca -0.14 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1vld h LEU 201 Cb 1.10 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 1vld h LEU 201 CO 0.17 0.49 -0.15 0.25 0.09 0.00 0.00 178.44 179.30 1vld h LEU 202 N 0.00 -0.41 -1.55 1.67 5.85 -1.59 -0.69 115.31 118.59 1vld h LEU 202 Ca -0.02 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 1vld h LEU 202 Cb 1.40 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 1vld h LEU 202 CO 0.06 -0.21 -0.24 -0.08 -0.34 0.00 0.00 178.44 177.64 1vld h GLU 203 N -0.26 0.00 -0.04 1.25 4.81 -1.78 -1.46 114.58 117.10 1vld h GLU 203 Ca 0.04 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1vld h GLU 203 Cb 0.30 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1vld h GLU 203 CO -0.11 0.24 -0.01 0.22 -0.73 0.00 0.00 179.01 178.61 1vld h ASP 204 N 0.00 0.07 -0.17 1.04 -0.00 -1.51 -2.61 116.42 113.23 1vld h ASP 204 Ca -0.00 -0.37 -0.00 0.00 -0.00 0.00 0.00 57.03 56.65 1vld h ASP 204 Cb 0.45 -0.02 -0.01 0.00 -0.00 0.00 0.00 39.33 39.76 1vld h ASP 204 CO 0.03 0.42 0.09 1.23 -0.00 0.00 0.00 179.24 181.02 1vld h GLY 205 N -0.29 0.25 0.83 -0.78 0.00 -0.88 0.11 103.07 102.31 1vld h GLY 205 Ca 0.01 -0.11 0.15 0.00 0.00 0.00 0.00 47.33 47.37 1vld h GLY 205 CO 0.00 0.11 0.44 1.41 0.00 0.00 0.00 176.54 178.50 1vld h LEU 206 N 0.18 0.21 0.12 3.11 3.38 -1.30 0.47 115.31 121.47 1vld h LEU 206 Ca 0.06 0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.72 1vld h LEU 206 Cb 0.07 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1vld h LEU 206 CO -0.01 0.11 -1.68 0.11 0.09 0.00 0.00 178.44 177.06 1vld h LYS 207 N 0.23 0.25 0.00 1.13 1.57 -1.02 -3.42 116.57 115.30 1vld h LYS 207 Ca 0.31 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1vld h LYS 207 Cb 0.90 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1vld h LYS 207 CO -0.06 1.10 0.00 0.72 -0.57 0.00 0.00 179.45 180.64 1vld n HIS 208 N -3.44 0.00 -1.85 -1.35 8.25 0.33 -4.83 115.22 112.34 1vld n HIS 208 Ca -0.21 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.83 1vld n HIS 208 Cb 1.05 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.13 1vld n HIS 208 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vld s ALA 209 N -0.47 3.80 0.00 -1.41 0.00 0.16 -4.63 121.76 119.21 1vld s ALA 209 Ca 0.00 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.37 1vld s ALA 209 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1vld s ALA 209 CO 0.00 -0.94 0.00 0.39 0.00 0.00 0.00 175.76 175.21 1vld n GLU 210 N 4.54 3.00 -3.60 0.00 1.02 -0.54 -4.70 120.64 120.37 1vld n GLU 210 Ca 0.15 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.20 1vld n GLU 210 Cb 0.38 -0.73 -0.06 0.00 -0.02 0.00 0.00 31.44 31.01 1vld n GLU 210 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1vld s MET 211 N -1.39 0.52 -0.05 3.49 0.00 -1.13 -3.15 119.30 117.59 1vld s MET 211 Ca 0.00 0.26 0.01 0.00 0.00 0.00 0.00 55.69 55.96 1vld s MET 211 Cb 0.00 0.25 0.02 0.00 0.00 0.00 0.00 34.83 35.10 1vld s MET 211 CO 0.00 -0.14 -0.07 0.42 0.00 0.00 0.00 175.02 175.23 1vld s ILE 212 N -0.69 0.74 -0.43 10.11 1.01 -0.22 -1.58 121.20 130.14 1vld s ILE 212 Ca 0.00 -0.24 -0.11 0.00 0.00 0.00 0.00 60.65 60.30 1vld s ILE 212 Cb -0.02 -0.72 0.07 0.00 0.01 0.00 0.00 42.46 41.81 1vld s ILE 212 CO -0.02 0.27 0.28 -0.69 0.00 0.00 0.00 174.94 174.78 1vld s VAL 213 N 0.81 4.46 -0.86 2.92 1.01 -0.53 -1.89 120.40 126.32 1vld s VAL 213 Ca -0.13 -1.28 -0.22 0.00 0.00 0.00 0.00 61.98 60.36 1vld s VAL 213 Cb -0.15 -3.70 0.08 0.00 0.00 0.00 0.00 36.38 32.62 1vld s VAL 213 CO 0.01 -0.50 1.18 -0.36 0.00 0.00 0.00 175.10 175.44 1vld s PHE 214 N 1.48 2.77 -0.32 5.22 0.08 0.12 0.38 117.98 127.71 1vld s PHE 214 Ca 0.03 -0.89 -0.12 0.00 0.12 0.00 0.00 56.93 56.07 1vld s PHE 214 Cb -0.23 -4.43 -0.03 0.00 -0.57 0.00 0.00 43.02 37.77 1vld s PHE 214 CO 0.03 -1.71 0.23 -0.46 -0.10 0.00 0.00 175.22 173.22 1vld s TRP 215 N 3.95 3.23 -1.52 0.36 -0.11 0.29 -0.94 118.94 124.19 1vld s TRP 215 Ca 0.33 -0.07 -0.14 0.00 1.22 0.00 0.00 56.10 57.45 1vld s TRP 215 Cb -0.07 -2.46 0.08 0.00 -1.50 0.00 0.00 33.47 29.52 1vld s TRP 215 CO -0.02 -0.29 0.97 0.45 -4.62 0.00 0.00 176.95 173.44 1vld n SER 216 N 5.11 -4.90 -3.99 5.86 2.88 -0.58 -1.51 113.62 116.48 1vld n SER 216 Ca -0.13 -0.75 -0.24 0.00 -1.33 0.00 0.00 58.87 56.42 1vld n SER 216 Cb 0.50 -3.91 -0.17 0.00 -0.75 0.00 0.00 64.21 59.89 1vld n SER 216 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1vld s SER 217 N -3.27 1.68 -0.52 -3.46 0.15 -1.26 -3.35 113.70 103.68 1vld s SER 217 Ca 0.65 -0.27 0.06 0.00 0.70 0.00 0.00 55.95 57.09 1vld s SER 217 Cb -0.33 -0.77 0.21 0.00 -1.71 0.00 0.00 66.02 63.43 1vld s SER 217 CO 0.81 0.01 0.52 -0.67 1.20 0.00 0.00 173.24 175.10 1vld n ASP 218 N 3.95 1.39 -0.26 5.45 -0.08 -1.26 -4.88 116.55 120.86 1vld n ASP 218 Ca -0.22 -2.88 0.07 0.00 -1.51 0.00 0.00 54.79 50.24 1vld n ASP 218 Cb 0.51 -0.65 0.19 0.00 2.34 0.00 0.00 41.12 43.52 1vld n ASP 218 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1vld h PRO 219 N 4.75 0.17 -0.18 -0.67 0.11 -1.90 -1.80 132.00 132.48 1vld h PRO 219 Ca 0.17 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 1vld h PRO 219 Cb 0.81 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.87 1vld h PRO 219 CO 0.57 0.11 0.09 0.93 -0.21 0.00 0.00 178.00 179.50 1vld h GLU 220 N 0.18 0.26 0.56 1.05 4.39 -1.94 0.44 114.58 119.52 1vld h GLU 220 Ca 0.44 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 60.08 1vld h GLU 220 Cb 0.80 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 29.41 1vld h GLU 220 CO -0.61 0.28 -0.27 1.15 -1.16 0.00 0.00 179.01 178.40 1vld h THR 221 N 0.18 0.00 0.06 1.13 2.02 -1.81 -3.36 112.91 111.12 1vld h THR 221 Ca 0.06 -0.17 -0.25 0.00 0.77 0.00 0.00 66.41 66.82 1vld h THR 221 Cb 0.10 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 66.52 1vld h THR 221 CO -0.01 0.00 -1.08 0.78 0.37 0.00 0.00 175.52 175.58 1vld h ASN 222 N -0.92 0.51 -0.93 4.18 2.35 -1.44 -3.48 115.58 115.85 1vld h ASN 222 Ca -0.08 -0.47 -0.40 0.00 -0.55 0.00 0.00 56.30 54.81 1vld h ASN 222 Cb 0.57 -0.16 -0.16 0.00 0.05 0.00 0.00 38.32 38.62 1vld h ASN 222 CO 0.13 1.30 -0.36 -1.54 -1.65 0.00 0.00 177.43 175.30 1vld n SER 223 N -3.67 -5.51 0.00 5.81 3.41 0.16 -2.55 113.62 111.27 1vld n SER 223 Ca -0.08 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1vld n SER 223 Cb 0.92 -4.73 0.00 0.00 -0.26 0.00 0.00 64.21 60.14 1vld n SER 223 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vld n GLY 224 N -0.37 2.18 0.00 5.00 0.00 -1.26 -4.39 105.19 106.36 1vld n GLY 224 Ca -0.20 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1vld n GLY 224 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1vld n ILE 225 N 0.00 0.00 -0.92 -0.61 3.06 -1.06 -4.60 119.36 115.23 1vld n ILE 225 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1vld n ILE 225 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1vld n ILE 225 CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 1vld n TYR 226 N -0.09 0.00 -1.25 9.51 0.53 -1.26 -4.87 117.16 119.73 1vld n TYR 226 Ca 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 57.90 56.82 1vld n TYR 226 Cb 0.00 -1.68 0.23 0.00 -1.03 0.00 0.00 39.34 36.85 1vld n TYR 226 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1vld n ALA 227 N 1.00 4.33 -0.20 -0.72 0.00 -1.26 -4.13 120.51 119.53 1vld n ALA 227 Ca 0.00 -2.80 0.00 0.00 0.00 0.00 0.00 53.44 50.64 1vld n ALA 227 Cb 0.36 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1vld n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vld n GLY 228 N -0.85 1.20 2.64 0.00 0.00 -1.25 -1.71 105.19 105.23 1vld n GLY 228 Ca 0.37 0.68 -0.09 0.00 0.00 0.00 0.00 46.02 46.98 1vld n GLY 228 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vld n PHE 229 N 0.00 1.10 -0.01 1.61 3.01 -1.26 -4.72 117.46 117.19 1vld n PHE 229 Ca 0.00 -2.83 -0.10 0.00 1.01 0.00 0.00 57.45 55.52 1vld n PHE 229 Cb 0.00 -0.38 0.04 0.00 -0.01 0.00 0.00 39.48 39.13 1vld n PHE 229 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1vld h GLU 230 N 3.00 0.61 -0.00 -1.08 4.39 -1.63 -3.28 114.58 116.58 1vld h GLU 230 Ca -0.09 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.22 1vld h GLU 230 Cb 1.17 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1vld h GLU 230 CO 0.50 1.00 -0.10 -1.13 -1.16 0.00 0.00 179.01 178.13 1vld n SER 231 N -3.96 0.46 -0.03 1.42 3.41 -1.26 -4.39 113.62 109.27 1vld n SER 231 Ca -0.03 -0.61 -0.10 0.00 -0.26 0.00 0.00 58.87 57.87 1vld n SER 231 Cb 0.62 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.46 1vld n SER 231 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1vld h ASN 232 N 0.58 -1.00 0.25 4.04 -0.73 -1.95 -1.94 115.58 114.83 1vld h ASN 232 Ca 0.00 0.15 -0.05 0.00 1.87 0.00 0.00 56.30 58.28 1vld h ASN 232 Cb 0.34 0.44 -0.01 0.00 0.27 0.00 0.00 38.32 39.36 1vld h ASN 232 CO 0.00 -0.35 -0.23 -0.29 -0.37 0.00 0.00 177.43 176.19 1vld h ILE 233 N -0.36 1.13 -0.19 2.57 2.10 -1.85 -2.43 117.51 118.48 1vld h ILE 233 Ca 0.11 -0.81 -0.00 0.00 1.08 0.00 0.00 64.86 65.24 1vld h ILE 233 Cb 0.54 1.44 -0.01 0.00 -1.09 0.00 0.00 36.82 37.70 1vld h ILE 233 CO -0.39 0.23 0.11 0.03 -1.08 0.00 0.00 178.15 177.04 1vld h ARG 234 N 0.00 0.26 0.00 2.19 3.08 -1.62 0.40 114.38 118.69 1vld h ARG 234 Ca -0.00 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1vld h ARG 234 Cb 0.42 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 1vld h ARG 234 CO 0.03 0.24 -0.15 0.00 -1.07 0.00 0.00 179.97 179.03 1vld h ARG 235 N 0.21 0.00 -0.48 0.04 3.08 -1.29 -1.53 114.38 114.41 1vld h ARG 235 Ca 0.07 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.02 1vld h ARG 235 Cb 0.05 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 1vld h ARG 235 CO -0.01 0.15 -0.07 0.37 -1.07 0.00 0.00 179.97 179.33 1vld h GLN 236 N 0.00 0.90 0.33 0.04 5.75 -0.74 -0.70 115.11 120.69 1vld h GLN 236 Ca -0.00 -0.33 -0.02 0.00 -0.15 0.00 0.00 58.65 58.16 1vld h GLN 236 Cb 0.54 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1vld h GLN 236 CO 0.02 0.97 -0.16 -1.49 -2.65 0.00 0.00 178.83 175.52 1vld h TRP 237 N 0.75 -0.41 -0.32 3.99 6.55 0.00 -0.50 115.95 126.01 1vld h TRP 237 Ca 0.13 -0.01 0.07 0.00 0.95 0.00 0.00 58.89 60.03 1vld h TRP 237 Cb 0.62 0.13 -0.07 0.00 -0.86 0.00 0.00 29.16 28.98 1vld h TRP 237 CO 0.05 -0.16 -0.14 -0.07 -1.05 0.00 0.00 178.44 177.07 1vld h LEU 238 N -0.60 -0.49 -0.79 -4.49 3.38 -1.32 0.04 115.31 111.04 1vld h LEU 238 Ca -0.04 0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.18 1vld h LEU 238 Cb 0.43 0.28 -0.09 0.00 0.09 0.00 0.00 40.66 41.37 1vld h LEU 238 CO 0.07 -0.18 0.37 0.50 0.09 0.00 0.00 178.44 179.30 1vld h LYS 239 N -0.09 0.54 0.00 1.13 3.64 -0.99 0.36 116.57 121.15 1vld h LYS 239 Ca 0.16 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1vld h LYS 239 Cb 0.34 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1vld h LYS 239 CO -0.38 0.36 0.00 -0.25 -2.27 0.00 0.00 179.45 176.90 1vld n ASP 240 N -4.92 0.00 -0.00 4.20 8.00 -0.12 -2.70 116.55 121.02 1vld n ASP 240 Ca 0.15 -1.00 0.08 0.00 0.71 0.00 0.00 54.79 54.73 1vld n ASP 240 Cb 0.40 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.39 1vld n ASP 240 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1vld n LEU 241 N -0.91 0.48 0.00 0.64 4.77 0.12 -4.99 117.00 117.11 1vld n LEU 241 Ca 0.17 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1vld n LEU 241 Cb 0.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1vld n LEU 241 CO 0.13 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1vld n GLY 242 N 1.45 1.25 3.69 -0.72 0.00 -0.99 -5.08 105.19 104.78 1vld n GLY 242 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1vld n GLY 242 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vld s VAL 243 N -2.00 4.72 0.26 1.61 1.01 -1.07 -4.88 120.40 120.05 1vld s VAL 243 Ca 0.00 1.99 -0.22 0.00 0.00 0.00 0.00 61.98 63.75 1vld s VAL 243 Cb 0.00 -4.28 -0.09 0.00 0.00 0.00 0.00 36.38 32.01 1vld s VAL 243 CO 0.00 0.02 0.80 -1.81 0.00 0.00 0.00 175.10 174.11 1vld s ASP 244 N 1.13 7.16 -0.17 3.32 1.01 -1.19 -4.50 116.67 123.44 1vld s ASP 244 Ca 0.50 1.57 0.01 0.00 0.71 0.00 0.00 52.55 55.34 1vld s ASP 244 Cb -0.19 -2.48 0.01 0.00 1.01 0.00 0.00 42.92 41.27 1vld s ASP 244 CO 0.19 -0.00 -0.18 -0.36 0.21 0.00 0.00 175.17 175.03 1vld s PHE 245 N -1.55 2.76 -0.13 4.23 2.99 -1.26 -1.06 117.98 123.96 1vld s PHE 245 Ca 0.45 -1.35 0.02 0.00 0.00 0.00 0.00 56.93 56.06 1vld s PHE 245 Cb -0.17 -1.90 0.00 0.00 0.00 0.00 0.00 43.02 40.95 1vld s PHE 245 CO 0.22 -0.65 -0.20 0.08 -0.00 0.00 0.00 175.22 174.67 1vld s VAL 246 N 1.05 2.29 -0.18 -0.44 1.01 -0.79 -1.63 120.40 121.71 1vld s VAL 246 Ca -0.01 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.03 1vld s VAL 246 Cb -0.14 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 1vld s VAL 246 CO -0.06 0.54 -0.07 -0.36 0.00 0.00 0.00 175.10 175.15 1vld s PHE 247 N 0.63 2.92 -0.50 5.22 0.40 -0.80 0.11 117.98 125.96 1vld s PHE 247 Ca -0.10 -0.77 -0.04 0.00 -0.60 0.00 0.00 56.93 55.42 1vld s PHE 247 Cb -0.16 -2.00 0.13 0.00 0.51 0.00 0.00 43.02 41.50 1vld s PHE 247 CO 0.02 -0.37 0.32 0.42 0.70 0.00 0.00 175.22 176.31 1vld s ILE 248 N 0.97 3.62 -0.15 0.64 1.01 -0.12 -0.47 121.20 126.70 1vld s ILE 248 Ca -0.01 -2.35 -0.11 0.00 0.00 0.00 0.00 60.65 58.19 1vld s ILE 248 Cb -0.15 -3.41 0.05 0.00 0.01 0.00 0.00 42.46 38.96 1vld s ILE 248 CO 0.00 -0.78 0.39 -0.62 0.00 0.00 0.00 174.94 173.93 1vld s ASP 249 N 1.56 -0.44 0.38 3.58 -1.08 -0.73 -1.53 116.67 118.40 1vld s ASP 249 Ca 0.11 0.81 0.11 0.00 -0.52 0.00 0.00 52.55 53.06 1vld s ASP 249 Cb -0.22 0.75 0.89 0.00 -1.46 0.00 0.00 42.92 42.88 1vld s ASP 249 CO -0.04 -0.16 1.91 -0.65 0.52 0.00 0.00 175.17 176.75 1vld h PRO 250 N 6.40 0.58 -5.29 4.34 0.11 -1.77 -3.35 132.00 133.03 1vld h PRO 250 Ca -0.32 -0.04 -0.63 0.00 0.11 0.00 0.00 66.00 65.12 1vld h PRO 250 Cb 1.18 -0.13 -0.19 0.00 0.11 0.00 0.00 31.00 31.97 1vld h PRO 250 CO 0.29 0.39 -0.62 -1.58 -0.21 0.00 0.00 178.00 176.26 1vld s HIS 251 N -5.58 3.12 -0.74 0.65 5.65 -1.26 -4.06 115.29 113.08 1vld s HIS 251 Ca -0.09 -0.15 -0.26 0.00 0.25 0.00 0.00 55.06 54.82 1vld s HIS 251 Cb 0.21 -2.01 -0.05 0.00 -1.18 0.00 0.00 32.58 29.56 1vld s HIS 251 CO 0.78 0.04 2.00 1.41 -0.65 0.00 0.00 174.74 178.31 1vld s MET 252 N 0.37 2.46 1.01 2.88 1.75 -0.32 -4.92 119.30 122.53 1vld s MET 252 Ca -0.01 0.30 -0.12 0.00 -1.25 0.00 0.00 55.69 54.61 1vld s MET 252 Cb -0.13 -4.72 0.20 0.00 2.84 0.00 0.00 34.83 33.02 1vld s MET 252 CO 0.02 -3.20 1.08 0.54 -0.65 0.00 0.00 175.02 172.80 1vld s ASN 253 N 8.70 2.30 0.56 1.11 2.20 -1.26 -4.64 114.94 123.90 1vld s ASN 253 Ca 0.73 1.61 0.24 0.00 -0.94 0.00 0.00 52.86 54.50 1vld s ASN 253 Cb -0.11 -2.27 1.52 0.00 -2.00 0.00 0.00 41.25 38.39 1vld s ASN 253 CO 0.11 -3.39 2.14 0.45 -2.94 0.00 0.00 177.10 173.47 1vld h HIS 254 N -2.07 0.00 0.09 1.54 3.86 -1.96 0.26 115.15 116.87 1vld h HIS 254 Ca -0.53 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 58.41 1vld h HIS 254 Cb 1.30 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.78 1vld h HIS 254 CO 0.37 0.00 -1.15 1.15 0.86 0.00 0.00 177.93 179.15 1vld h THR 255 N 0.00 1.43 -0.21 2.45 2.02 -1.91 -3.03 112.91 113.66 1vld h THR 255 Ca 0.05 -2.76 -0.14 0.00 0.77 0.00 0.00 66.41 64.34 1vld h THR 255 Cb 0.25 2.74 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 1vld h THR 255 CO -0.00 0.82 -0.44 0.00 0.37 0.00 0.00 175.52 176.26 1vld h ALA 256 N 0.58 0.84 0.00 6.16 0.00 -1.43 -1.86 119.26 123.55 1vld h ALA 256 Ca -0.13 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1vld h ALA 256 Cb 1.84 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1vld h ALA 256 CO 0.20 0.65 0.00 0.54 0.00 0.00 0.00 179.25 180.64 1vld n ARG 257 N -4.01 0.02 -0.10 0.00 1.74 0.73 -1.92 116.66 113.12 1vld n ARG 257 Ca -0.02 0.27 -0.17 0.00 -0.77 0.00 0.00 57.85 57.16 1vld n ARG 257 Cb 0.53 -1.53 -0.09 0.00 -1.02 0.00 0.00 32.46 30.36 1vld n ARG 257 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1vld n LEU 258 N -1.56 2.43 -0.21 0.55 7.94 -0.91 -4.85 117.00 120.39 1vld n LEU 258 Ca 0.03 0.03 0.02 0.00 -1.11 0.00 0.00 56.01 54.98 1vld n LEU 258 Cb 0.17 -0.67 0.03 0.00 0.53 0.00 0.00 43.42 43.49 1vld n LEU 258 CO 0.14 0.69 0.35 1.33 -1.11 0.00 0.00 177.39 178.79 1vld n VAL 259 N -3.40 0.55 -1.91 1.96 0.24 -0.75 -5.10 118.33 109.91 1vld n VAL 259 Ca -0.38 -0.63 -0.38 0.00 -2.04 0.00 0.00 64.34 60.92 1vld n VAL 259 Cb 0.84 0.47 0.03 0.00 -1.47 0.00 0.00 33.84 33.72 1vld n VAL 259 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vld s ALA 260 N -0.76 2.77 -0.16 2.33 0.00 -0.81 -4.69 121.76 120.45 1vld s ALA 260 Ca 0.07 1.19 0.06 0.00 0.00 0.00 0.00 51.96 53.29 1vld s ALA 260 Cb 0.06 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 1vld s ALA 260 CO 0.01 -1.21 0.21 -0.25 0.00 0.00 0.00 175.76 174.51 1vld n ASP 261 N -1.07 1.88 -3.60 0.00 9.92 -0.65 -4.99 116.55 118.04 1vld n ASP 261 Ca 0.11 -0.33 -0.08 0.00 -0.53 0.00 0.00 54.79 53.96 1vld n ASP 261 Cb 0.47 1.15 -0.05 0.00 -0.64 0.00 0.00 41.12 42.04 1vld n ASP 261 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1vld s LYS 262 N -2.02 0.43 -0.01 -1.24 2.47 -1.22 -5.03 119.74 113.11 1vld s LYS 262 Ca 0.00 0.18 0.00 0.00 -1.56 0.00 0.00 55.97 54.59 1vld s LYS 262 Cb 0.04 0.20 0.01 0.00 -1.46 0.00 0.00 37.83 36.63 1vld s LYS 262 CO 0.27 -0.12 -0.00 -0.46 0.16 0.00 0.00 175.35 175.19 1vld s TRP 263 N -0.81 0.18 0.03 4.03 -0.00 -1.26 -1.90 118.94 119.21 1vld s TRP 263 Ca 0.02 0.01 0.04 0.00 -0.00 0.00 0.00 56.10 56.17 1vld s TRP 263 Cb -0.02 -0.22 -0.04 0.00 -0.00 0.00 0.00 33.47 33.20 1vld s TRP 263 CO -0.03 -0.06 -0.06 -0.06 -0.00 0.00 0.00 176.95 176.74 1vld s PHE 264 N 0.49 2.87 -0.51 5.86 0.40 0.38 -4.99 117.98 122.47 1vld s PHE 264 Ca -0.04 -0.06 0.04 0.00 -0.60 0.00 0.00 56.93 56.26 1vld s PHE 264 Cb -0.07 -1.57 0.16 0.00 0.51 0.00 0.00 43.02 42.06 1vld s PHE 264 CO -0.01 0.40 0.37 0.45 0.70 0.00 0.00 175.22 177.13 1vld s SER 265 N -1.69 3.01 0.40 1.36 0.15 -1.25 -1.77 113.70 113.91 1vld s SER 265 Ca 0.19 -3.22 -0.24 0.00 0.70 0.00 0.00 55.95 53.38 1vld s SER 265 Cb -0.11 -0.94 -0.09 0.00 -1.71 0.00 0.00 66.02 63.17 1vld s SER 265 CO 0.10 -0.16 1.09 -2.16 1.20 0.00 0.00 173.24 173.31 1vld s PRO 266 N -0.36 4.11 0.70 5.44 0.04 -1.26 -4.70 135.00 138.96 1vld s PRO 266 Ca 0.27 1.63 -0.16 0.00 0.04 0.00 0.00 61.00 62.77 1vld s PRO 266 Cb -0.05 -2.58 0.02 0.00 0.04 0.00 0.00 34.50 31.93 1vld s PRO 266 CO -0.14 -0.22 1.24 0.15 0.04 0.00 0.00 177.00 178.07 1vld s LYS 267 N -2.44 2.29 0.65 4.56 1.02 -0.23 -4.32 119.74 121.27 1vld s LYS 267 Ca 0.58 1.89 -0.18 0.00 0.02 0.00 0.00 55.97 58.29 1vld s LYS 267 Cb -0.25 -1.84 -0.02 0.00 -0.52 0.00 0.00 37.83 35.21 1vld s LYS 267 CO 0.31 -1.76 1.15 0.44 -0.92 0.00 0.00 175.35 174.58 1vld n ILE 268 N -2.39 4.27 -1.99 2.17 -5.35 -1.26 -2.68 119.36 112.13 1vld n ILE 268 Ca 0.14 -0.48 -0.19 0.00 -0.27 0.00 0.00 62.75 61.96 1vld n ILE 268 Cb 0.49 -1.33 -0.04 0.00 -1.74 0.00 0.00 39.64 37.02 1vld n ILE 268 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vld n GLY 269 N 1.05 0.64 0.11 3.28 0.00 -1.26 -4.64 105.19 104.37 1vld n GLY 269 Ca 0.15 -0.09 0.02 0.00 0.00 0.00 0.00 46.02 46.10 1vld n GLY 269 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vld n THR 270 N -3.28 0.68 0.09 2.61 -2.24 -1.09 -4.30 114.28 106.74 1vld n THR 270 Ca -0.21 -0.75 0.01 0.00 -2.27 0.00 0.00 64.05 60.83 1vld n THR 270 Cb 0.65 0.51 0.34 0.00 -2.10 0.00 0.00 70.33 69.73 1vld n THR 270 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1vld h ASP 271 N 0.00 0.30 0.97 3.42 5.19 -1.89 -2.90 116.42 121.50 1vld h ASP 271 Ca 0.00 -0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.34 1vld h ASP 271 Cb 0.92 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.35 1vld h ASP 271 CO 0.00 0.47 0.00 1.12 -3.12 0.00 0.00 179.24 177.71 1vld h HIS 272 N 0.29 0.00 -0.03 4.55 2.07 -1.89 -2.30 115.15 117.85 1vld h HIS 272 Ca 0.06 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.49 1vld h HIS 272 Cb 0.43 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.40 1vld h HIS 272 CO 0.01 0.00 -0.40 0.00 -3.07 0.00 0.00 177.93 174.47 1vld h ALA 273 N 2.09 1.28 0.02 6.11 0.00 -1.89 -1.83 119.26 125.04 1vld h ALA 273 Ca 0.00 -0.38 -0.27 0.00 0.00 0.00 0.00 54.91 54.27 1vld h ALA 273 Cb 0.48 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.22 1vld h ALA 273 CO 0.00 0.52 -1.07 -0.07 0.00 0.00 0.00 179.25 178.64 1vld h LEU 274 N 0.05 0.86 -0.62 0.00 3.38 -1.54 -2.04 115.31 115.40 1vld h LEU 274 Ca 0.00 -0.71 -0.11 0.00 0.09 0.00 0.00 57.88 57.15 1vld h LEU 274 Cb 0.73 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1vld h LEU 274 CO 0.05 1.51 -0.14 0.77 0.09 0.00 0.00 178.44 180.72 1vld h SER 275 N 0.35 0.95 -0.57 -0.43 4.64 -1.43 0.06 113.55 117.12 1vld h SER 275 Ca -0.13 -0.32 -0.05 0.00 -0.47 0.00 0.00 61.79 60.82 1vld h SER 275 Cb 1.72 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.53 1vld h SER 275 CO 0.21 1.08 0.17 -0.26 -0.87 0.00 0.00 176.83 177.15 1vld h PHE 276 N 0.83 0.94 -0.67 4.77 -1.00 -1.38 0.70 116.94 121.14 1vld h PHE 276 Ca 0.13 -0.10 -0.04 0.00 2.81 0.00 0.00 57.97 60.76 1vld h PHE 276 Cb 0.69 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 39.95 1vld h PHE 276 CO 0.04 0.79 0.25 0.00 -1.61 0.00 0.00 178.31 177.79 1vld h ALA 277 N 1.04 0.87 -0.49 2.45 0.00 -1.10 0.38 119.26 122.41 1vld h ALA 277 Ca 0.18 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1vld h ALA 277 Cb 0.31 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1vld h ALA 277 CO -0.00 0.50 -0.10 0.82 0.00 0.00 0.00 179.25 180.47 1vld h ILE 278 N 0.95 1.26 -0.51 0.00 2.04 -0.69 -0.82 117.51 119.75 1vld h ILE 278 Ca 0.22 -1.20 -0.10 0.00 1.00 0.00 0.00 64.86 64.79 1vld h ILE 278 Cb 0.23 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 1vld h ILE 278 CO -0.02 0.42 -0.07 0.00 0.00 0.00 0.00 178.15 178.48 1vld h ALA 279 N 1.09 0.69 -1.01 1.87 0.00 -0.31 -2.07 119.26 119.52 1vld h ALA 279 Ca 0.13 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1vld h ALA 279 Cb 0.61 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1vld h ALA 279 CO 0.04 0.56 0.66 -0.92 0.00 0.00 0.00 179.25 179.59 1vld h TYR 280 N 0.80 1.24 -0.49 0.00 3.20 0.12 0.63 116.97 122.47 1vld h TYR 280 Ca 0.13 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 1vld h TYR 280 Cb 0.62 -0.41 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1vld h TYR 280 CO 0.04 0.72 0.11 1.15 -1.64 0.00 0.00 178.16 178.55 1vld h THR 281 N 1.29 1.24 -0.55 1.81 2.02 -0.82 -1.01 112.91 116.89 1vld h THR 281 Ca 0.40 -0.87 -0.09 0.00 0.77 0.00 0.00 66.41 66.62 1vld h THR 281 Cb -0.02 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1vld h THR 281 CO -0.12 0.31 0.00 -0.50 0.37 0.00 0.00 175.52 175.58 1vld h TRP 282 N 0.68 1.02 -0.31 3.16 6.55 -0.67 -2.02 115.95 124.36 1vld h TRP 282 Ca 0.15 -0.16 -0.17 0.00 0.95 0.00 0.00 58.89 59.66 1vld h TRP 282 Cb 0.35 -0.27 -0.00 0.00 -0.86 0.00 0.00 29.16 28.37 1vld h TRP 282 CO 0.02 0.92 -0.48 -0.07 -1.05 0.00 0.00 178.44 177.78 1vld h LEU 283 N 0.87 0.91 -1.31 -4.49 3.38 -0.75 0.84 115.31 114.77 1vld h LEU 283 Ca 0.16 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 1vld h LEU 283 Cb 0.51 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1vld h LEU 283 CO 0.03 1.24 -0.18 0.11 0.09 0.00 0.00 178.44 179.73 1vld h LYS 284 N 0.66 0.00 -0.08 1.13 1.79 -1.05 -3.22 116.57 115.80 1vld h LYS 284 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1vld h LYS 284 Cb 1.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.72 1vld h LYS 284 CO 0.11 0.18 0.00 0.39 -1.08 0.00 0.00 179.45 179.05 1vld n GLU 285 N -3.39 1.00 -3.82 3.15 1.02 -0.77 -4.99 120.64 112.83 1vld n GLU 285 Ca -0.00 -1.22 -0.26 0.00 -0.02 0.00 0.00 57.16 55.66 1vld n GLU 285 Cb 0.38 -1.13 0.03 0.00 -0.02 0.00 0.00 31.44 30.70 1vld n GLU 285 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1vld n ASP 286 N 0.24 -2.98 -3.17 1.62 9.92 0.18 -4.90 116.55 117.46 1vld n ASP 286 Ca 0.05 -0.81 -0.34 0.00 -0.53 0.00 0.00 54.79 53.16 1vld n ASP 286 Cb 0.23 -3.92 -0.00 0.00 -0.64 0.00 0.00 41.12 36.78 1vld n ASP 286 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1vld n SER 287 N -2.94 6.00 -3.54 -2.24 3.41 -0.54 -4.99 113.62 108.77 1vld n SER 287 Ca -0.13 -3.71 -0.12 0.00 -0.26 0.00 0.00 58.87 54.65 1vld n SER 287 Cb 0.60 -0.85 -0.04 0.00 -0.26 0.00 0.00 64.21 63.66 1vld n SER 287 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1vld s TYR 288 N -3.90 0.77 -1.11 7.33 1.13 -1.26 -4.75 117.35 115.56 1vld s TYR 288 Ca 0.45 -1.07 -0.18 0.00 -1.41 0.00 0.00 57.07 54.86 1vld s TYR 288 Cb 0.27 0.04 0.11 0.00 -1.10 0.00 0.00 41.96 41.28 1vld s TYR 288 CO -0.17 -1.08 1.43 0.34 -2.51 0.00 0.00 175.55 173.55 1vld s ASP 289 N -3.15 6.78 0.23 -0.18 -1.08 -0.16 -4.85 116.67 114.26 1vld s ASP 289 Ca 0.27 -2.29 -0.07 0.00 -0.52 0.00 0.00 52.55 49.94 1vld s ASP 289 Cb -0.00 -2.48 0.28 0.00 -1.46 0.00 0.00 42.92 39.25 1vld s ASP 289 CO 0.15 -1.09 1.85 0.11 0.52 0.00 0.00 175.17 176.71 1vld h LYS 290 N 8.26 0.88 -0.09 4.34 1.57 -1.96 -1.86 116.57 127.72 1vld h LYS 290 Ca 0.28 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.02 1vld h LYS 290 Cb 0.94 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 1vld h LYS 290 CO 1.30 0.58 -0.00 0.93 -0.57 0.00 0.00 179.45 181.69 1vld h GLU 291 N 0.91 0.03 -0.10 3.15 3.07 -1.99 -0.36 114.58 119.30 1vld h GLU 291 Ca 0.34 -0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.22 1vld h GLU 291 Cb 0.12 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.00 1vld h GLU 291 CO -0.15 0.02 -0.05 -0.92 -1.40 0.00 0.00 179.01 176.51 1vld h TYR 292 N 0.03 -0.12 -0.90 4.33 3.20 -1.91 -2.12 116.97 119.48 1vld h TYR 292 Ca 0.04 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1vld h TYR 292 Cb 0.05 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.34 1vld h TYR 292 CO -0.12 -0.08 0.59 0.28 -1.64 0.00 0.00 178.16 177.19 1vld h VAL 293 N -0.05 1.18 0.00 1.81 2.07 -1.04 0.36 116.25 120.59 1vld h VAL 293 Ca 0.06 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 1vld h VAL 293 Cb 0.13 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.81 1vld h VAL 293 CO -0.13 0.21 -0.25 0.00 0.02 0.00 0.00 177.57 177.43 1vld h ALA 294 N 1.46 1.16 0.07 1.67 0.00 -0.68 -2.11 119.26 120.82 1vld h ALA 294 Ca 0.35 -0.23 -0.37 0.00 0.00 0.00 0.00 54.91 54.66 1vld h ALA 294 Cb -0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1vld h ALA 294 CO -0.09 0.31 -2.15 0.00 0.00 0.00 0.00 179.25 177.32 1vld n ALA 295 N -2.30 1.08 -0.56 0.00 0.00 -0.59 -4.63 120.51 113.52 1vld n ALA 295 Ca -0.01 -0.78 0.07 0.00 0.00 0.00 0.00 53.44 52.72 1vld n ALA 295 Cb 0.38 -0.44 0.22 0.00 0.00 0.00 0.00 19.45 19.61 1vld n ALA 295 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1vld n ASN 296 N -3.49 3.57 -4.20 0.00 3.02 0.12 -4.97 115.26 109.31 1vld n ASN 296 Ca -0.38 -2.46 -0.23 0.00 -0.03 0.00 0.00 54.58 51.49 1vld n ASN 296 Cb 1.00 -0.40 -0.14 0.00 -0.61 0.00 0.00 39.78 39.63 1vld n ASN 296 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vld s ALA 297 N -1.83 1.46 -0.04 5.41 0.00 -0.80 -0.86 121.76 125.10 1vld s ALA 297 Ca 0.35 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 51.41 1vld s ALA 297 Cb 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 23.09 1vld s ALA 297 CO 0.14 0.31 -0.19 -1.58 0.00 0.00 0.00 175.76 174.44 1vld s HIS 298 N -0.84 1.87 -0.48 0.00 2.46 0.24 -4.67 115.29 113.87 1vld s HIS 298 Ca 0.04 -0.51 0.00 0.00 0.47 0.00 0.00 55.06 55.06 1vld s HIS 298 Cb -0.08 -1.24 0.00 0.00 -0.13 0.00 0.00 32.58 31.12 1vld s HIS 298 CO 0.02 -0.16 0.00 0.41 -2.47 0.00 0.00 174.74 172.54 1vld n GLY 299 N 3.02 0.72 0.29 1.59 0.00 -1.26 -1.27 105.19 108.28 1vld n GLY 299 Ca -0.17 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.20 1vld n GLY 299 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1vld h PHE 300 N 0.00 1.03 -0.07 1.61 3.57 -1.92 -2.61 116.94 118.54 1vld h PHE 300 Ca -0.09 -0.12 0.04 0.00 3.53 0.00 0.00 57.97 61.32 1vld h PHE 300 Cb 0.38 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 1vld h PHE 300 CO 0.18 0.86 -0.19 0.93 -2.23 0.00 0.00 178.31 177.86 1vld h GLU 301 N 0.89 -0.26 -0.76 1.11 3.07 -1.96 0.17 114.58 116.84 1vld h GLU 301 Ca 0.19 0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.02 1vld h GLU 301 Cb 0.35 0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.29 1vld h GLU 301 CO 0.00 -0.18 0.28 0.93 -1.40 0.00 0.00 179.01 178.65 1vld h GLU 302 N -0.27 1.15 0.08 2.33 3.07 -1.97 -2.06 114.58 116.90 1vld h GLU 302 Ca 0.08 -0.22 -0.00 0.00 -0.50 0.00 0.00 59.36 58.72 1vld h GLU 302 Cb 0.39 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 1vld h GLU 302 CO -0.23 0.95 -0.04 2.35 -1.40 0.00 0.00 179.01 180.63 1vld h TRP 303 N 1.12 -0.10 -0.81 4.33 7.01 -1.05 -1.84 115.95 124.62 1vld h TRP 303 Ca 0.25 -0.00 0.15 0.00 2.11 0.00 0.00 58.89 61.40 1vld h TRP 303 Cb 0.24 0.03 -0.10 0.00 -2.10 0.00 0.00 29.16 27.24 1vld h TRP 303 CO 0.02 0.04 0.37 0.00 -2.79 0.00 0.00 178.44 176.08 1vld h ALA 304 N 0.70 1.18 0.00 2.65 0.00 -0.46 0.41 119.26 123.74 1vld h ALA 304 Ca -0.01 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1vld h ALA 304 Cb 0.18 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1vld h ALA 304 CO 0.02 -0.17 -0.20 -0.44 0.00 0.00 0.00 179.25 178.46 1vld h ASP 305 N 0.52 0.00 -0.29 0.00 3.32 -0.97 -1.00 116.42 118.01 1vld h ASP 305 Ca 0.45 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.35 1vld h ASP 305 Cb 0.67 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1vld h ASP 305 CO -0.39 0.20 -0.37 0.22 -1.72 0.00 0.00 179.24 177.18 1vld h TYR 306 N 0.00 0.98 -0.40 4.55 3.20 0.57 -0.06 116.97 125.81 1vld h TYR 306 Ca -0.00 -0.28 -0.11 0.00 3.14 0.00 0.00 58.73 61.47 1vld h TYR 306 Cb 0.36 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1vld h TYR 306 CO 0.00 1.07 -0.19 0.28 -1.64 0.00 0.00 178.16 177.68 1vld h VAL 307 N 0.68 1.28 0.00 1.81 2.07 -0.34 -2.76 116.25 118.99 1vld h VAL 307 Ca 0.06 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.25 1vld h VAL 307 Cb 0.93 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1vld h VAL 307 CO 0.09 0.45 0.00 0.18 0.02 0.00 0.00 177.57 178.30 1vld n LEU 308 N -4.24 0.00 0.00 2.57 4.77 -0.45 -1.65 117.00 118.00 1vld n LEU 308 Ca -0.01 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1vld n LEU 308 Cb 0.43 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1vld n LEU 308 CO 0.45 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1vld n GLY 309 N 0.28 0.54 0.26 -0.72 0.00 -1.04 -4.35 105.19 100.16 1vld n GLY 309 Ca 0.11 -0.26 0.14 0.00 0.00 0.00 0.00 46.02 46.01 1vld n GLY 309 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vld h LYS 310 N 1.03 0.00 0.00 1.61 1.57 -1.23 -1.60 116.57 117.94 1vld h LYS 310 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vld h LYS 310 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1vld h LYS 310 CO 0.00 0.10 -1.24 0.25 -0.57 0.00 0.00 179.45 177.99 1vld n THR 311 N -3.28 0.00 0.19 -0.16 -2.24 -1.25 -4.65 114.28 102.89 1vld n THR 311 Ca -0.00 -0.23 0.02 0.00 -2.27 0.00 0.00 64.05 61.57 1vld n THR 311 Cb 0.32 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 68.97 1vld n THR 311 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1vld n ASP 312 N -1.71 0.51 -0.35 3.42 3.85 -1.24 -5.00 116.55 116.03 1vld n ASP 312 Ca -0.01 -0.76 -0.04 0.00 -0.71 0.00 0.00 54.79 53.27 1vld n ASP 312 Cb 0.23 0.73 -0.02 0.00 -1.35 0.00 0.00 41.12 40.71 1vld n ASP 312 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1vld n GLY 313 N 0.87 0.67 2.62 6.12 0.00 -0.60 -5.01 105.19 109.85 1vld n GLY 313 Ca 0.01 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 1vld n GLY 313 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vld s THR 314 N -2.17 0.65 0.28 2.61 2.01 -1.23 -5.04 115.64 112.76 1vld s THR 314 Ca 0.00 -1.66 -0.30 0.00 0.31 0.00 0.00 61.69 60.04 1vld s THR 314 Cb 0.00 -1.48 -0.11 0.00 0.01 0.00 0.00 72.50 70.92 1vld s THR 314 CO 0.00 -0.82 1.48 -2.84 -0.69 0.00 0.00 174.62 171.75 1vld s PRO 315 N 1.24 4.21 -1.41 4.92 0.02 -1.26 -4.05 135.00 138.66 1vld s PRO 315 Ca 0.14 2.41 -0.11 0.00 0.02 0.00 0.00 61.00 63.46 1vld s PRO 315 Cb -0.20 -3.07 0.07 0.00 0.02 0.00 0.00 34.50 31.32 1vld s PRO 315 CO -0.14 -0.48 2.25 1.63 -0.33 0.00 0.00 177.00 179.94 1vld n LYS 316 N 1.99 3.43 -1.62 5.54 4.76 -0.66 -4.86 118.16 126.74 1vld n LYS 316 Ca 0.06 -2.93 -0.30 0.00 -2.87 0.00 0.00 58.31 52.28 1vld n LYS 316 Cb 0.39 -3.02 0.10 0.00 -1.84 0.00 0.00 35.03 30.66 1vld n LYS 316 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1vld s THR 317 N 1.65 2.77 0.26 -0.18 -4.23 -1.26 -3.86 115.64 110.79 1vld s THR 317 Ca 0.49 0.25 0.04 0.00 -1.18 0.00 0.00 61.69 61.29 1vld s THR 317 Cb 0.14 -3.05 0.01 0.00 1.34 0.00 0.00 72.50 70.93 1vld s THR 317 CO -0.06 -0.33 1.64 0.00 -0.54 0.00 0.00 174.62 175.34 1vld h GLU 319 N 0.28 0.26 -0.16 0.00 3.07 -1.93 -0.93 114.58 115.17 1vld h GLU 319 Ca 0.02 -0.10 -0.19 0.00 -0.50 0.00 0.00 59.36 58.59 1vld h GLU 319 Cb 0.90 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.80 1vld h GLU 319 CO 0.07 0.54 -0.64 2.35 -1.40 0.00 0.00 179.01 179.93 1vld h TRP 320 N 0.24 0.97 -0.63 4.33 7.01 -1.74 -3.05 115.95 123.07 1vld h TRP 320 Ca 0.03 -0.41 -0.05 0.00 2.11 0.00 0.00 58.89 60.58 1vld h TRP 320 Cb 0.64 -0.16 -0.03 0.00 -2.10 0.00 0.00 29.16 27.51 1vld h TRP 320 CO 0.01 1.22 0.19 0.00 -2.79 0.00 0.00 178.44 177.08 1vld h ALA 321 N 0.55 1.15 -0.77 2.65 0.00 -0.70 -2.39 119.26 119.75 1vld h ALA 321 Ca -0.03 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1vld h ALA 321 Cb 1.27 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1vld h ALA 321 CO 0.14 0.59 0.51 1.49 0.00 0.00 0.00 179.25 181.97 1vld h GLU 322 N 0.93 1.01 0.00 0.00 4.81 -1.15 0.83 114.58 121.01 1vld h GLU 322 Ca 0.21 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 1vld h GLU 322 Cb 0.27 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1vld h GLU 322 CO -0.01 0.67 -0.22 1.49 -0.73 0.00 0.00 179.01 180.21 1vld h GLU 323 N 1.04 0.00 0.00 1.92 4.81 -1.32 0.13 114.58 121.16 1vld h GLU 323 Ca 0.28 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.40 1vld h GLU 323 Cb -0.12 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 1vld h GLU 323 CO -0.06 0.22 -0.75 0.93 -0.73 0.00 0.00 179.01 178.62 1vld h GLU 324 N 0.00 0.00 0.00 1.92 4.39 -0.98 -3.42 114.58 116.50 1vld h GLU 324 Ca -0.00 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.59 1vld h GLU 324 Cb 0.56 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 1vld h GLU 324 CO 0.03 0.63 -1.32 -1.13 -1.16 0.00 0.00 179.01 176.06 1vld n SER 325 N -4.54 0.80 0.00 1.42 3.41 0.15 -4.75 113.62 110.10 1vld n SER 325 Ca -0.19 0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1vld n SER 325 Cb 0.47 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.80 1vld n SER 325 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vld n GLY 326 N 1.32 0.73 3.72 5.00 0.00 0.44 -1.07 105.19 115.33 1vld n GLY 326 Ca -0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 1vld n GLY 326 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vld s VAL 327 N -2.92 5.06 -0.08 1.61 1.01 -1.26 -5.00 120.40 118.83 1vld s VAL 327 Ca 0.00 1.40 -0.37 0.00 0.00 0.00 0.00 61.98 63.00 1vld s VAL 327 Cb 0.00 -4.02 -0.15 0.00 0.00 0.00 0.00 36.38 32.21 1vld s VAL 327 CO 0.00 0.26 1.63 -2.65 0.00 0.00 0.00 175.10 174.34 1vld n PRO 328 N 3.76 1.47 -0.19 2.72 -0.02 -1.26 -3.98 135.00 137.50 1vld n PRO 328 Ca -0.02 0.54 0.14 0.00 -2.02 0.00 0.00 63.50 62.14 1vld n PRO 328 Cb 0.51 -2.25 0.47 0.00 -0.02 0.00 0.00 33.50 32.21 1vld n PRO 328 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vld h ALA 329 N 6.67 2.04 0.00 3.55 0.00 -1.93 0.15 119.26 129.73 1vld h ALA 329 Ca -0.47 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1vld h ALA 329 Cb 1.31 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1vld h ALA 329 CO 0.90 -0.25 -0.11 0.00 0.00 0.00 0.00 179.25 179.79 1vld h GLU 331 N 0.00 0.00 0.06 0.00 5.08 -1.09 -2.77 114.58 115.86 1vld h GLU 331 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1vld h GLU 331 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1vld h GLU 331 CO 0.01 0.52 -0.03 0.82 -1.00 0.00 0.00 179.01 179.34 1vld h ILE 332 N 0.00 1.17 -0.69 3.13 2.04 -1.02 -2.66 117.51 119.49 1vld h ILE 332 Ca -0.19 -0.83 -0.05 0.00 1.00 0.00 0.00 64.86 64.78 1vld h ILE 332 Cb 1.83 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 39.59 1vld h ILE 332 CO 0.08 0.21 0.23 -0.09 0.00 0.00 0.00 178.15 178.57 1vld h ARG 333 N -0.46 1.04 -0.59 2.37 2.43 -1.51 -2.05 114.38 115.62 1vld h ARG 333 Ca -0.01 -0.21 0.02 0.00 -0.81 0.00 0.00 59.98 58.98 1vld h ARG 333 Cb 0.40 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1vld h ARG 333 CO 0.01 0.88 0.37 0.00 -1.51 0.00 0.00 179.97 179.73 1vld h ALA 334 N 1.23 0.76 -0.12 2.80 0.00 -1.49 -1.88 119.26 120.57 1vld h ALA 334 Ca 0.23 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1vld h ALA 334 Cb 0.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1vld h ALA 334 CO -0.01 0.13 0.07 1.25 0.00 0.00 0.00 179.25 180.68 1vld h LEU 335 N 0.74 0.15 -0.16 0.00 5.85 -1.16 -2.12 115.31 118.61 1vld h LEU 335 Ca 0.23 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.91 1vld h LEU 335 Cb -0.02 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 40.92 1vld h LEU 335 CO -0.08 0.19 -0.17 0.00 -0.34 0.00 0.00 178.44 178.04 1vld h ALA 336 N 0.97 -0.07 -0.62 1.25 0.00 -1.04 0.32 119.26 120.08 1vld h ALA 336 Ca 0.04 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1vld h ALA 336 Cb 0.07 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1vld h ALA 336 CO -0.01 -0.61 0.23 0.00 0.00 0.00 0.00 179.25 178.86 1vld h ARG 337 N -0.19 0.91 -0.30 0.00 3.08 -1.29 -1.29 114.38 115.29 1vld h ARG 337 Ca 0.11 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 59.90 1vld h ARG 337 Cb 0.35 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1vld h ARG 337 CO -0.27 0.76 -0.23 0.37 -1.07 0.00 0.00 179.97 179.53 1vld h GLN 338 N 0.89 0.68 -0.82 0.04 5.75 -0.87 -2.90 115.11 117.88 1vld h GLN 338 Ca 0.21 -0.33 0.08 0.00 -0.15 0.00 0.00 58.65 58.45 1vld h GLN 338 Cb 0.20 -0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.69 1vld h GLN 338 CO -0.02 0.94 0.48 2.35 -2.65 0.00 0.00 178.83 179.93 1vld h TRP 339 N 0.43 0.88 -0.35 3.99 2.91 0.10 -1.83 115.95 122.09 1vld h TRP 339 Ca 0.06 0.03 -0.13 0.00 1.13 0.00 0.00 58.89 59.97 1vld h TRP 339 Cb 0.78 -0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 29.15 1vld h TRP 339 CO 0.07 0.40 -0.31 0.00 -1.03 0.00 0.00 178.44 177.57 1vld h ALA 340 N 1.42 0.50 0.00 2.65 0.00 -1.20 -3.31 119.26 119.33 1vld h ALA 340 Ca 0.38 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1vld h ALA 340 Cb 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1vld h ALA 340 CO -0.21 0.54 -0.26 1.57 0.00 0.00 0.00 179.25 180.90 1vld h LYS 341 N 0.61 0.00 -6.23 0.00 2.10 -1.28 -3.47 116.57 108.29 1vld h LYS 341 Ca 0.06 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 58.14 1vld h LYS 341 Cb 0.89 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.14 1vld h LYS 341 CO 0.08 0.00 -0.59 0.15 -2.00 0.00 0.00 179.45 177.09 1vld s LYS 342 N -3.19 2.76 -0.77 0.07 -0.14 -0.71 -5.02 119.74 112.74 1vld s LYS 342 Ca 0.07 -0.97 -0.26 0.00 -1.36 0.00 0.00 55.97 53.46 1vld s LYS 342 Cb 0.09 -2.55 -0.02 0.00 -1.68 0.00 0.00 37.83 33.67 1vld s LYS 342 CO 0.68 0.46 1.83 -0.80 -0.76 0.00 0.00 175.35 176.76 1vld s ASN 343 N -3.16 5.35 -0.15 2.83 0.01 -1.26 -4.86 114.94 113.70 1vld s ASN 343 Ca 0.30 -0.24 -0.03 0.00 -0.71 0.00 0.00 52.86 52.18 1vld s ASN 343 Cb -0.10 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 38.99 1vld s ASN 343 CO 0.22 -2.44 -0.05 -0.89 -1.51 0.00 0.00 177.10 172.43 1vld s THR 344 N 9.02 3.76 -0.14 1.60 2.01 -1.09 -1.46 115.64 129.34 1vld s THR 344 Ca 0.65 -0.41 -0.07 0.00 0.31 0.00 0.00 61.69 62.17 1vld s THR 344 Cb -0.09 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.74 1vld s THR 344 CO 0.10 0.50 0.12 -0.31 -0.69 0.00 0.00 174.62 174.34 1vld s TYR 345 N 0.34 3.52 -0.41 4.92 1.51 -0.61 -3.96 117.35 122.65 1vld s TYR 345 Ca -0.05 0.45 -0.16 0.00 -1.01 0.00 0.00 57.07 56.29 1vld s TYR 345 Cb -0.14 -1.98 0.02 0.00 -0.11 0.00 0.00 41.96 39.74 1vld s TYR 345 CO 0.03 0.61 0.36 -1.17 -1.11 0.00 0.00 175.55 174.27 1vld s LEU 346 N -0.68 4.95 -1.13 -1.29 2.96 -0.27 -1.45 118.68 121.76 1vld s LEU 346 Ca 0.13 -0.75 -0.13 0.00 -0.22 0.00 0.00 54.13 53.16 1vld s LEU 346 Cb -0.12 -2.27 0.19 0.00 0.50 0.00 0.00 46.19 44.50 1vld s LEU 346 CO 0.03 -0.49 1.30 0.00 -1.32 0.00 0.00 176.35 175.86 1vld s ALA 347 N 1.90 4.08 -0.25 5.97 0.00 0.16 -1.97 121.76 131.66 1vld s ALA 347 Ca 0.08 -3.38 -0.21 0.00 0.00 0.00 0.00 51.96 48.45 1vld s ALA 347 Cb -0.18 -3.97 -0.02 0.00 0.00 0.00 0.00 23.12 18.95 1vld s ALA 347 CO 0.12 -2.66 0.65 0.00 0.00 0.00 0.00 175.76 173.87 1vld s ALA 348 N 1.06 3.61 0.09 0.00 0.00 -1.26 -0.54 121.76 124.72 1vld s ALA 348 Ca 0.38 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.95 1vld s ALA 348 Cb -0.05 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 20.02 1vld s ALA 348 CO -0.03 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.35 1vld n GLY 349 N 4.08 -1.84 0.08 0.00 0.00 -0.57 -0.64 105.19 106.30 1vld n GLY 349 Ca -0.00 -1.43 -0.05 0.00 0.00 0.00 0.00 46.02 44.54 1vld n GLY 349 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vld h GLY 350 N -0.29 0.00 1.22 -0.02 0.00 -1.73 -3.38 103.07 98.87 1vld h GLY 350 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.03 1vld h GLY 350 CO 0.01 0.00 -1.54 -2.00 0.00 0.00 0.00 176.54 173.01 1vld h LEU 351 N 0.00 0.25 0.00 3.11 5.85 -1.82 -3.35 115.31 119.35 1vld h LEU 351 Ca -0.15 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1vld h LEU 351 Cb 1.80 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.74 1vld h LEU 351 CO 0.09 1.33 0.00 0.61 -0.34 0.00 0.00 178.44 180.12 1vld n GLY 352 N 1.63 0.98 0.00 3.75 0.00 -1.25 -4.44 105.19 105.86 1vld n GLY 352 Ca -0.16 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1vld n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vld n GLY 353 N 0.00 -0.32 7.00 -0.02 0.00 0.18 -4.07 105.19 107.97 1vld n GLY 353 Ca 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.79 1vld n GLY 353 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1vld n TRP 354 N 0.00 -0.75 0.00 1.61 8.01 -1.26 -3.73 117.44 121.32 1vld n TRP 354 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 1vld n TRP 354 Cb 0.00 0.17 0.00 0.00 -2.01 0.00 0.00 31.31 29.47 1vld n TRP 354 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1vld n GLY 355 N 0.00 3.30 0.27 6.99 0.00 -1.26 -3.94 105.19 110.55 1vld n GLY 355 Ca 0.00 -1.49 0.11 0.00 0.00 0.00 0.00 46.02 44.64 1vld n GLY 355 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vld h GLY 356 N 0.00 0.00 1.58 -0.02 0.00 -1.94 -0.98 103.07 101.70 1vld h GLY 356 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1vld h GLY 356 CO 0.00 0.00 0.21 0.00 0.00 0.00 0.00 176.54 176.75 1vld h ALA 357 N 1.99 1.61 0.00 3.60 0.00 -1.89 -2.62 119.26 121.95 1vld h ALA 357 Ca -0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1vld h ALA 357 Cb 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1vld h ALA 357 CO 0.00 0.33 -0.07 0.00 0.00 0.00 0.00 179.25 179.51 1vld n ARG 359 N -3.30 4.04 -4.13 0.00 1.85 -0.99 -0.51 116.66 113.62 1vld n ARG 359 Ca -0.01 -4.72 -0.13 0.00 -1.00 0.00 0.00 57.85 51.99 1vld n ARG 359 Cb 0.25 -2.36 -0.07 0.00 -1.05 0.00 0.00 32.46 29.22 1vld n ARG 359 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1vld s ALA 360 N -3.47 0.79 0.30 2.89 0.00 -1.22 -1.81 121.76 119.24 1vld s ALA 360 Ca 0.41 -1.49 0.34 0.00 0.00 0.00 0.00 51.96 51.23 1vld s ALA 360 Cb 0.19 1.27 1.88 0.00 0.00 0.00 0.00 23.12 26.46 1vld s ALA 360 CO -0.07 -0.71 2.05 0.66 0.00 0.00 0.00 175.76 177.69 1vld h SER 361 N 2.37 0.00 -0.29 0.00 4.64 -1.87 -0.29 113.55 118.12 1vld h SER 361 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1vld h SER 361 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1vld h SER 361 CO 0.44 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.40 1vld n HIS 362 N -2.72 0.46 -0.14 4.77 1.44 -1.26 -4.54 115.22 113.23 1vld n HIS 362 Ca -0.02 -0.55 -0.06 0.00 -2.01 0.00 0.00 57.72 55.08 1vld n HIS 362 Cb 0.07 -0.07 0.00 0.00 0.12 0.00 0.00 29.99 30.12 1vld n HIS 362 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 1vld h GLY 363 N 1.74 -0.06 -0.05 -1.39 0.00 -1.13 -0.79 103.07 101.40 1vld h GLY 363 Ca 0.00 0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.70 1vld h GLY 363 CO 0.03 -0.21 -0.45 -2.22 0.00 0.00 0.00 176.54 173.69 1vld h ILE 364 N -0.18 0.00 0.00 2.60 2.04 -1.78 -0.93 117.51 119.27 1vld h ILE 364 Ca 0.20 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.05 1vld h ILE 364 Cb 0.51 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1vld h ILE 364 CO -0.56 0.00 -0.07 -0.33 0.00 0.00 0.00 178.15 177.20 1vld h GLU 365 N -0.53 0.00 0.16 2.37 4.39 -1.86 -1.75 114.58 117.37 1vld h GLU 365 Ca 0.02 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 1vld h GLU 365 Cb 0.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1vld h GLU 365 CO -0.32 0.07 -0.08 2.35 -1.16 0.00 0.00 179.01 179.86 1vld h TRP 366 N 0.00 -0.20 -0.47 4.33 7.01 -0.07 0.16 115.95 126.71 1vld h TRP 366 Ca -0.00 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.04 1vld h TRP 366 Cb 0.13 0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.21 1vld h TRP 366 CO 0.00 0.06 0.22 0.00 -2.79 0.00 0.00 178.44 175.94 1vld h ALA 367 N 0.33 0.59 -0.79 2.65 0.00 -0.84 -0.03 119.26 121.17 1vld h ALA 367 Ca -0.02 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1vld h ALA 367 Cb 0.36 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1vld h ALA 367 CO 0.04 -0.14 0.32 0.00 0.00 0.00 0.00 179.25 179.47 1vld h ARG 368 N 0.44 1.18 -0.85 0.00 3.08 -1.24 -1.17 114.38 115.83 1vld h ARG 368 Ca 0.21 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1vld h ARG 368 Cb 0.14 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 1vld h ARG 368 CO -0.16 0.95 0.43 0.78 -1.07 0.00 0.00 179.97 180.90 1vld h GLY 369 N 1.16 1.28 1.39 0.04 0.00 -0.01 0.69 103.07 107.62 1vld h GLY 369 Ca 0.27 -0.61 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1vld h GLY 369 CO -0.02 0.58 0.04 -0.33 0.00 0.00 0.00 176.54 176.81 1vld h MET 370 N 1.19 0.75 -0.22 4.80 2.86 -0.40 -2.19 114.93 121.73 1vld h MET 370 Ca 0.29 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.62 1vld h MET 370 Cb 0.08 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1vld h MET 370 CO -0.04 0.74 -0.39 0.82 1.06 0.00 0.00 176.91 179.09 1vld h ILE 371 N 0.71 1.32 -0.18 -1.22 2.04 -0.46 -2.57 117.51 117.15 1vld h ILE 371 Ca 0.15 -1.61 0.03 0.00 1.00 0.00 0.00 64.86 64.44 1vld h ILE 371 Cb 0.38 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 38.22 1vld h ILE 371 CO 0.01 0.50 -0.03 0.00 0.00 0.00 0.00 178.15 178.63 1vld h ALA 372 N 0.62 0.13 -0.38 1.87 0.00 -0.68 0.14 119.26 120.97 1vld h ALA 372 Ca 0.01 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1vld h ALA 372 Cb 0.99 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1vld h ALA 372 CO 0.09 -0.47 0.22 -0.07 0.00 0.00 0.00 179.25 179.03 1vld h LEU 373 N 0.02 0.46 -1.14 0.00 4.07 -1.43 0.21 115.31 117.49 1vld h LEU 373 Ca 0.09 -0.06 -0.04 0.00 0.08 0.00 0.00 57.88 57.95 1vld h LEU 373 Cb 0.13 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 41.73 1vld h LEU 373 CO -0.18 0.39 0.16 0.00 -1.08 0.00 0.00 178.44 177.73 1vld h ALA 374 N 1.09 1.31 -0.19 1.53 0.00 -1.16 -2.34 119.26 119.50 1vld h ALA 374 Ca 0.14 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1vld h ALA 374 Cb 0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1vld h ALA 374 CO -0.02 0.50 -0.04 1.15 0.00 0.00 0.00 179.25 180.83 1vld h THR 375 N 0.75 1.28 0.00 0.00 2.02 -0.03 -1.51 112.91 115.42 1vld h THR 375 Ca 0.17 -0.99 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 1vld h THR 375 Cb 0.22 1.54 -0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1vld h THR 375 CO -0.01 0.30 -0.05 0.24 0.37 0.00 0.00 175.52 176.37 1vld h MET 376 N 0.09 0.00 -0.02 6.66 2.07 -0.36 -0.90 114.93 122.47 1vld h MET 376 Ca 0.05 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.68 1vld h MET 376 Cb 0.47 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.20 1vld h MET 376 CO 0.02 0.05 -0.04 1.04 1.07 0.00 0.00 176.91 179.05 1vld n GLN 377 N -3.85 1.69 -2.17 1.72 1.13 -0.91 -0.99 117.38 114.01 1vld n GLN 377 Ca -0.03 -1.10 -0.04 0.00 -1.94 0.00 0.00 57.00 53.90 1vld n GLN 377 Cb 0.15 -1.48 0.02 0.00 0.11 0.00 0.00 30.24 29.04 1vld n GLN 377 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1vld n GLY 378 N 1.23 0.32 3.68 1.08 0.00 -0.34 -4.78 105.19 106.38 1vld n GLY 378 Ca 0.17 -0.22 -0.44 0.00 0.00 0.00 0.00 46.02 45.53 1vld n GLY 378 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1vld n MET 379 N -1.83 2.08 0.00 1.61 0.00 -0.60 -2.82 117.12 115.55 1vld n MET 379 Ca -0.05 0.74 0.00 0.00 0.00 0.00 0.00 57.70 58.39 1vld n MET 379 Cb 0.54 -2.38 0.00 0.00 0.00 0.00 0.00 33.22 31.38 1vld n MET 379 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1vld n GLY 380 N 1.81 2.27 3.83 3.17 0.00 -0.26 -4.45 105.19 111.57 1vld n GLY 380 Ca 0.10 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 1vld n GLY 380 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vld s LYS 381 N 0.00 2.40 0.08 1.61 -2.85 -1.13 -4.02 119.74 115.84 1vld s LYS 381 Ca 0.00 0.61 -0.33 0.00 -1.00 0.00 0.00 55.97 55.25 1vld s LYS 381 Cb 0.00 -1.96 -0.12 0.00 -2.06 0.00 0.00 37.83 33.69 1vld s LYS 381 CO 0.00 -1.39 1.75 -2.30 0.10 0.00 0.00 175.35 173.51 1vld n PRO 382 N -3.27 2.40 -0.92 1.78 -0.02 -1.26 -2.08 135.00 131.63 1vld n PRO 382 Ca 0.07 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 1vld n PRO 382 Cb 0.56 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1vld n PRO 382 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vld n GLY 383 N 3.98 0.73 2.82 -1.23 0.00 -1.26 -5.01 105.19 105.22 1vld n GLY 383 Ca 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 1vld n GLY 383 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vld s SER 384 N -2.45 0.96 0.02 1.61 0.15 -0.88 -2.68 113.70 110.42 1vld s SER 384 Ca 0.00 0.17 -0.19 0.00 0.70 0.00 0.00 55.95 56.64 1vld s SER 384 Cb 0.00 0.31 0.06 0.00 -1.71 0.00 0.00 66.02 64.68 1vld s SER 384 CO 0.00 -0.27 0.86 -3.20 1.20 0.00 0.00 173.24 171.83 1vld n ASN 385 N 5.32 -0.94 -4.26 5.45 2.85 -1.25 -1.10 115.26 121.33 1vld n ASN 385 Ca -0.05 -1.29 -0.39 0.00 -0.11 0.00 0.00 54.58 52.73 1vld n ASN 385 Cb 0.50 1.48 -0.10 0.00 1.24 0.00 0.00 39.78 42.90 1vld n ASN 385 CO 0.00 0.00 0.00 -0.32 -2.11 0.00 0.00 177.26 174.83 1vld s MET 386 N -2.02 2.55 -0.02 1.20 -2.45 -1.26 -1.12 119.30 116.19 1vld s MET 386 Ca 0.20 -1.45 0.00 0.00 -1.25 0.00 0.00 55.69 53.19 1vld s MET 386 Cb -0.01 -3.72 0.02 0.00 1.25 0.00 0.00 34.83 32.38 1vld s MET 386 CO 0.01 -0.92 0.01 -0.46 1.05 0.00 0.00 175.02 174.70 1vld s TRP 387 N 1.39 0.12 -1.07 4.11 -0.00 -0.83 -4.89 118.94 117.76 1vld s TRP 387 Ca 0.03 0.06 0.18 0.00 -0.00 0.00 0.00 56.10 56.36 1vld s TRP 387 Cb -0.22 -0.23 0.65 0.00 -0.00 0.00 0.00 33.47 33.67 1vld s TRP 387 CO 0.02 -0.07 1.56 0.43 -0.00 0.00 0.00 176.95 178.88 1vld n SER 388 N 3.84 4.42 0.00 5.86 7.64 -1.26 -3.10 113.62 131.02 1vld n SER 388 Ca -0.23 -2.42 0.00 0.00 1.01 0.00 0.00 58.87 57.23 1vld n SER 388 Cb 0.53 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1vld n SER 388 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1vld n THR 389 N 0.94 0.00 0.04 0.44 -2.24 -1.26 -4.77 114.28 107.43 1vld n THR 389 Ca 0.24 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.83 1vld n THR 389 Cb 0.82 -0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.73 1vld n THR 389 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1vld h THR 390 N 0.00 0.94 -0.68 4.28 1.35 -1.86 -3.47 112.91 113.47 1vld h THR 390 Ca 0.00 -2.61 -0.57 0.00 -0.55 0.00 0.00 66.41 62.68 1vld h THR 390 Cb 0.00 2.66 -0.05 0.00 -1.73 0.00 0.00 68.15 69.03 1vld h THR 390 CO 0.00 0.81 -0.31 -1.10 -0.25 0.00 0.00 175.52 174.67 1vld s GLN 391 N -2.59 2.27 0.00 4.72 -0.21 -1.26 -4.28 119.66 118.31 1vld s GLN 391 Ca -0.13 -1.96 0.00 0.00 0.02 0.00 0.00 55.36 53.28 1vld s GLN 391 Cb 0.07 -2.14 0.00 0.00 1.00 0.00 0.00 33.01 31.94 1vld s GLN 391 CO 0.83 -0.58 0.00 0.41 -2.12 0.00 0.00 175.29 173.83 1vld n GLY 392 N -1.75 0.75 3.76 3.09 0.00 -1.25 -4.36 105.19 105.43 1vld n GLY 392 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1vld n GLY 392 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vld s VAL 393 N -2.00 2.22 -0.00 1.61 1.01 -1.22 -1.97 120.40 120.05 1vld s VAL 393 Ca 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 1vld s VAL 393 Cb 0.00 -3.13 -0.08 0.00 0.00 0.00 0.00 36.38 33.17 1vld s VAL 393 CO 0.00 0.04 1.47 -2.65 0.00 0.00 0.00 175.10 173.96 1vld n PRO 394 N 1.26 0.62 -1.94 2.72 -0.02 -1.26 -4.70 135.00 131.68 1vld n PRO 394 Ca 0.04 -0.31 -0.29 0.00 -2.02 0.00 0.00 63.50 60.91 1vld n PRO 394 Cb 0.39 -1.66 0.13 0.00 -0.02 0.00 0.00 33.50 32.34 1vld n PRO 394 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1vld s LEU 395 N 0.00 2.61 -0.84 2.45 1.43 -1.26 -4.75 118.68 118.32 1vld s LEU 395 Ca 0.21 0.53 -0.23 0.00 -1.03 0.00 0.00 54.13 53.61 1vld s LEU 395 Cb 0.10 -2.84 0.07 0.00 0.03 0.00 0.00 46.19 43.54 1vld s LEU 395 CO -0.00 -2.24 1.22 -0.62 0.23 0.00 0.00 176.35 174.94 1vld s ASP 396 N -4.71 6.36 0.45 2.29 3.68 -1.26 -4.83 116.67 118.65 1vld s ASP 396 Ca 0.67 -1.20 0.31 0.00 2.13 0.00 0.00 52.55 54.46 1vld s ASP 396 Cb -0.08 -2.49 1.37 0.00 -1.45 0.00 0.00 42.92 40.26 1vld s ASP 396 CO 0.50 -1.49 1.92 1.88 0.13 0.00 0.00 175.17 178.12 1vld h TYR 397 N 9.60 0.00 0.00 -5.34 0.99 -1.96 -2.65 116.97 117.61 1vld h TYR 397 Ca -0.06 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.55 1vld h TYR 397 Cb 1.04 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 38.75 1vld h TYR 397 CO 1.14 0.00 -0.58 0.93 -0.00 0.00 0.00 178.16 179.65 1vld h GLU 398 N 0.00 0.00 -6.70 4.88 5.08 -2.01 -3.44 114.58 112.39 1vld h GLU 398 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 1vld h GLU 398 Cb 0.36 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.63 1vld h GLU 398 CO 0.00 0.58 0.51 0.12 -1.00 0.00 0.00 179.01 179.22 1vld s PHE 399 N -3.13 3.52 -0.17 4.33 5.36 -1.00 -5.03 117.98 121.86 1vld s PHE 399 Ca 0.02 1.55 -0.00 0.00 -0.96 0.00 0.00 56.93 57.54 1vld s PHE 399 Cb 0.09 -3.34 0.00 0.00 -0.34 0.00 0.00 43.02 39.43 1vld s PHE 399 CO 0.75 -0.84 -0.15 -0.47 -1.46 0.00 0.00 175.22 173.04 1vld s TYR 400 N -0.40 2.80 -0.05 10.12 5.04 -1.26 -5.02 117.35 128.58 1vld s TYR 400 Ca 0.49 -1.15 -0.02 0.00 -2.44 0.00 0.00 57.07 53.96 1vld s TYR 400 Cb -0.31 -1.92 0.04 0.00 0.35 0.00 0.00 41.96 40.11 1vld s TYR 400 CO 0.37 -0.55 0.10 0.12 -1.34 0.00 0.00 175.55 174.26 1vld s PHE 401 N 0.99 -0.08 0.80 4.97 5.36 -1.26 -2.12 117.98 126.64 1vld s PHE 401 Ca -0.02 0.38 -0.14 0.00 -0.96 0.00 0.00 56.93 56.19 1vld s PHE 401 Cb -0.15 -0.21 0.08 0.00 -0.34 0.00 0.00 43.02 42.40 1vld s PHE 401 CO -0.03 -0.17 1.18 -2.30 -1.46 0.00 0.00 175.22 172.44 1vld n PRO 402 N 4.55 0.21 -3.55 10.12 -0.02 -1.26 -5.06 135.00 139.99 1vld n PRO 402 Ca -0.20 0.15 -0.21 0.00 -2.02 0.00 0.00 63.50 61.22 1vld n PRO 402 Cb 0.51 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.54 1vld n PRO 402 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1vld s GLY 403 N -2.07 2.14 0.36 -1.23 0.00 -1.26 -4.76 107.32 100.49 1vld s GLY 403 Ca 0.73 -1.84 0.13 0.00 0.00 0.00 0.00 44.72 43.75 1vld s GLY 403 CO 0.51 -1.71 1.80 0.10 0.00 0.00 0.00 173.10 173.80 1vld h TYR 404 N 0.95 0.00 0.00 1.90 -0.00 -1.49 -2.50 116.97 115.83 1vld h TYR 404 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.33 1vld h TYR 404 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.00 1vld h TYR 404 CO 0.55 0.40 0.00 0.00 -0.00 0.00 0.00 178.16 179.10 1vld h ALA 405 N 1.60 1.00 0.00 0.10 0.00 -1.71 -2.84 119.26 117.41 1vld h ALA 405 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vld h ALA 405 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1vld h ALA 405 CO 0.05 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.69 1vld n GLU 406 N -2.74 0.85 0.00 0.00 1.02 -0.94 0.31 120.64 119.14 1vld n GLU 406 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1vld n GLU 406 Cb 0.17 -1.14 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 1vld n GLU 406 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vld n GLY 407 N 0.45 2.18 7.00 0.62 0.00 -1.07 -2.64 105.19 111.73 1vld n GLY 407 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1vld n GLY 407 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vld n GLY 408 N -2.00 2.59 1.54 -0.02 0.00 -1.26 -1.53 105.19 104.51 1vld n GLY 408 Ca 0.00 0.35 0.09 0.00 0.00 0.00 0.00 46.02 46.46 1vld n GLY 408 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1vld n ILE 409 N 0.00 1.75 -0.09 -0.61 -5.35 -1.26 -4.40 119.36 109.39 1vld n ILE 409 Ca 0.00 -1.12 -0.11 0.00 -0.27 0.00 0.00 62.75 61.25 1vld n ILE 409 Cb 0.00 0.09 -0.12 0.00 -1.74 0.00 0.00 39.64 37.87 1vld n ILE 409 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1vld n SER 410 N 1.07 1.45 -1.38 7.28 3.41 -0.58 -4.77 113.62 120.09 1vld n SER 410 Ca 0.25 -0.05 -0.17 0.00 -0.26 0.00 0.00 58.87 58.64 1vld n SER 410 Cb 0.86 0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 65.15 1vld n SER 410 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vld n GLY 411 N 2.17 1.49 3.55 5.00 0.00 -1.25 -0.21 105.19 115.95 1vld n GLY 411 Ca -0.32 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.15 1vld n GLY 411 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vld s ASP 412 N -2.76 5.37 0.34 1.61 -1.08 -1.26 -4.69 116.67 114.20 1vld s ASP 412 Ca 0.00 -0.06 0.26 0.00 -0.52 0.00 0.00 52.55 52.23 1vld s ASP 412 Cb 0.00 -2.54 1.11 0.00 -1.46 0.00 0.00 42.92 40.03 1vld s ASP 412 CO 0.00 -2.39 1.79 0.00 0.52 0.00 0.00 175.17 175.09 1vld n GLU 414 N -2.45 0.65 -0.04 0.00 2.13 -1.26 -4.34 120.64 115.32 1vld n GLU 414 Ca 0.01 0.07 0.05 0.00 0.66 0.00 0.00 57.16 57.95 1vld n GLU 414 Cb 0.23 -1.67 0.07 0.00 0.27 0.00 0.00 31.44 30.34 1vld n GLU 414 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1vld n ASN 415 N -2.72 2.11 -3.75 4.31 3.02 -1.19 -5.01 115.26 112.03 1vld n ASN 415 Ca -0.15 -1.58 -0.18 0.00 -0.03 0.00 0.00 54.58 52.64 1vld n ASN 415 Cb 0.87 -0.06 -0.09 0.00 -0.61 0.00 0.00 39.78 39.89 1vld n ASN 415 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1vld s SER 416 N -0.88 1.39 -0.02 6.41 1.04 -0.88 -5.03 113.70 115.74 1vld s SER 416 Ca 0.14 -1.62 0.11 0.00 0.48 0.00 0.00 55.95 55.06 1vld s SER 416 Cb 0.09 0.47 0.36 0.00 0.10 0.00 0.00 66.02 67.04 1vld s SER 416 CO 0.13 -0.96 1.27 0.00 0.98 0.00 0.00 173.24 174.65 1vld n ALA 417 N -0.56 2.56 -0.30 5.32 0.00 0.15 -4.39 120.51 123.29 1vld n ALA 417 Ca 0.04 -0.74 0.09 0.00 0.00 0.00 0.00 53.44 52.83 1vld n ALA 417 Cb 0.64 -0.98 0.25 0.00 0.00 0.00 0.00 19.45 19.35 1vld n ALA 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vld h ALA 418 N 3.61 1.35 0.00 0.00 0.00 -1.67 -1.10 119.26 121.45 1vld h ALA 418 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1vld h ALA 418 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1vld h ALA 418 CO 0.04 -0.12 0.01 0.41 0.00 0.00 0.00 179.25 179.59 1vld n GLY 419 N -1.33 -0.30 0.07 0.00 0.00 -1.26 -1.97 105.19 100.40 1vld n GLY 419 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 1vld n GLY 419 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1vld h PHE 420 N 0.00 0.00 0.00 1.61 3.57 -1.55 -3.48 116.94 117.09 1vld h PHE 420 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1vld h PHE 420 Cb 0.02 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.76 1vld h PHE 420 CO 0.00 0.93 0.00 1.17 -2.23 0.00 0.00 178.31 178.18 1vld n LYS 421 N -4.60 0.00 0.27 1.11 4.81 -1.12 -4.99 118.16 113.63 1vld n LYS 421 Ca -0.12 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.16 1vld n LYS 421 Cb 0.45 -0.15 -0.08 0.00 0.02 0.00 0.00 35.03 35.26 1vld n LYS 421 CO 0.00 0.00 0.00 0.35 1.17 0.00 0.00 177.40 178.92 1vld h PHE 422 N 0.00 -0.58 -0.98 5.64 3.57 -1.84 -2.82 116.94 119.94 1vld h PHE 422 Ca 0.00 -0.01 0.32 0.00 3.53 0.00 0.00 57.97 61.81 1vld h PHE 422 Cb 0.00 0.19 -0.16 0.00 2.79 0.00 0.00 35.95 38.77 1vld h PHE 422 CO 0.00 -0.35 0.46 0.00 -2.23 0.00 0.00 178.31 176.19 1vld h ALA 423 N -0.09 1.82 0.00 2.41 0.00 -1.66 0.96 119.26 122.70 1vld h ALA 423 Ca -0.06 0.23 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1vld h ALA 423 Cb 0.48 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1vld h ALA 423 CO 0.10 -0.64 -0.27 -1.49 0.00 0.00 0.00 179.25 176.95 1vld h TRP 424 N 0.21 0.00 0.09 0.00 -0.00 -1.73 -2.09 115.95 112.43 1vld h TRP 424 Ca 0.72 0.00 -0.33 0.00 -0.00 0.00 0.00 58.89 59.28 1vld h TRP 424 Cb 1.67 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 30.80 1vld h TRP 424 CO -0.09 0.27 -1.78 0.00 -0.00 0.00 0.00 178.44 176.84 1vld h ARG 425 N 0.00 0.18 -0.06 0.49 3.08 0.94 -3.40 114.38 115.60 1vld h ARG 425 Ca -0.00 -0.31 -0.21 0.00 0.07 0.00 0.00 59.98 59.53 1vld h ARG 425 Cb 0.55 0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.73 1vld h ARG 425 CO 0.04 0.96 -0.78 1.98 -1.07 0.00 0.00 179.97 181.10 1vld h MET 426 N 0.05 0.63 -6.23 0.04 4.05 -0.63 -3.44 114.93 109.39 1vld h MET 426 Ca -0.33 -0.60 -0.66 0.00 -0.28 0.00 0.00 59.70 57.83 1vld h MET 426 Cb 2.02 0.15 -0.13 0.00 -0.80 0.00 0.00 31.60 32.84 1vld h MET 426 CO 0.11 1.21 -0.65 -0.06 0.23 0.00 0.00 176.91 177.74 1vld s PHE 427 N -3.47 3.04 -0.69 1.39 0.40 -0.79 -4.96 117.98 112.90 1vld s PHE 427 Ca -0.11 0.04 0.06 0.00 -0.60 0.00 0.00 56.93 56.31 1vld s PHE 427 Cb 0.06 -1.62 0.04 0.00 0.51 0.00 0.00 43.02 42.01 1vld s PHE 427 CO 0.88 0.46 0.66 -0.40 0.70 0.00 0.00 175.22 177.52 1vld n ASP 428 N 1.08 1.41 -2.09 1.36 5.68 -1.25 -4.76 116.55 117.98 1vld n ASP 428 Ca -0.13 -1.20 -0.20 0.00 -0.50 0.00 0.00 54.79 52.76 1vld n ASP 428 Cb 0.52 0.06 -0.02 0.00 -1.14 0.00 0.00 41.12 40.53 1vld n ASP 428 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vld n GLY 429 N 0.37 0.01 1.93 6.12 0.00 -1.25 -4.77 105.19 107.60 1vld n GLY 429 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1vld n GLY 429 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vld n LYS 430 N -2.80 0.00 -0.04 1.61 5.02 -1.26 -5.00 118.16 115.69 1vld n LYS 430 Ca -0.23 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.02 1vld n LYS 430 Cb 0.67 -0.04 -0.05 0.00 -0.02 0.00 0.00 35.03 35.60 1vld n LYS 430 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1vld n THR 431 N -3.15 0.47 -5.09 -0.18 -2.24 -1.26 -5.02 114.28 97.81 1vld n THR 431 Ca 0.00 -0.24 -0.32 0.00 -2.27 0.00 0.00 64.05 61.22 1vld n THR 431 Cb 0.01 -0.81 -0.15 0.00 -2.10 0.00 0.00 70.33 67.28 1vld n THR 431 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1vld s THR 432 N -2.16 2.57 0.09 4.28 -1.32 -1.26 -5.08 115.64 112.76 1vld s THR 432 Ca -0.07 -0.91 0.05 0.00 -1.21 0.00 0.00 61.69 59.55 1vld s THR 432 Cb 0.02 -1.96 -0.03 0.00 -1.51 0.00 0.00 72.50 69.02 1vld s THR 432 CO 0.24 0.58 -0.12 -0.36 -2.21 0.00 0.00 174.62 172.75 1vld s PHE 433 N -0.58 1.18 0.91 9.09 0.40 -1.26 -3.76 117.98 123.97 1vld s PHE 433 Ca 0.08 -0.56 -0.13 0.00 -0.60 0.00 0.00 56.93 55.72 1vld s PHE 433 Cb -0.11 -0.64 0.14 0.00 0.51 0.00 0.00 43.02 42.92 1vld s PHE 433 CO 0.00 0.05 1.18 -2.14 0.70 0.00 0.00 175.22 175.02 1vld s PRO 434 N -2.37 1.10 -0.47 0.24 0.02 -1.26 -5.00 135.00 127.25 1vld s PRO 434 Ca 0.03 0.09 0.03 0.00 0.02 0.00 0.00 61.00 61.17 1vld s PRO 434 Cb -0.06 -1.85 0.14 0.00 0.02 0.00 0.00 34.50 32.74 1vld s PRO 434 CO 0.02 -2.19 0.25 0.45 -0.33 0.00 0.00 177.00 175.20 1vld s SER 435 N -4.31 3.86 0.60 2.53 0.15 0.71 -5.02 113.70 112.22 1vld s SER 435 Ca 0.66 -2.79 -0.12 0.00 0.70 0.00 0.00 55.95 54.40 1vld s SER 435 Cb -0.11 -1.23 -0.05 0.00 -1.71 0.00 0.00 66.02 62.92 1vld s SER 435 CO 0.52 -0.25 1.02 -2.84 1.20 0.00 0.00 173.24 172.90 1vld s PRO 436 N 0.10 3.64 -0.09 5.44 0.02 -1.26 -4.42 135.00 138.42 1vld s PRO 436 Ca 0.18 0.81 0.04 0.00 0.02 0.00 0.00 61.00 62.05 1vld s PRO 436 Cb -0.24 -2.09 -0.00 0.00 0.02 0.00 0.00 34.50 32.19 1vld s PRO 436 CO -0.01 -0.53 -0.23 0.45 -0.33 0.00 0.00 177.00 176.35 1vld s SER 437 N -3.92 3.00 -0.10 2.53 0.15 -1.26 -4.71 113.70 109.39 1vld s SER 437 Ca 0.56 -0.54 0.16 0.00 0.70 0.00 0.00 55.95 56.83 1vld s SER 437 Cb -0.11 -1.30 0.55 0.00 -1.71 0.00 0.00 66.02 63.46 1vld s SER 437 CO 0.49 0.16 1.47 -0.46 1.20 0.00 0.00 173.24 176.10 1vld n ASN 438 N 3.46 4.02 0.00 5.45 6.94 -1.26 -4.45 115.26 129.42 1vld n ASN 438 Ca -0.19 -2.49 0.00 0.00 -0.02 0.00 0.00 54.58 51.88 1vld n ASN 438 Cb 0.53 -0.47 0.00 0.00 -2.36 0.00 0.00 39.78 37.48 1vld n ASN 438 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1vld n LEU 439 N 0.49 2.42 -3.74 -4.53 4.77 -1.26 -4.66 117.00 110.49 1vld n LEU 439 Ca 0.21 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.77 1vld n LEU 439 Cb 0.76 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.85 1vld n LEU 439 CO 0.17 0.40 2.47 -3.20 -1.33 0.00 0.00 177.39 175.90 1vld n ASN 440 N -2.55 4.68 -3.60 -1.43 5.15 -1.26 -0.75 115.26 115.50 1vld n ASN 440 Ca 0.00 -2.93 -0.15 0.00 -0.60 0.00 0.00 54.58 50.91 1vld n ASN 440 Cb 0.48 -1.58 -0.06 0.00 -0.53 0.00 0.00 39.78 38.09 1vld n ASN 440 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1vld s THR 441 N 2.05 0.03 0.32 -0.44 -1.32 -1.26 -4.90 115.64 110.12 1vld s THR 441 Ca 0.46 -0.23 0.08 0.00 -1.21 0.00 0.00 61.69 60.78 1vld s THR 441 Cb 0.13 -0.92 0.35 0.00 -1.51 0.00 0.00 72.50 70.55 1vld s THR 441 CO -0.06 -0.13 1.61 0.28 -2.21 0.00 0.00 174.62 174.12 1vld h SER 442 N 3.05 0.01 1.09 8.08 0.02 -1.98 0.74 113.55 124.56 1vld h SER 442 Ca -0.30 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1vld h SER 442 Cb 1.19 0.31 0.00 0.00 0.14 0.00 0.00 62.40 64.04 1vld h SER 442 CO 0.41 -0.27 0.00 0.00 -1.14 0.00 0.00 176.83 175.83 1vld n ALA 443 N -2.67 2.21 -1.51 3.77 0.00 -1.26 -4.72 120.51 116.33 1vld n ALA 443 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1vld n ALA 443 Cb 0.87 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1vld n ALA 443 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vld n GLY 444 N 1.20 0.68 3.21 0.00 0.00 0.26 -5.01 105.19 105.53 1vld n GLY 444 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 1vld n GLY 444 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1vld s GLN 445 N 1.87 0.36 0.30 1.61 0.74 0.07 -4.83 119.66 119.76 1vld s GLN 445 Ca 0.00 0.61 -0.08 0.00 0.05 0.00 0.00 55.36 55.94 1vld s GLN 445 Cb 0.00 0.05 0.00 0.00 1.10 0.00 0.00 33.01 34.16 1vld s GLN 445 CO 0.00 -0.11 0.47 -3.38 -0.55 0.00 0.00 175.29 171.72 1vld s HIS 446 N 0.87 0.71 0.03 1.67 -3.43 -1.26 -3.92 115.29 109.95 1vld s HIS 446 Ca -0.06 -1.03 -0.02 0.00 -0.80 0.00 0.00 55.06 53.16 1vld s HIS 446 Cb -0.06 0.06 -0.02 0.00 -1.43 0.00 0.00 32.58 31.12 1vld s HIS 446 CO -0.06 -1.07 -0.00 0.96 -2.00 0.00 0.00 174.74 172.56 1vld s ILE 447 N -3.48 0.14 0.17 -5.38 -4.36 -0.39 -4.88 121.20 103.01 1vld s ILE 447 Ca 0.27 -1.17 -0.30 0.00 -0.26 0.00 0.00 60.65 59.19 1vld s ILE 447 Cb -0.00 -0.71 -0.07 0.00 1.25 0.00 0.00 42.46 42.92 1vld s ILE 447 CO 0.14 -0.65 1.15 -2.84 0.24 0.00 0.00 174.94 172.99 1vld s PRO 448 N -2.31 4.53 0.13 0.37 0.02 -1.26 -1.64 135.00 134.85 1vld s PRO 448 Ca -0.08 1.78 -0.20 0.00 0.02 0.00 0.00 61.00 62.52 1vld s PRO 448 Cb -0.04 -3.27 -0.01 0.00 0.02 0.00 0.00 34.50 31.20 1vld s PRO 448 CO -0.04 -0.03 1.69 -0.09 -0.33 0.00 0.00 177.00 178.20 1vld h ARG 449 N 5.37 -0.06 0.00 5.54 2.43 -1.45 -1.53 114.38 124.67 1vld h ARG 449 Ca -0.44 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1vld h ARG 449 Cb 1.21 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1vld h ARG 449 CO 0.74 -0.04 0.21 -0.07 -1.51 0.00 0.00 179.97 179.30 1vld h LEU 450 N -0.06 0.00 -2.93 3.80 3.38 -1.92 -2.53 115.31 115.05 1vld h LEU 450 Ca 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1vld h LEU 450 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1vld h LEU 450 CO -0.24 0.00 -0.22 0.29 0.09 0.00 0.00 178.44 178.36 1vld n LYS 451 N -2.84 1.23 -0.20 1.13 4.76 -0.61 -4.77 118.16 116.86 1vld n LYS 451 Ca -0.02 -2.66 -0.03 0.00 -2.87 0.00 0.00 58.31 52.73 1vld n LYS 451 Cb 0.26 -1.41 0.07 0.00 -1.84 0.00 0.00 35.03 32.11 1vld n LYS 451 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1vld h ILE 452 N 1.05 0.98 -0.37 -0.18 2.04 -1.12 -2.39 117.51 117.53 1vld h ILE 452 Ca -0.01 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.71 1vld h ILE 452 Cb 1.06 0.30 -0.07 0.00 -0.74 0.00 0.00 36.82 37.37 1vld h ILE 452 CO 0.00 0.11 -0.10 -0.65 0.00 0.00 0.00 178.15 177.52 1vld h PRO 453 N 0.63 -0.01 -0.37 2.37 0.11 -1.86 -1.22 132.00 131.65 1vld h PRO 453 Ca 0.26 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.32 1vld h PRO 453 Cb 0.14 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.23 1vld h PRO 453 CO -0.16 -0.01 -0.00 0.93 -0.21 0.00 0.00 178.00 178.55 1vld h GLU 454 N -0.01 0.58 -0.47 1.05 3.07 -1.88 -1.40 114.58 115.52 1vld h GLU 454 Ca 0.18 -0.13 -0.14 0.00 -0.50 0.00 0.00 59.36 58.77 1vld h GLU 454 Cb 0.29 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 1vld h GLU 454 CO -0.39 0.61 -0.25 0.00 -1.40 0.00 0.00 179.01 177.58 1vld h ILE 456 N 0.85 0.82 -0.19 0.00 2.04 -1.02 0.27 117.51 120.28 1vld h ILE 456 Ca 0.10 -1.02 -0.14 0.00 1.00 0.00 0.00 64.86 64.80 1vld h ILE 456 Cb 0.83 1.34 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 1vld h ILE 456 CO 0.07 0.20 -0.42 0.24 0.00 0.00 0.00 178.15 178.24 1vld h MET 457 N -0.84 0.61 0.20 2.37 2.86 -1.35 -3.31 114.93 115.48 1vld h MET 457 Ca -0.03 -0.41 -0.32 0.00 -2.06 0.00 0.00 59.70 56.89 1vld h MET 457 Cb 0.52 0.06 0.03 0.00 0.06 0.00 0.00 31.60 32.27 1vld h MET 457 CO 0.04 1.03 -1.38 0.78 1.06 0.00 0.00 176.91 178.44 1vld h GLY 458 N 0.29 0.57 -0.12 8.32 0.00 -0.42 -3.48 103.07 108.22 1vld h GLY 458 Ca 0.00 -1.39 -0.03 0.00 0.00 0.00 0.00 47.33 45.91 1vld h GLY 458 CO 0.09 1.22 -0.03 0.61 0.00 0.00 0.00 176.54 178.43 1vld n GLY 459 N 1.60 0.45 3.62 4.60 0.00 0.94 -5.00 105.19 111.39 1vld n GLY 459 Ca -0.14 -0.96 -0.06 0.00 0.00 0.00 0.00 46.02 44.85 1vld n GLY 459 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vld s LYS 460 N -2.68 0.33 -0.13 1.61 2.20 -1.24 -4.55 119.74 115.28 1vld s LYS 460 Ca 0.00 0.14 -0.31 0.00 -0.36 0.00 0.00 55.97 55.44 1vld s LYS 460 Cb 0.00 0.16 0.13 0.00 -1.51 0.00 0.00 37.83 36.60 1vld s LYS 460 CO 0.00 -0.09 1.04 0.12 -0.36 0.00 0.00 175.35 176.06 1vld s PHE 461 N -0.79 -0.28 -0.00 4.03 5.36 -0.53 -4.56 117.98 121.21 1vld s PHE 461 Ca 0.04 0.33 0.01 0.00 -0.96 0.00 0.00 56.93 56.34 1vld s PHE 461 Cb -0.02 0.50 -0.00 0.00 -0.34 0.00 0.00 43.02 43.16 1vld s PHE 461 CO -0.05 -0.35 -0.03 -1.14 -1.46 0.00 0.00 175.22 172.19 1vld s GLN 462 N -2.06 0.28 0.27 10.12 -0.44 -1.26 0.65 119.66 127.22 1vld s GLN 462 Ca 0.04 -0.12 -0.09 0.00 -2.50 0.00 0.00 55.36 52.69 1vld s GLN 462 Cb -0.01 -0.27 0.04 0.00 -1.64 0.00 0.00 33.01 31.12 1vld s GLN 462 CO -0.04 0.07 0.52 -2.67 0.50 0.00 0.00 175.29 173.67 1vld n TRP 463 N 3.03 -1.85 -4.36 1.67 2.14 0.27 -4.98 117.44 113.37 1vld n TRP 463 Ca -0.13 -1.33 -0.30 0.00 2.07 0.00 0.00 57.50 57.81 1vld n TRP 463 Cb 0.59 0.61 -0.11 0.00 -0.81 0.00 0.00 31.31 31.59 1vld n TRP 463 CO 0.00 0.00 0.00 -1.12 2.07 0.00 0.00 177.69 178.64 1vld s SER 464 N -2.44 4.19 0.48 -0.67 0.01 -1.26 -0.54 113.70 113.47 1vld s SER 464 Ca 0.12 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.98 1vld s SER 464 Cb -0.03 -0.76 0.00 0.00 0.21 0.00 0.00 66.02 65.44 1vld s SER 464 CO 0.09 0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.56 1vld n GLY 465 N 0.99 -3.18 2.93 3.44 0.00 0.09 -4.76 105.19 104.70 1vld n GLY 465 Ca -0.15 -1.14 -0.30 0.00 0.00 0.00 0.00 46.02 44.44 1vld n GLY 465 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vld s LYS 466 N -3.96 1.65 3.40 1.61 2.20 -1.26 -4.87 119.74 118.50 1vld s LYS 466 Ca 0.00 -0.81 0.00 0.00 -0.36 0.00 0.00 55.97 54.80 1vld s LYS 466 Cb 0.00 -2.38 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 1vld s LYS 466 CO 0.00 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 174.89 1vld n GLY 467 N 4.74 3.01 3.47 5.54 0.00 -1.26 -3.67 105.19 117.02 1vld n GLY 467 Ca -0.13 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1vld n GLY 467 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vld s PHE 468 N 0.00 2.71 -1.37 1.61 0.40 -1.23 -4.42 117.98 115.68 1vld s PHE 468 Ca 0.00 -0.66 -0.16 0.00 -0.60 0.00 0.00 56.93 55.51 1vld s PHE 468 Cb 0.00 -4.34 0.06 0.00 0.51 0.00 0.00 43.02 39.25 1vld s PHE 468 CO 0.00 -1.68 1.95 0.00 0.70 0.00 0.00 175.22 176.20 1vld n ALA 469 N 7.72 4.54 0.52 5.36 0.00 -1.24 -4.69 120.51 132.72 1vld n ALA 469 Ca 0.03 -3.90 0.11 0.00 0.00 0.00 0.00 53.44 49.69 1vld n ALA 469 Cb 0.47 -3.53 0.16 0.00 0.00 0.00 0.00 19.45 16.55 1vld n ALA 469 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vld n GLY 470 N 4.65 1.37 0.16 0.00 0.00 -1.26 -4.52 105.19 105.59 1vld n GLY 470 Ca 0.49 -0.68 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 1vld n GLY 470 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vld h GLY 471 N 4.28 0.51 -2.37 -0.02 0.00 -1.83 -3.17 103.07 100.47 1vld h GLY 471 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 1vld h GLY 471 CO 0.00 0.29 -0.00 -0.35 0.00 0.00 0.00 176.54 176.47 1vld s ASP 472 N -5.83 -0.18 0.16 0.19 2.15 -1.26 -4.88 116.67 107.02 1vld s ASP 472 Ca -0.13 -0.69 -0.15 0.00 0.43 0.00 0.00 52.55 52.00 1vld s ASP 472 Cb 0.08 0.60 0.08 0.00 -0.30 0.00 0.00 42.92 43.39 1vld s ASP 472 CO 0.74 -1.13 1.76 0.40 -0.17 0.00 0.00 175.17 176.77 1vld h ILE 473 N 2.20 0.93 -0.01 4.11 2.04 -1.90 -2.99 117.51 121.89 1vld h ILE 473 Ca -0.26 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1vld h ILE 473 Cb 1.25 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 1vld h ILE 473 CO 0.34 0.06 -0.01 -1.20 0.00 0.00 0.00 178.15 177.35 1vld n SER 474 N -4.97 0.76 -0.25 1.72 7.64 -1.26 -4.07 113.62 113.19 1vld n SER 474 Ca 0.02 -1.20 0.05 0.00 1.01 0.00 0.00 58.87 58.75 1vld n SER 474 Cb 0.12 -0.00 0.29 0.00 -1.01 0.00 0.00 64.21 63.61 1vld n SER 474 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1vld h HIS 475 N 1.17 0.92 0.00 1.43 3.86 -1.84 -0.83 115.15 119.87 1vld h HIS 475 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1vld h HIS 475 Cb 0.27 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.43 1vld h HIS 475 CO 0.00 0.49 0.00 0.00 0.86 0.00 0.00 177.93 179.28 1vld n GLN 476 N -4.48 0.13 0.03 2.45 10.64 -1.26 -2.07 117.38 122.83 1vld n GLN 476 Ca 0.12 0.20 0.12 0.00 -1.83 0.00 0.00 57.00 55.61 1vld n GLN 476 Cb 0.21 -1.50 0.11 0.00 -0.86 0.00 0.00 30.24 28.20 1vld n GLN 476 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1vld n LEU 477 N -1.32 0.63 -4.78 2.61 4.77 -0.32 -2.12 117.00 116.48 1vld n LEU 477 Ca 0.05 0.04 -0.41 0.00 -0.03 0.00 0.00 56.01 55.65 1vld n LEU 477 Cb 0.09 -0.15 -0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1vld n LEU 477 CO 0.09 0.04 1.13 -2.28 -1.33 0.00 0.00 177.39 175.04 1vld s HIS 478 N -3.14 2.62 -0.03 -1.77 2.46 -0.88 -4.66 115.29 109.89 1vld s HIS 478 Ca 0.06 1.16 -0.15 0.00 0.47 0.00 0.00 55.06 56.61 1vld s HIS 478 Cb 0.15 -4.01 -0.05 0.00 -0.13 0.00 0.00 32.58 28.54 1vld s HIS 478 CO 0.76 -2.96 0.40 -0.65 -2.47 0.00 0.00 174.74 169.82 1vld s GLN 479 N -2.01 4.00 0.17 2.88 -1.52 -1.26 -0.73 119.66 121.18 1vld s GLN 479 Ca 0.53 0.38 0.04 0.00 -1.95 0.00 0.00 55.36 54.36 1vld s GLN 479 Cb -0.46 -3.27 -0.05 0.00 -0.22 0.00 0.00 33.01 29.01 1vld s GLN 479 CO 0.62 0.58 -0.07 0.71 -0.25 0.00 0.00 175.29 176.88 1vld s TYR 480 N -0.69 1.31 0.06 0.91 1.51 0.29 -4.97 117.35 115.77 1vld s TYR 480 Ca 0.23 -0.83 -0.07 0.00 -1.01 0.00 0.00 57.07 55.40 1vld s TYR 480 Cb -0.16 -0.70 -0.01 0.00 -0.11 0.00 0.00 41.96 40.98 1vld s TYR 480 CO 0.12 0.02 0.13 -1.83 -1.11 0.00 0.00 175.55 172.87 1vld s GLU 481 N -3.79 0.70 -0.04 -0.62 -1.05 -1.26 -0.56 118.70 112.07 1vld s GLU 481 Ca 0.20 -0.88 0.01 0.00 -0.15 0.00 0.00 54.97 54.15 1vld s GLU 481 Cb 0.04 0.28 0.02 0.00 -0.44 0.00 0.00 34.13 34.02 1vld s GLU 481 CO 0.03 -0.19 -0.06 -0.47 0.95 0.00 0.00 175.26 175.51 1vld s TYR 482 N -3.26 0.82 0.41 4.83 5.04 0.21 -2.97 117.35 122.42 1vld s TYR 482 Ca 0.00 -0.23 -0.24 0.00 -2.44 0.00 0.00 57.07 54.17 1vld s TYR 482 Cb 0.02 -0.67 -0.09 0.00 0.35 0.00 0.00 41.96 41.58 1vld s TYR 482 CO -0.08 -0.17 1.08 -1.25 -1.34 0.00 0.00 175.55 173.80 1vld s PRO 483 N 0.71 4.07 0.61 4.97 0.04 -1.26 -1.45 135.00 142.68 1vld s PRO 483 Ca -0.10 1.60 -0.19 0.00 0.04 0.00 0.00 61.00 62.34 1vld s PRO 483 Cb -0.13 -2.53 -0.02 0.00 0.04 0.00 0.00 34.50 31.86 1vld s PRO 483 CO 0.01 -0.24 1.32 0.00 0.04 0.00 0.00 177.00 178.12 1vld s ALA 484 N -1.61 2.54 -0.32 8.56 0.00 -1.16 -4.83 121.76 124.94 1vld s ALA 484 Ca 0.59 1.26 -0.41 0.00 0.00 0.00 0.00 51.96 53.39 1vld s ALA 484 Cb -0.24 -3.56 -0.16 0.00 0.00 0.00 0.00 23.12 19.16 1vld s ALA 484 CO 0.30 -1.51 1.77 -2.30 0.00 0.00 0.00 175.76 174.02 1vld n PRO 485 N -1.59 0.96 0.00 0.00 -0.02 -1.26 -1.05 135.00 132.04 1vld n PRO 485 Ca 0.14 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1vld n PRO 485 Cb 0.47 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1vld n PRO 485 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vld n GLY 486 N 4.45 2.70 3.97 -1.23 0.00 -1.26 -5.02 105.19 108.80 1vld n GLY 486 Ca 0.29 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.07 1vld n GLY 486 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vld s TYR 487 N -2.65 2.27 0.13 1.61 1.51 -0.21 -5.10 117.35 114.90 1vld s TYR 487 Ca 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 57.07 56.08 1vld s TYR 487 Cb 0.00 -3.04 -0.04 0.00 -0.11 0.00 0.00 41.96 38.77 1vld s TYR 487 CO 0.00 -1.45 0.27 0.45 -1.11 0.00 0.00 175.55 173.71 1vld s SER 488 N -4.60 6.35 0.54 2.29 0.15 -1.26 -4.77 113.70 112.40 1vld s SER 488 Ca 0.63 0.21 -0.18 0.00 0.70 0.00 0.00 55.95 57.30 1vld s SER 488 Cb -0.08 -1.93 -0.06 0.00 -1.71 0.00 0.00 66.02 62.24 1vld s SER 488 CO 0.43 0.08 1.07 -0.54 1.20 0.00 0.00 173.24 175.49 1vld s LYS 489 N -3.03 3.47 0.37 5.44 1.02 -1.26 -4.45 119.74 121.30 1vld s LYS 489 Ca 0.35 1.40 -0.28 0.00 0.02 0.00 0.00 55.97 57.45 1vld s LYS 489 Cb -0.12 -2.04 -0.10 0.00 -0.52 0.00 0.00 37.83 35.05 1vld s LYS 489 CO 0.28 -0.72 1.42 0.42 -0.92 0.00 0.00 175.35 175.84 1vld s ILE 490 N -2.07 2.28 0.00 2.17 -1.09 -1.26 -4.50 121.20 116.73 1vld s ILE 490 Ca 0.68 0.28 0.00 0.00 -2.23 0.00 0.00 60.65 59.38 1vld s ILE 490 Cb -0.19 -3.17 0.00 0.00 -1.58 0.00 0.00 42.46 37.52 1vld s ILE 490 CO 0.28 0.06 0.00 0.29 -1.23 0.00 0.00 174.94 174.34 1vld n LYS 491 N 0.48 2.25 -4.27 2.79 4.76 0.17 -4.80 118.16 119.54 1vld n LYS 491 Ca 0.01 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.22 1vld n LYS 491 Cb 0.40 -0.80 -0.12 0.00 -1.84 0.00 0.00 35.03 32.67 1vld n LYS 491 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 1vld s MET 492 N -1.60 1.08 -0.08 1.97 1.75 -0.95 -1.05 119.30 120.43 1vld s MET 492 Ca 0.00 -1.14 0.00 0.00 -1.25 0.00 0.00 55.69 53.30 1vld s MET 492 Cb 0.00 -1.29 0.02 0.00 2.84 0.00 0.00 34.83 36.40 1vld s MET 492 CO 0.00 0.30 -0.06 0.12 -0.65 0.00 0.00 175.02 174.73 1vld s PHE 493 N -1.24 1.11 -0.56 4.11 5.99 -0.40 -0.47 117.98 126.54 1vld s PHE 493 Ca 0.06 -0.44 -0.01 0.00 0.00 0.00 0.00 56.93 56.53 1vld s PHE 493 Cb -0.10 -0.97 0.14 0.00 0.00 0.00 0.00 43.02 42.10 1vld s PHE 493 CO 0.04 -0.35 0.35 -0.46 -0.00 0.00 0.00 175.22 174.80 1vld s TRP 494 N 1.37 3.41 0.24 10.12 -0.11 0.78 -0.62 118.94 134.12 1vld s TRP 494 Ca -0.03 -2.78 -0.25 0.00 1.22 0.00 0.00 56.10 54.26 1vld s TRP 494 Cb -0.14 -3.12 -0.09 0.00 -1.50 0.00 0.00 33.47 28.63 1vld s TRP 494 CO -0.03 -0.85 0.85 0.15 -4.62 0.00 0.00 176.95 172.45 1vld s LYS 495 N 0.11 4.57 -0.53 5.86 1.02 0.12 -2.73 119.74 128.16 1vld s LYS 495 Ca 0.15 1.22 0.04 0.00 0.02 0.00 0.00 55.97 57.40 1vld s LYS 495 Cb -0.22 -3.05 0.13 0.00 -0.52 0.00 0.00 37.83 34.18 1vld s LYS 495 CO -0.03 0.44 0.28 -0.47 -0.92 0.00 0.00 175.35 174.65 1vld s TYR 496 N -1.37 3.21 0.00 3.18 5.04 -1.07 -0.86 117.35 125.48 1vld s TYR 496 Ca 0.43 -3.15 0.00 0.00 -2.44 0.00 0.00 57.07 51.90 1vld s TYR 496 Cb -0.21 -2.85 0.00 0.00 0.35 0.00 0.00 41.96 39.25 1vld s TYR 496 CO 0.26 -0.74 0.00 0.41 -1.34 0.00 0.00 175.55 174.13 1vld n GLY 497 N 3.09 -4.16 2.71 8.97 0.00 -1.05 -4.14 105.19 110.62 1vld n GLY 497 Ca 0.06 -2.05 -0.07 0.00 0.00 0.00 0.00 46.02 43.96 1vld n GLY 497 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vld n GLY 498 N -0.12 -0.33 0.71 -0.02 0.00 -1.26 -4.84 105.19 99.33 1vld n GLY 498 Ca 0.00 0.37 0.10 0.00 0.00 0.00 0.00 46.02 46.49 1vld n GLY 498 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vld n PRO 499 N 0.86 1.74 -0.31 1.61 -0.04 -1.26 -1.03 135.00 136.58 1vld n PRO 499 Ca 0.03 -1.49 0.08 0.00 -0.04 0.00 0.00 63.50 62.08 1vld n PRO 499 Cb 0.70 -1.39 0.23 0.00 -0.04 0.00 0.00 33.50 33.00 1vld n PRO 499 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1vld h HIS 500 N 3.50 0.84 -0.81 0.54 3.86 -1.94 -1.39 115.15 119.74 1vld h HIS 500 Ca 0.00 0.03 0.22 0.00 -1.16 0.00 0.00 60.37 59.46 1vld h HIS 500 Cb 0.80 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.99 1vld h HIS 500 CO 0.00 0.22 0.57 -0.07 0.86 0.00 0.00 177.93 179.51 1vld h LEU 501 N 0.68 0.10 -2.92 2.43 3.38 -1.88 0.15 115.31 117.25 1vld h LEU 501 Ca 0.48 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.46 1vld h LEU 501 Cb 0.65 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1vld h LEU 501 CO -0.35 0.04 0.00 0.61 0.09 0.00 0.00 178.44 178.83 1vld n GLY 502 N -1.65 2.88 0.00 0.83 0.00 -0.60 -4.43 105.19 102.22 1vld n GLY 502 Ca 0.17 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1vld n GLY 502 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vld n THR 503 N 0.33 0.00 -0.00 2.61 -2.24 0.01 -1.17 114.28 113.82 1vld n THR 503 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1vld n THR 503 Cb 0.44 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 1vld n THR 503 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1vld n MET 504 N -0.93 3.47 -4.46 -0.78 2.81 0.32 -4.97 117.12 112.59 1vld n MET 504 Ca 0.00 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.68 1vld n MET 504 Cb 0.04 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 32.41 1vld n MET 504 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1vld s THR 505 N 2.63 1.04 -1.36 2.03 -4.23 -1.26 -4.81 115.64 109.69 1vld s THR 505 Ca 0.00 -0.77 -0.02 0.00 -1.18 0.00 0.00 61.69 59.73 1vld s THR 505 Cb 0.00 -0.91 0.02 0.00 1.34 0.00 0.00 72.50 72.94 1vld s THR 505 CO 0.00 0.14 0.04 0.00 -0.54 0.00 0.00 174.62 174.26 1vld n ALA 506 N 2.33 -1.81 0.00 3.99 0.00 -0.45 -4.74 120.51 119.84 1vld n ALA 506 Ca -0.16 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1vld n ALA 506 Cb 0.55 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.20 1vld n ALA 506 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vld n THR 507 N -4.05 1.08 0.27 0.00 -2.24 -1.09 -2.59 114.28 105.66 1vld n THR 507 Ca -0.25 0.45 0.09 0.00 -2.27 0.00 0.00 64.05 62.07 1vld n THR 507 Cb 0.59 -1.45 0.44 0.00 -2.10 0.00 0.00 70.33 67.80 1vld n THR 507 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1vld n ASN 508 N -1.25 0.46 0.06 3.42 3.02 -1.26 -1.08 115.26 118.62 1vld n ASN 508 Ca 0.00 0.66 -0.06 0.00 -0.03 0.00 0.00 54.58 55.15 1vld n ASN 508 Cb 0.18 -0.74 -0.10 0.00 -0.61 0.00 0.00 39.78 38.51 1vld n ASN 508 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 1vld h ARG 509 N 0.00 0.00 -0.21 3.52 0.11 -1.82 -2.71 114.38 113.26 1vld h ARG 509 Ca 0.00 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.95 1vld h ARG 509 Cb 0.17 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.24 1vld h ARG 509 CO 0.00 0.85 -0.40 1.88 0.10 0.00 0.00 179.97 182.41 1vld h TYR 510 N 0.00 0.58 -0.33 4.08 -1.99 -1.35 -2.60 116.97 115.36 1vld h TYR 510 Ca -0.05 -0.16 -0.17 0.00 2.00 0.00 0.00 58.73 60.35 1vld h TYR 510 Cb 1.75 -0.13 -0.00 0.00 2.00 0.00 0.00 36.73 40.35 1vld h TYR 510 CO 0.00 0.82 -0.45 0.00 -0.00 0.00 0.00 178.16 178.53 1vld h ALA 511 N 1.16 0.57 -0.12 3.88 0.00 -1.54 -3.23 119.26 119.98 1vld h ALA 511 Ca 0.04 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 1vld h ALA 511 Cb 0.87 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1vld h ALA 511 CO 0.07 0.68 -0.30 0.87 0.00 0.00 0.00 179.25 180.57 1vld h LYS 512 N 0.70 0.23 -0.41 0.00 1.57 -1.32 -3.19 116.57 114.13 1vld h LYS 512 Ca 0.04 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 1vld h LYS 512 Cb 1.04 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 1vld h LYS 512 CO 0.10 0.51 0.11 0.00 -0.57 0.00 0.00 179.45 179.61 1vld h MET 513 N 0.20 0.60 -0.34 3.15 -0.00 -1.48 -2.95 114.93 114.12 1vld h MET 513 Ca 0.03 -0.10 0.10 0.00 -0.00 0.00 0.00 59.70 59.73 1vld h MET 513 Cb 0.65 -0.10 -0.01 0.00 -0.00 0.00 0.00 31.60 32.13 1vld h MET 513 CO 0.05 0.55 0.30 1.88 -0.00 0.00 0.00 176.91 179.69 1vld h TYR 514 N 0.59 0.00 -0.49 -0.10 -1.99 -1.68 -0.93 116.97 112.37 1vld h TYR 514 Ca 0.14 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.87 1vld h TYR 514 Cb 0.21 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.94 1vld h TYR 514 CO 0.01 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.42 1vld n THR 515 N -4.00 0.65 -2.53 -2.88 -2.24 -1.11 -4.81 114.28 97.35 1vld n THR 515 Ca 0.05 -0.72 -0.42 0.00 -2.27 0.00 0.00 64.05 60.69 1vld n THR 515 Cb 0.47 0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 69.19 1vld n THR 515 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1vld s HIS 516 N -1.35 3.46 -2.00 4.78 5.04 -0.36 -4.10 115.29 120.77 1vld s HIS 516 Ca 0.38 1.42 0.05 0.00 -1.54 0.00 0.00 55.06 55.37 1vld s HIS 516 Cb 0.21 -3.32 0.31 0.00 0.04 0.00 0.00 32.58 29.82 1vld s HIS 516 CO 0.28 -0.86 0.77 -0.40 -2.34 0.00 0.00 174.74 172.18 1vld n ASP 517 N 4.21 0.00 0.17 9.88 5.75 -1.26 -1.29 116.55 134.00 1vld n ASP 517 Ca 0.08 -0.18 0.10 0.00 -0.01 0.00 0.00 54.79 54.78 1vld n ASP 517 Cb 0.48 0.00 0.09 0.00 -1.03 0.00 0.00 41.12 40.66 1vld n ASP 517 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1vld h SER 518 N 0.00 0.00 -1.96 -1.12 4.64 -1.90 -3.40 113.55 109.81 1vld h SER 518 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 1vld h SER 518 Cb 0.00 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 61.96 1vld h SER 518 CO 0.00 0.09 1.06 -0.76 -0.87 0.00 0.00 176.83 176.35 1vld s LEU 519 N -5.98 4.21 0.43 5.97 1.43 -0.41 -4.54 118.68 119.78 1vld s LEU 519 Ca 0.04 -1.53 0.23 0.00 -1.03 0.00 0.00 54.13 51.85 1vld s LEU 519 Cb 0.07 -2.48 0.90 0.00 0.03 0.00 0.00 46.19 44.71 1vld s LEU 519 CO 0.72 -1.36 1.82 -0.33 0.23 0.00 0.00 176.35 177.43 1vld h GLU 520 N 9.41 0.00 -2.28 1.70 5.08 -1.32 -3.46 114.58 123.71 1vld h GLU 520 Ca 0.07 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1vld h GLU 520 Cb 1.03 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.06 1vld h GLU 520 CO 1.25 0.24 0.00 0.12 -1.00 0.00 0.00 179.01 179.63 1vld s PHE 521 N -3.66 -0.64 -0.03 4.33 5.36 -1.16 -5.04 117.98 117.13 1vld s PHE 521 Ca 0.00 1.50 0.01 0.00 -0.96 0.00 0.00 56.93 57.49 1vld s PHE 521 Cb 0.10 0.24 0.02 0.00 -0.34 0.00 0.00 43.02 43.04 1vld s PHE 521 CO 0.64 -0.36 -0.04 0.08 -1.46 0.00 0.00 175.22 174.09 1vld s VAL 522 N 0.07 0.47 -0.04 3.12 1.01 -1.26 -1.27 120.40 122.49 1vld s VAL 522 Ca -0.02 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 61.88 1vld s VAL 522 Cb -0.04 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.86 1vld s VAL 522 CO 0.02 0.19 -0.15 -0.69 0.00 0.00 0.00 175.10 174.48 1vld s VAL 523 N 0.73 1.28 -0.20 2.92 1.01 0.20 -1.51 120.40 124.83 1vld s VAL 523 Ca -0.09 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.28 1vld s VAL 523 Cb -0.12 -1.11 0.04 0.00 0.00 0.00 0.00 36.38 35.18 1vld s VAL 523 CO -0.00 0.38 -0.13 -0.55 0.00 0.00 0.00 175.10 174.79 1vld s SER 524 N 0.17 3.47 -0.89 3.32 0.15 -0.23 0.14 113.70 119.83 1vld s SER 524 Ca -0.06 -0.89 -0.09 0.00 0.70 0.00 0.00 55.95 55.61 1vld s SER 524 Cb -0.12 -1.35 0.23 0.00 -1.71 0.00 0.00 66.02 63.07 1vld s SER 524 CO 0.02 -0.11 0.82 -1.58 1.20 0.00 0.00 173.24 173.59 1vld s GLN 525 N 1.32 3.57 0.48 5.44 0.74 -0.04 -0.21 119.66 130.97 1vld s GLN 525 Ca -0.01 -2.81 0.02 0.00 0.05 0.00 0.00 55.36 52.61 1vld s GLN 525 Cb -0.16 -4.29 -0.01 0.00 1.10 0.00 0.00 33.01 29.65 1vld s GLN 525 CO -0.09 -1.25 0.05 -1.12 -0.55 0.00 0.00 175.29 172.32 1vld s SER 526 N 1.36 3.70 -0.19 6.67 0.01 -1.00 -2.52 113.70 121.73 1vld s SER 526 Ca 0.23 -1.68 0.04 0.00 1.31 0.00 0.00 55.95 55.85 1vld s SER 526 Cb -0.11 0.57 -0.15 0.00 0.21 0.00 0.00 66.02 66.54 1vld s SER 526 CO -0.08 -0.91 -0.13 -0.38 0.41 0.00 0.00 173.24 172.15 1vld n ILE 527 N -1.16 1.14 -4.36 1.44 5.41 -1.26 -1.58 119.36 118.99 1vld n ILE 527 Ca -0.15 -0.50 -0.27 0.00 1.00 0.00 0.00 62.75 62.83 1vld n ILE 527 Cb 0.66 -1.07 -0.13 0.00 -0.71 0.00 0.00 39.64 38.39 1vld n ILE 527 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 1vld s TRP 528 N -2.40 2.15 -0.84 1.39 0.51 -1.26 -1.92 118.94 116.57 1vld s TRP 528 Ca -0.23 -0.39 -0.22 0.00 -2.12 0.00 0.00 56.10 53.14 1vld s TRP 528 Cb 0.06 -1.15 0.08 0.00 -0.81 0.00 0.00 33.47 31.65 1vld s TRP 528 CO 0.51 0.32 1.17 0.12 -0.51 0.00 0.00 176.95 178.56 1vld s PHE 529 N -1.19 2.73 0.22 -1.98 5.36 0.66 -4.77 117.98 119.02 1vld s PHE 529 Ca 0.13 -0.82 -0.22 0.00 -0.96 0.00 0.00 56.93 55.06 1vld s PHE 529 Cb -0.10 -4.43 0.06 0.00 -0.34 0.00 0.00 43.02 38.21 1vld s PHE 529 CO 0.06 -1.73 0.92 -1.83 -1.46 0.00 0.00 175.22 171.18 1vld s GLU 530 N 4.07 1.51 4.49 10.12 -1.05 -1.26 -4.94 118.70 131.64 1vld s GLU 530 Ca 0.33 -0.91 0.00 0.00 -0.15 0.00 0.00 54.97 54.24 1vld s GLU 530 Cb -0.08 0.47 0.00 0.00 -0.44 0.00 0.00 34.13 34.08 1vld s GLU 530 CO -0.00 -0.70 0.00 0.41 0.95 0.00 0.00 175.26 175.92 1vld n GLY 531 N -0.55 2.85 0.06 -3.83 0.00 -1.24 -1.98 105.19 100.49 1vld n GLY 531 Ca -0.05 0.31 0.12 0.00 0.00 0.00 0.00 46.02 46.40 1vld n GLY 531 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vld n GLU 532 N 9.33 0.22 -0.32 1.61 1.02 -0.19 -4.24 120.64 128.06 1vld n GLU 532 Ca 0.00 0.09 0.14 0.00 -0.02 0.00 0.00 57.16 57.37 1vld n GLU 532 Cb 0.00 -1.66 0.37 0.00 -0.02 0.00 0.00 31.44 30.12 1vld n GLU 532 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1vld h VAL 533 N 0.00 0.74 0.00 2.62 2.07 -1.62 -1.86 116.25 118.20 1vld h VAL 533 Ca 0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1vld h VAL 533 Cb 0.69 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1vld h VAL 533 CO 0.00 0.13 0.00 -2.65 0.02 0.00 0.00 177.57 175.07 1vld n PRO 534 N -4.65 0.58 -0.01 1.57 -0.02 -1.26 -2.41 135.00 128.80 1vld n PRO 534 Ca 0.21 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.74 1vld n PRO 534 Cb 0.57 -1.09 -0.09 0.00 -0.02 0.00 0.00 33.50 32.87 1vld n PRO 534 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1vld n PHE 535 N -0.29 0.00 -0.69 6.00 3.01 -0.70 -3.15 117.46 121.65 1vld n PHE 535 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.16 1vld n PHE 535 Cb 0.04 -0.28 0.18 0.00 -0.01 0.00 0.00 39.48 39.41 1vld n PHE 535 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1vld s ALA 536 N -2.75 1.13 -0.09 4.37 0.00 -1.01 -4.36 121.76 119.05 1vld s ALA 536 Ca -0.04 0.45 0.21 0.00 0.00 0.00 0.00 51.96 52.58 1vld s ALA 536 Cb 0.07 -3.41 -0.27 0.00 0.00 0.00 0.00 23.12 19.51 1vld s ALA 536 CO 0.47 -2.94 0.52 -0.25 0.00 0.00 0.00 175.76 173.56 1vld n ASP 537 N -4.34 0.16 -3.71 0.00 8.00 -0.57 -4.64 116.55 111.44 1vld n ASP 537 Ca 0.10 0.06 -0.12 0.00 0.71 0.00 0.00 54.79 55.54 1vld n ASP 537 Cb 0.52 1.55 -0.13 0.00 -0.02 0.00 0.00 41.12 43.05 1vld n ASP 537 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1vld s ILE 538 N -3.32 -0.09 -0.02 0.53 -1.09 -1.09 -1.56 121.20 114.55 1vld s ILE 538 Ca -0.07 0.16 0.05 0.00 -2.23 0.00 0.00 60.65 58.55 1vld s ILE 538 Cb 0.12 -0.43 -0.03 0.00 -1.58 0.00 0.00 42.46 40.54 1vld s ILE 538 CO 0.88 0.06 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.86 1vld s ILE 539 N 1.44 2.88 -0.15 2.92 1.01 -0.93 -1.07 121.20 127.31 1vld s ILE 539 Ca -0.08 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 59.69 1vld s ILE 539 Cb -0.10 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 40.25 1vld s ILE 539 CO -0.09 0.53 -0.16 -0.76 0.00 0.00 0.00 174.94 174.46 1vld s LEU 540 N -0.90 1.78 -0.18 2.97 1.43 0.70 -2.66 118.68 121.82 1vld s LEU 540 Ca 0.12 -0.51 -0.29 0.00 -1.03 0.00 0.00 54.13 52.42 1vld s LEU 540 Cb -0.11 -1.23 -0.01 0.00 0.03 0.00 0.00 46.19 44.87 1vld s LEU 540 CO 0.02 -0.04 1.31 -2.84 0.23 0.00 0.00 176.35 175.04 1vld s PRO 541 N 1.39 4.16 0.30 1.29 0.02 -1.26 -2.37 135.00 138.52 1vld s PRO 541 Ca 0.04 1.63 0.09 0.00 0.02 0.00 0.00 61.00 62.77 1vld s PRO 541 Cb -0.13 -3.81 -0.04 0.00 0.02 0.00 0.00 34.50 30.54 1vld s PRO 541 CO -0.10 -0.81 0.10 0.00 -0.33 0.00 0.00 177.00 175.86 1vld s ALA 542 N 3.77 3.40 0.39 -1.55 0.00 -0.61 -2.12 121.76 125.03 1vld s ALA 542 Ca 0.57 -1.68 0.08 0.00 0.00 0.00 0.00 51.96 50.92 1vld s ALA 542 Cb -0.22 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.01 1vld s ALA 542 CO 0.18 0.16 0.29 0.00 0.00 0.00 0.00 175.76 176.38 1vld s THR 544 N -2.45 4.33 -1.82 0.00 -4.23 -1.26 -4.86 115.64 105.35 1vld s THR 544 Ca 0.44 0.23 0.01 0.00 -1.18 0.00 0.00 61.69 61.18 1vld s THR 544 Cb -0.03 -3.69 0.02 0.00 1.34 0.00 0.00 72.50 70.14 1vld s THR 544 CO 0.26 -0.73 0.62 -0.46 -0.54 0.00 0.00 174.62 173.77 1vld n ASN 545 N -2.49 0.00 -0.06 3.99 6.94 -1.26 -0.55 115.26 121.84 1vld n ASN 545 Ca 0.03 0.07 0.11 0.00 -0.02 0.00 0.00 54.58 54.78 1vld n ASN 545 Cb 0.56 -0.09 0.14 0.00 -2.36 0.00 0.00 39.78 38.03 1vld n ASN 545 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1vld n PHE 546 N -1.09 0.00 -0.88 -2.53 3.01 -1.26 -3.99 117.46 110.73 1vld n PHE 546 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.54 1vld n PHE 546 Cb 0.00 -0.14 0.29 0.00 -0.01 0.00 0.00 39.48 39.62 1vld n PHE 546 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1vld n GLU 547 N -1.31 3.42 -3.92 -1.08 1.02 0.29 -1.65 120.64 117.40 1vld n GLU 547 Ca 0.06 -2.85 -0.09 0.00 -0.02 0.00 0.00 57.16 54.26 1vld n GLU 547 Cb 0.34 -1.89 -0.02 0.00 -0.02 0.00 0.00 31.44 29.85 1vld n GLU 547 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1vld s ARG 548 N -2.58 1.81 -0.09 3.49 1.70 -1.25 -4.43 118.95 117.59 1vld s ARG 548 Ca 0.44 -1.24 -0.12 0.00 -0.47 0.00 0.00 55.73 54.34 1vld s ARG 548 Cb 0.34 0.55 -0.05 0.00 -0.57 0.00 0.00 34.95 35.22 1vld s ARG 548 CO 0.12 -0.80 0.28 -1.58 -1.08 0.00 0.00 175.30 172.24 1vld s TRP 549 N -3.56 3.61 0.29 5.89 0.52 -1.26 -3.36 118.94 121.06 1vld s TRP 549 Ca 0.18 0.71 -0.13 0.00 0.02 0.00 0.00 56.10 56.88 1vld s TRP 549 Cb -0.03 -2.18 0.05 0.00 -1.15 0.00 0.00 33.47 30.15 1vld s TRP 549 CO 0.10 0.56 0.66 -3.47 0.02 0.00 0.00 176.95 174.82 1vld n ASP 550 N 2.39 -1.78 -3.75 2.95 -0.08 -0.61 -4.78 116.55 110.89 1vld n ASP 550 Ca -0.15 -2.19 -0.13 0.00 -1.51 0.00 0.00 54.79 50.80 1vld n ASP 550 Cb 0.53 2.95 -0.08 0.00 2.34 0.00 0.00 41.12 46.86 1vld n ASP 550 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1vld s ILE 551 N -2.26 0.06 0.04 5.18 2.07 -1.26 -0.26 121.20 124.77 1vld s ILE 551 Ca 0.13 -0.52 -0.27 0.00 -1.41 0.00 0.00 60.65 58.58 1vld s ILE 551 Cb -0.04 -0.72 0.09 0.00 0.13 0.00 0.00 42.46 41.92 1vld s ILE 551 CO 0.09 -0.29 1.21 -0.94 -1.91 0.00 0.00 174.94 173.10 1vld s SER 552 N -1.55 -0.02 0.07 4.50 1.04 -1.20 -1.70 113.70 114.85 1vld s SER 552 Ca -0.11 -0.32 0.09 0.00 0.48 0.00 0.00 55.95 56.09 1vld s SER 552 Cb -0.04 0.26 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 1vld s SER 552 CO 0.02 -0.50 -0.23 -0.70 0.98 0.00 0.00 173.24 172.81 1vld s GLU 553 N -2.22 1.41 -0.29 4.02 2.12 -1.26 -2.32 118.70 120.17 1vld s GLU 553 Ca 0.23 -1.10 -0.36 0.00 0.36 0.00 0.00 54.97 54.09 1vld s GLU 553 Cb 0.00 -1.65 -0.12 0.00 0.26 0.00 0.00 34.13 32.62 1vld s GLU 553 CO 0.00 0.41 2.03 0.34 -0.54 0.00 0.00 175.26 177.50 1vld n PHE 554 N 1.48 1.84 -0.75 5.30 7.35 0.75 -1.69 117.46 131.75 1vld n PHE 554 Ca -0.18 0.28 0.00 0.00 -0.76 0.00 0.00 57.45 56.80 1vld n PHE 554 Cb 0.53 -2.54 0.00 0.00 0.35 0.00 0.00 39.48 37.82 1vld n PHE 554 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1vld n ALA 555 N 8.22 0.00 -2.11 3.13 0.00 -1.26 -4.71 120.51 123.79 1vld n ALA 555 Ca 0.34 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.43 1vld n ALA 555 Cb 0.22 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.41 1vld n ALA 555 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1vld s ASN 556 N -1.89 5.36 -0.18 0.00 3.84 -0.68 -4.36 114.94 117.02 1vld s ASN 556 Ca 0.00 -0.13 -0.16 0.00 0.21 0.00 0.00 52.86 52.78 1vld s ASN 556 Cb 0.00 -2.54 -0.11 0.00 -0.55 0.00 0.00 41.25 38.04 1vld s ASN 556 CO 0.00 -2.41 -0.01 0.00 -2.79 0.00 0.00 177.10 171.89 1vld n SER 558 N -4.50 -5.24 0.00 0.00 2.88 -1.20 -2.31 113.62 103.25 1vld n SER 558 Ca -0.22 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.32 1vld n SER 558 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 1vld n SER 558 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vld n GLY 559 N 0.00 1.84 0.00 0.46 0.00 -1.26 -3.02 105.19 103.21 1vld n GLY 559 Ca 0.00 -0.25 0.03 0.00 0.00 0.00 0.00 46.02 45.80 1vld n GLY 559 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1vld n TYR 560 N 2.94 0.00 -3.09 1.61 0.18 -1.26 -3.16 117.16 114.38 1vld n TYR 560 Ca 0.00 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 59.62 1vld n TYR 560 Cb 0.00 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 38.95 1vld n TYR 560 CO 0.00 0.00 0.00 -0.89 -2.08 0.00 0.00 176.86 173.89 1vld n ILE 561 N -0.60 -0.18 -1.55 -3.48 5.41 -1.17 -4.24 119.36 113.56 1vld n ILE 561 Ca 0.04 -3.86 -0.51 0.00 1.00 0.00 0.00 62.75 59.42 1vld n ILE 561 Cb 0.02 -0.01 -0.05 0.00 -0.71 0.00 0.00 39.64 38.89 1vld n ILE 561 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1vld n PRO 562 N 0.42 0.81 -3.62 0.38 -0.02 -1.19 -2.42 135.00 129.36 1vld n PRO 562 Ca 0.21 0.29 -0.27 0.00 -2.02 0.00 0.00 63.50 61.70 1vld n PRO 562 Cb 0.66 -1.75 0.01 0.00 -0.02 0.00 0.00 33.50 32.39 1vld n PRO 562 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1vld n ASP 563 N 1.98 -4.23 0.00 2.55 8.00 -1.26 -4.85 116.55 118.74 1vld n ASP 563 Ca 0.17 -0.58 0.10 0.00 0.71 0.00 0.00 54.79 55.19 1vld n ASP 563 Cb 0.21 -3.44 0.53 0.00 -0.02 0.00 0.00 41.12 38.39 1vld n ASP 563 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1vld n ASN 564 N -2.52 0.00 0.05 -2.24 2.04 -1.01 -2.53 115.26 109.04 1vld n ASN 564 Ca 0.01 -0.07 0.04 0.00 -0.44 0.00 0.00 54.58 54.12 1vld n ASN 564 Cb 0.54 -0.26 0.19 0.00 -2.53 0.00 0.00 39.78 37.71 1vld n ASN 564 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1vld n TYR 565 N -1.26 0.22 0.92 -2.53 4.11 -1.26 -0.93 117.16 116.43 1vld n TYR 565 Ca 0.10 0.11 0.05 0.00 -0.00 0.00 0.00 57.90 58.17 1vld n TYR 565 Cb 0.16 -0.68 0.32 0.00 -0.00 0.00 0.00 39.34 39.13 1vld n TYR 565 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1vld n GLN 566 N -1.73 0.46 0.17 -3.48 10.64 -1.05 -1.85 117.38 120.55 1vld n GLN 566 Ca -0.00 0.00 0.05 0.00 -1.83 0.00 0.00 57.00 55.22 1vld n GLN 566 Cb 0.02 -1.36 0.21 0.00 -0.86 0.00 0.00 30.24 28.25 1vld n GLN 566 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 1vld h LEU 567 N 0.00 0.00-10.63 2.61 3.38 -1.22 -3.24 115.31 106.22 1vld h LEU 567 Ca 0.00 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.51 1vld h LEU 567 Cb 0.00 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.82 1vld h LEU 567 CO 0.00 0.40 0.04 0.00 0.09 0.00 0.00 178.44 178.97 1vld n ASN 569 N -2.61 0.57 -3.82 0.00 3.02 -1.26 -4.78 115.26 106.38 1vld n ASN 569 Ca 0.13 -0.19 -0.12 0.00 -0.03 0.00 0.00 54.58 54.37 1vld n ASN 569 Cb 0.60 0.97 -0.11 0.00 -0.61 0.00 0.00 39.78 40.64 1vld n ASN 569 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1vld s HIS 570 N -3.25 -0.14 -0.45 3.10 3.76 -1.26 -4.85 115.29 112.20 1vld s HIS 570 Ca 0.02 0.31 -0.27 0.00 -0.15 0.00 0.00 55.06 54.96 1vld s HIS 570 Cb 0.14 0.04 0.03 0.00 1.11 0.00 0.00 32.58 33.90 1vld s HIS 570 CO 0.82 -0.20 1.03 1.03 -0.85 0.00 0.00 174.74 176.58 1vld s ARG 571 N -0.53 3.70 -0.23 1.40 0.52 -1.26 -4.93 118.95 117.61 1vld s ARG 571 Ca -0.06 0.46 -0.02 0.00 -0.52 0.00 0.00 55.73 55.59 1vld s ARG 571 Cb -0.04 -3.89 0.02 0.00 0.52 0.00 0.00 34.95 31.56 1vld s ARG 571 CO 0.01 -1.24 -0.08 0.08 0.02 0.00 0.00 175.30 174.09 1vld s VAL 572 N 4.03 2.85 -0.28 3.52 1.01 -1.26 -1.43 120.40 128.84 1vld s VAL 572 Ca 0.43 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.43 1vld s VAL 572 Cb -0.09 -2.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.90 1vld s VAL 572 CO 0.27 0.29 0.06 -0.63 0.00 0.00 0.00 175.10 175.09 1vld s ILE 573 N 1.35 3.95 0.03 2.22 1.01 0.14 -0.18 121.20 129.72 1vld s ILE 573 Ca 0.02 -0.56 0.05 0.00 0.00 0.00 0.00 60.65 60.15 1vld s ILE 573 Cb -0.16 -2.97 -0.02 0.00 0.01 0.00 0.00 42.46 39.33 1vld s ILE 573 CO -0.05 0.18 -0.14 -0.94 0.00 0.00 0.00 174.94 173.99 1vld s SER 574 N 1.52 1.62 0.17 3.58 1.04 -0.98 0.14 113.70 120.79 1vld s SER 574 Ca 0.04 -0.40 -0.30 0.00 0.48 0.00 0.00 55.95 55.77 1vld s SER 574 Cb -0.16 -0.12 -0.08 0.00 0.10 0.00 0.00 66.02 65.76 1vld s SER 574 CO 0.02 0.06 1.17 -0.22 0.98 0.00 0.00 173.24 175.25 1vld s LEU 575 N -0.93 4.45 -1.07 2.42 2.96 0.90 -3.26 118.68 124.16 1vld s LEU 575 Ca 0.02 2.17 -0.11 0.00 -0.22 0.00 0.00 54.13 56.00 1vld s LEU 575 Cb -0.07 -3.60 0.25 0.00 0.50 0.00 0.00 46.19 43.26 1vld s LEU 575 CO 0.01 -0.34 1.09 -1.10 -1.32 0.00 0.00 176.35 174.69 1vld s GLN 576 N -0.16 4.06 0.33 1.98 -0.21 0.64 -3.60 119.66 122.70 1vld s GLN 576 Ca 0.52 -2.95 -0.29 0.00 0.02 0.00 0.00 55.36 52.66 1vld s GLN 576 Cb -0.31 -4.61 -0.10 0.00 1.00 0.00 0.00 33.01 28.98 1vld s GLN 576 CO 0.35 -1.33 1.38 0.00 -2.12 0.00 0.00 175.29 173.57 1vld s ALA 577 N -0.52 3.54 -0.60 6.09 0.00 -0.48 -1.57 121.76 128.23 1vld s ALA 577 Ca 0.30 1.36 -0.26 0.00 0.00 0.00 0.00 51.96 53.35 1vld s ALA 577 Cb -0.09 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.46 1vld s ALA 577 CO -0.07 -0.77 2.10 0.21 0.00 0.00 0.00 175.76 177.23 1vld s LYS 578 N -1.61 2.36 -0.01 0.00 2.20 -1.21 -4.80 119.74 116.66 1vld s LYS 578 Ca 0.52 0.82 -0.22 0.00 -0.36 0.00 0.00 55.97 56.72 1vld s LYS 578 Cb -0.42 -4.54 -0.14 0.00 -1.51 0.00 0.00 37.83 31.22 1vld s LYS 578 CO 0.54 -3.10 0.98 0.00 -0.36 0.00 0.00 175.35 173.41 1vld s ILE 580 N -4.12 1.71 0.61 0.00 -4.36 -1.11 -4.87 121.20 109.06 1vld s ILE 580 Ca -0.12 -2.02 -0.15 0.00 -0.26 0.00 0.00 60.65 58.10 1vld s ILE 580 Cb 0.01 -2.87 -0.03 0.00 1.25 0.00 0.00 42.46 40.83 1vld s ILE 580 CO 0.41 -0.03 1.06 -1.61 0.24 0.00 0.00 174.94 175.01 1vld s GLU 581 N -3.77 3.24 0.27 0.37 0.41 -1.26 -4.39 118.70 113.56 1vld s GLU 581 Ca 0.35 1.16 -0.30 0.00 -0.41 0.00 0.00 54.97 55.77 1vld s GLU 581 Cb 0.09 -2.02 -0.13 0.00 -1.78 0.00 0.00 34.13 30.28 1vld s GLU 581 CO 0.17 -0.87 1.34 -2.30 -0.49 0.00 0.00 175.26 173.10 1vld n PRO 582 N -2.24 1.97 -2.61 0.39 -0.02 -1.26 -4.90 135.00 126.32 1vld n PRO 582 Ca 0.09 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.86 1vld n PRO 582 Cb 0.53 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.65 1vld n PRO 582 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1vld s VAL 583 N -0.40 3.93 0.00 -1.45 1.01 -1.26 -4.81 120.40 117.42 1vld s VAL 583 Ca 0.64 1.81 0.00 0.00 0.00 0.00 0.00 61.98 64.43 1vld s VAL 583 Cb -0.64 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 31.59 1vld s VAL 583 CO 0.54 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.62 1vld n GLY 584 N 1.67 2.13 1.01 4.51 0.00 -1.26 -2.94 105.19 110.31 1vld n GLY 584 Ca 0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 46.02 45.54 1vld n GLY 584 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1vld n GLU 585 N 13.20 1.96 -2.70 1.61 2.13 -0.21 -5.04 120.64 131.60 1vld n GLU 585 Ca 0.00 -3.39 -0.23 0.00 0.66 0.00 0.00 57.16 54.21 1vld n GLU 585 Cb 0.00 -1.79 0.03 0.00 0.27 0.00 0.00 31.44 29.95 1vld n GLU 585 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1vld s SER 586 N -3.03 5.47 0.14 4.31 1.04 -1.15 -4.74 113.70 115.73 1vld s SER 586 Ca 0.42 0.21 -0.15 0.00 0.48 0.00 0.00 55.95 56.92 1vld s SER 586 Cb 0.39 -1.22 0.02 0.00 0.10 0.00 0.00 66.02 65.32 1vld s SER 586 CO -0.03 -1.02 0.39 0.00 0.98 0.00 0.00 173.24 173.56 1vld s MET 587 N -4.75 1.12 0.65 4.02 0.23 -0.90 -4.74 119.30 114.93 1vld s MET 587 Ca 0.54 -0.83 -0.18 0.00 -1.03 0.00 0.00 55.69 54.19 1vld s MET 587 Cb -0.10 0.45 -0.01 0.00 -1.53 0.00 0.00 34.83 33.64 1vld s MET 587 CO 0.39 -0.43 1.26 -1.13 -2.03 0.00 0.00 175.02 173.08 1vld n SER 588 N -0.23 1.91 -0.28 -1.18 3.41 -1.26 -2.78 113.62 113.21 1vld n SER 588 Ca -0.14 0.82 -0.01 0.00 -0.26 0.00 0.00 58.87 59.28 1vld n SER 588 Cb 0.63 -1.54 0.12 0.00 -0.26 0.00 0.00 64.21 63.16 1vld n SER 588 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1vld h ASP 589 N 0.48 0.77 -0.44 4.04 3.32 -1.94 -0.32 116.42 122.34 1vld h ASP 589 Ca -0.51 0.01 0.04 0.00 0.02 0.00 0.00 57.03 56.60 1vld h ASP 589 Cb 1.34 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.70 1vld h ASP 589 CO 0.53 0.51 0.20 0.22 -1.72 0.00 0.00 179.24 178.98 1vld h TYR 590 N 0.91 0.37 -0.02 4.55 5.03 -1.93 0.54 116.97 126.43 1vld h TYR 590 Ca 0.34 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.59 1vld h TYR 590 Cb 0.12 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.29 1vld h TYR 590 CO -0.04 0.18 -0.37 0.93 -1.32 0.00 0.00 178.16 177.54 1vld h GLU 591 N 0.41 0.03 0.10 1.82 4.39 -1.72 0.44 114.58 120.04 1vld h GLU 591 Ca 0.20 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 1vld h GLU 591 Cb 0.13 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1vld h GLU 591 CO -0.16 0.40 -0.05 0.82 -1.16 0.00 0.00 179.01 178.86 1vld h ILE 592 N 0.03 1.09 -0.48 3.13 2.04 -0.15 -2.52 117.51 120.64 1vld h ILE 592 Ca 0.00 -0.76 0.01 0.00 1.00 0.00 0.00 64.86 65.11 1vld h ILE 592 Cb 0.67 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 1vld h ILE 592 CO 0.05 0.18 0.32 1.88 0.00 0.00 0.00 178.15 180.58 1vld h TYR 593 N -0.49 0.57 0.00 1.37 0.99 -0.69 -0.73 116.97 117.99 1vld h TYR 593 Ca -0.01 0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.67 1vld h TYR 593 Cb 0.41 -0.19 -0.01 0.00 1.00 0.00 0.00 36.73 37.93 1vld h TYR 593 CO 0.04 0.35 -0.29 -0.09 -0.00 0.00 0.00 178.16 178.17 1vld h ARG 594 N 0.61 0.00 -0.08 4.88 2.43 -0.79 0.30 114.38 121.72 1vld h ARG 594 Ca 0.18 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 59.11 1vld h ARG 594 Cb -0.02 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1vld h ARG 594 CO -0.04 0.29 -0.90 1.25 -1.51 0.00 0.00 179.97 179.06 1vld h LEU 595 N 0.00 0.91 -0.14 3.80 5.85 -0.70 -2.23 115.31 122.80 1vld h LEU 595 Ca -0.00 -0.65 -0.06 0.00 0.84 0.00 0.00 57.88 58.01 1vld h LEU 595 Cb 0.65 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 1vld h LEU 595 CO 0.04 1.45 -0.13 -0.26 -0.34 0.00 0.00 178.44 179.20 1vld h PHE 596 N 0.46 0.40 -0.62 1.25 -1.00 -1.05 -2.35 116.94 114.04 1vld h PHE 596 Ca -0.09 -0.12 0.13 0.00 2.81 0.00 0.00 57.97 60.70 1vld h PHE 596 Cb 1.54 -0.09 -0.11 0.00 3.61 0.00 0.00 35.95 40.90 1vld h PHE 596 CO 0.09 0.73 -0.08 0.00 -1.61 0.00 0.00 178.31 177.43 1vld h ALA 597 N 0.61 0.50 -0.72 2.45 0.00 -0.44 0.50 119.26 122.16 1vld h ALA 597 Ca 0.02 0.22 0.04 0.00 0.00 0.00 0.00 54.91 55.19 1vld h ALA 597 Cb 0.66 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1vld h ALA 597 CO 0.03 -0.42 0.44 -0.22 0.00 0.00 0.00 179.25 179.09 1vld h LYS 598 N 0.05 0.83 0.00 0.00 3.64 -1.27 0.15 116.57 119.97 1vld h LYS 598 Ca 0.31 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1vld h LYS 598 Cb 0.49 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1vld h LYS 598 CO -0.59 0.55 0.00 0.87 -2.27 0.00 0.00 179.45 178.01 1vld h LYS 599 N 0.86 0.00 -0.02 1.90 1.57 -0.37 -2.78 116.57 117.73 1vld h LYS 599 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1vld h LYS 599 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1vld h LYS 599 CO -0.12 0.00 -0.18 1.28 -0.57 0.00 0.00 179.45 179.85 1vld n LEU 600 N -2.37 2.08 -2.48 2.94 4.77 0.15 -4.97 117.00 117.12 1vld n LEU 600 Ca 0.05 -0.70 -0.10 0.00 -0.03 0.00 0.00 56.01 55.23 1vld n LEU 600 Cb 0.43 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 41.55 1vld n LEU 600 CO 0.30 0.36 0.06 -3.20 -1.33 0.00 0.00 177.39 173.59 1vld n ASN 601 N 0.37 -2.33 -1.02 -1.43 5.15 -0.05 -4.96 115.26 110.99 1vld n ASN 601 Ca 0.13 -0.38 -0.01 0.00 -0.60 0.00 0.00 54.58 53.73 1vld n ASN 601 Cb 0.47 -3.30 -0.01 0.00 -0.53 0.00 0.00 39.78 36.41 1vld n ASN 601 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1vld n ILE 602 N -2.85 0.00 -0.19 -1.44 -5.35 0.33 -4.96 119.36 104.90 1vld n ILE 602 Ca -0.16 -0.37 -0.06 0.00 -0.27 0.00 0.00 62.75 61.89 1vld n ILE 602 Cb 0.60 0.61 0.04 0.00 -1.74 0.00 0.00 39.64 39.14 1vld n ILE 602 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1vld h GLU 603 N 0.37 0.70 -0.20 6.28 4.81 -1.84 -1.21 114.58 123.49 1vld h GLU 603 Ca -0.26 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1vld h GLU 603 Cb 1.53 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.74 1vld h GLU 603 CO -0.05 0.46 0.10 1.49 -0.73 0.00 0.00 179.01 180.28 1vld h GLU 604 N 0.72 0.28 -0.64 1.92 4.57 -1.93 0.44 114.58 119.93 1vld h GLU 604 Ca 0.21 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.38 1vld h GLU 604 Cb -0.04 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.46 1vld h GLU 604 CO -0.07 0.28 0.41 0.52 -1.18 0.00 0.00 179.01 178.97 1vld h MET 605 N 0.20 0.79 0.22 1.92 2.86 -1.91 0.70 114.93 119.71 1vld h MET 605 Ca 0.07 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1vld h MET 605 Cb 0.08 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.57 1vld h MET 605 CO -0.01 0.52 -0.10 0.35 1.06 0.00 0.00 176.91 178.73 1vld h PHE 606 N 0.82 -0.27 0.00 -0.22 3.57 -0.98 -3.38 116.94 116.48 1vld h PHE 606 Ca 0.25 -0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.55 1vld h PHE 606 Cb -0.03 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 1vld h PHE 606 CO -0.04 0.08 -1.01 0.66 -2.23 0.00 0.00 178.31 175.77 1vld h SER 607 N -0.95 0.00 -2.80 0.41 4.64 -0.15 -3.47 113.55 111.22 1vld h SER 607 Ca -0.03 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.90 1vld h SER 607 Cb 0.47 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.52 1vld h SER 607 CO 0.05 0.85 -0.48 -0.62 -0.87 0.00 0.00 176.83 175.76 1vld n GLU 608 N -3.24 -1.72 -1.24 4.77 1.02 0.24 -0.96 120.64 119.52 1vld n GLU 608 Ca -0.03 0.98 -0.08 0.00 -0.02 0.00 0.00 57.16 58.02 1vld n GLU 608 Cb 0.90 -5.59 -0.03 0.00 -0.02 0.00 0.00 31.44 26.69 1vld n GLU 608 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vld n GLY 609 N -0.88 0.94 3.57 0.62 0.00 -1.26 -5.01 105.19 103.17 1vld n GLY 609 Ca -0.23 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.22 1vld n GLY 609 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vld s LYS 610 N -2.40 2.06 0.40 1.61 1.02 -0.13 -5.12 119.74 117.19 1vld s LYS 610 Ca 0.00 -1.13 0.05 0.00 0.02 0.00 0.00 55.97 54.91 1vld s LYS 610 Cb 0.00 -2.23 0.05 0.00 -0.52 0.00 0.00 37.83 35.13 1vld s LYS 610 CO 0.00 0.48 0.42 -0.40 -0.92 0.00 0.00 175.35 174.92 1vld n ASP 611 N 0.45 1.92 -0.22 2.83 5.68 -1.26 -4.85 116.55 121.10 1vld n ASP 611 Ca -0.13 -2.24 0.13 0.00 -0.50 0.00 0.00 54.79 52.06 1vld n ASP 611 Cb 0.54 -0.15 0.43 0.00 -1.14 0.00 0.00 41.12 40.79 1vld n ASP 611 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1vld h GLU 612 N 0.00 0.57 0.00 0.11 5.08 -1.99 -1.45 114.58 116.89 1vld h GLU 612 Ca -0.22 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 57.97 1vld h GLU 612 Cb 0.90 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1vld h GLU 612 CO 0.34 0.38 -0.60 1.25 -1.00 0.00 0.00 179.01 179.37 1vld h LEU 613 N 0.58 0.00 0.01 1.33 5.85 -1.95 -2.44 115.31 118.70 1vld h LEU 613 Ca 0.41 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.94 1vld h LEU 613 Cb 0.74 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.79 1vld h LEU 613 CO -0.16 0.60 -0.73 0.00 -0.34 0.00 0.00 178.44 177.81 1vld h ALA 614 N 1.40 0.07 -0.89 1.25 0.00 -1.75 -2.78 119.26 116.57 1vld h ALA 614 Ca -0.01 -0.61 0.04 0.00 0.00 0.00 0.00 54.91 54.33 1vld h ALA 614 Cb 1.38 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.16 1vld h ALA 614 CO 0.08 0.43 0.59 -1.49 0.00 0.00 0.00 179.25 178.86 1vld h TRP 615 N 0.00 1.07 -0.73 0.00 4.06 -1.31 -1.64 115.95 117.41 1vld h TRP 615 Ca -0.09 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.86 1vld h TRP 615 Cb 1.43 -0.36 -0.03 0.00 -1.00 0.00 0.00 29.16 29.20 1vld h TRP 615 CO 0.14 0.62 0.38 0.00 -3.56 0.00 0.00 178.44 176.02 1vld h GLU 617 N 1.01 0.75 -0.41 0.00 4.81 -1.09 0.20 114.58 119.85 1vld h GLU 617 Ca 0.25 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1vld h GLU 617 Cb 0.07 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1vld h GLU 617 CO -0.04 0.83 0.25 0.37 -0.73 0.00 0.00 179.01 179.69 1vld h GLN 618 N 0.58 0.55 -0.03 1.92 4.15 -1.05 -0.93 115.11 120.30 1vld h GLN 618 Ca 0.12 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.51 1vld h GLN 618 Cb 0.49 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 1vld h GLN 618 CO 0.02 0.39 -0.06 -0.92 -1.93 0.00 0.00 178.83 176.34 1vld h TYR 619 N 0.54 -0.14 -0.72 3.99 3.20 -0.73 -2.42 116.97 120.69 1vld h TYR 619 Ca 0.15 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.14 1vld h TYR 619 Cb -0.02 0.07 -0.08 0.00 1.54 0.00 0.00 36.73 38.24 1vld h TYR 619 CO -0.04 -0.09 0.33 0.35 -1.64 0.00 0.00 178.16 177.07 1vld h PHE 620 N -0.08 0.57 0.00 -3.82 3.57 -0.21 -0.27 116.94 116.70 1vld h PHE 620 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1vld h PHE 620 Cb 0.13 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1vld h PHE 620 CO -0.14 0.16 0.00 -0.91 -2.23 0.00 0.00 178.31 175.18 1vld h ASN 621 N 0.53 0.00 -0.32 0.41 2.35 -0.78 -2.40 115.58 115.37 1vld h ASN 621 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 1vld h ASN 621 Cb 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 1vld h ASN 621 CO -0.32 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.46 1vld n ALA 622 N -1.82 2.46 -3.80 -0.83 0.00 -0.12 -4.88 120.51 111.52 1vld n ALA 622 Ca 0.02 -0.64 -0.08 0.00 0.00 0.00 0.00 53.44 52.73 1vld n ALA 622 Cb 0.24 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.68 1vld n ALA 622 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vld n THR 623 N 0.57 0.00 1.46 0.00 -2.24 -0.90 -4.72 114.28 108.45 1vld n THR 623 Ca 0.14 -0.62 0.14 0.00 -2.27 0.00 0.00 64.05 61.44 1vld n THR 623 Cb 0.34 -0.21 0.52 0.00 -2.10 0.00 0.00 70.33 68.88 1vld n THR 623 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1vld n ASP 624 N -1.67 1.24 -0.27 3.42 10.43 -0.90 -4.35 116.55 124.45 1vld n ASP 624 Ca -0.02 -1.27 0.02 0.00 2.57 0.00 0.00 54.79 56.09 1vld n ASP 624 Cb 0.17 0.03 0.15 0.00 1.84 0.00 0.00 41.12 43.31 1vld n ASP 624 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 1vld h MET 625 N 1.84 0.66 -0.32 -1.24 2.86 -1.80 -2.06 114.93 114.86 1vld h MET 625 Ca 0.00 -0.04 0.09 0.00 -2.06 0.00 0.00 59.70 57.69 1vld h MET 625 Cb 0.46 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1vld h MET 625 CO 0.00 0.44 0.71 -1.35 1.06 0.00 0.00 176.91 177.76 1vld h PRO 626 N 0.68 0.00 0.00 -0.22 0.11 -1.76 0.42 132.00 131.23 1vld h PRO 626 Ca 0.37 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.44 1vld h PRO 626 Cb 0.38 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 1vld h PRO 626 CO -0.26 0.00 -0.22 0.87 -0.21 0.00 0.00 178.00 178.18 1vld h LYS 627 N 0.00 0.00 0.00 1.05 1.57 -1.70 -3.30 116.57 114.18 1vld h LYS 627 Ca 0.15 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.73 1vld h LYS 627 Cb 1.56 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.84 1vld h LYS 627 CO -0.00 0.22 -1.77 0.66 -0.57 0.00 0.00 179.45 177.98 1vld n TYR 628 N -3.72 0.00 -3.51 -1.35 4.02 0.14 -5.08 117.16 107.67 1vld n TYR 628 Ca -0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.75 1vld n TYR 628 Cb 0.33 -0.55 -0.04 0.00 -0.02 0.00 0.00 39.34 39.06 1vld n TYR 628 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1vld s MET 629 N -2.27 0.96 0.88 -0.72 0.23 -0.95 -5.12 119.30 112.31 1vld s MET 629 Ca -0.08 -0.05 -0.13 0.00 -1.03 0.00 0.00 55.69 54.40 1vld s MET 629 Cb 0.04 0.45 0.12 0.00 -1.53 0.00 0.00 34.83 33.91 1vld s MET 629 CO 0.43 -0.36 1.19 0.95 -2.03 0.00 0.00 175.02 175.20 1vld s THR 630 N -2.16 1.99 0.11 3.16 -4.23 -1.26 -3.87 115.64 109.36 1vld s THR 630 Ca -0.03 0.00 -0.22 0.00 -1.18 0.00 0.00 61.69 60.26 1vld s THR 630 Cb -0.01 -2.91 -0.10 0.00 1.34 0.00 0.00 72.50 70.83 1vld s THR 630 CO -0.01 0.00 1.72 -0.25 -0.54 0.00 0.00 174.62 175.54 1vld h TRP 631 N -1.34 -0.05 0.11 3.99 2.91 -1.97 -1.31 115.95 118.28 1vld h TRP 631 Ca -0.47 0.01 0.02 0.00 1.13 0.00 0.00 58.89 59.58 1vld h TRP 631 Cb 1.31 0.04 -0.04 0.00 -0.51 0.00 0.00 29.16 29.96 1vld h TRP 631 CO -0.04 -0.04 -0.35 -0.44 -1.03 0.00 0.00 178.44 176.54 1vld h ASP 632 N -0.01 -1.02 -0.13 2.65 3.45 -1.98 0.28 116.42 119.67 1vld h ASP 632 Ca 0.04 0.12 0.05 0.00 0.43 0.00 0.00 57.03 57.67 1vld h ASP 632 Cb 0.07 0.39 -0.06 0.00 -0.56 0.00 0.00 39.33 39.17 1vld h ASP 632 CO -0.09 -0.43 -0.30 -0.33 -1.57 0.00 0.00 179.24 176.52 1vld h GLU 633 N -0.57 -0.36 -0.46 3.56 5.08 -1.90 0.22 114.58 120.15 1vld h GLU 633 Ca 0.03 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.47 1vld h GLU 633 Cb 0.61 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.89 1vld h GLU 633 CO -0.21 -0.24 0.17 0.35 -1.00 0.00 0.00 179.01 178.08 1vld h PHE 634 N -0.37 0.31 -0.24 4.33 3.57 -0.97 0.63 116.94 124.20 1vld h PHE 634 Ca 0.10 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.65 1vld h PHE 634 Cb 0.52 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1vld h PHE 634 CO -0.39 0.12 0.16 0.35 -2.23 0.00 0.00 178.31 176.32 1vld h PHE 635 N 0.35 0.20 0.01 0.41 3.57 0.33 0.12 116.94 121.94 1vld h PHE 635 Ca 0.21 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 1vld h PHE 635 Cb 0.20 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1vld h PHE 635 CO -0.15 0.12 -0.01 -0.22 -2.23 0.00 0.00 178.31 175.82 1vld h LYS 636 N 0.21 -0.02 0.00 1.11 3.64 0.45 -3.32 116.57 118.64 1vld h LYS 636 Ca 0.10 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1vld h LYS 636 Cb 0.14 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1vld h LYS 636 CO -0.02 0.77 -0.16 -0.22 -2.27 0.00 0.00 179.45 177.55 1vld h LYS 637 N -0.89 0.00 0.00 1.90 3.64 -0.62 -3.47 116.57 117.14 1vld h LYS 637 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1vld h LYS 637 Cb 0.79 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1vld h LYS 637 CO 0.00 0.16 0.00 0.41 -2.27 0.00 0.00 179.45 177.76 1vld n GLY 638 N -0.78 2.70 3.41 5.01 0.00 0.00 -4.93 105.19 110.60 1vld n GLY 638 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 1vld n GLY 638 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1vld s TYR 639 N -0.51 -0.47 -0.02 1.61 -0.85 -1.26 -0.07 117.35 115.78 1vld s TYR 639 Ca 0.00 0.55 0.01 0.00 -0.52 0.00 0.00 57.07 57.11 1vld s TYR 639 Cb 0.00 0.37 0.01 0.00 0.38 0.00 0.00 41.96 42.72 1vld s TYR 639 CO 0.00 -0.66 -0.04 0.12 -1.52 0.00 0.00 175.55 173.45 1vld s PHE 640 N -2.39 0.52 -0.31 -3.49 5.36 0.38 -4.96 117.98 113.10 1vld s PHE 640 Ca -0.06 -0.10 -0.09 0.00 -0.96 0.00 0.00 56.93 55.72 1vld s PHE 640 Cb -0.01 -0.43 0.00 0.00 -0.34 0.00 0.00 43.02 42.24 1vld s PHE 640 CO -0.01 -0.09 0.13 0.08 -1.46 0.00 0.00 175.22 173.87 1vld s VAL 641 N 0.41 4.37 0.11 3.12 1.01 -1.26 -0.68 120.40 127.48 1vld s VAL 641 Ca -0.05 -0.56 -0.31 0.00 0.00 0.00 0.00 61.98 61.07 1vld s VAL 641 Cb -0.08 -3.26 -0.08 0.00 0.00 0.00 0.00 36.38 32.96 1vld s VAL 641 CO -0.00 0.04 1.43 -0.69 0.00 0.00 0.00 175.10 175.88 1vld s VAL 642 N 1.57 3.23 1.10 2.92 1.01 -0.51 -4.43 120.40 125.28 1vld s VAL 642 Ca 0.04 0.85 -0.16 0.00 0.00 0.00 0.00 61.98 62.71 1vld s VAL 642 Cb -0.17 -3.54 0.14 0.00 0.00 0.00 0.00 36.38 32.80 1vld s VAL 642 CO 0.05 0.06 0.36 -2.65 0.00 0.00 0.00 175.10 172.92 1vld n PRO 643 N 4.19 -1.57 -3.33 2.72 -0.02 -1.26 -4.63 135.00 131.11 1vld n PRO 643 Ca 0.12 -0.43 -0.30 0.00 -2.02 0.00 0.00 63.50 60.87 1vld n PRO 643 Cb 0.42 -1.87 -0.04 0.00 -0.02 0.00 0.00 33.50 31.99 1vld n PRO 643 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1vld s ASP 644 N -2.04 6.50 -0.60 2.55 3.68 -1.26 -4.63 116.67 120.86 1vld s ASP 644 Ca 0.60 0.79 0.06 0.00 2.13 0.00 0.00 52.55 56.13 1vld s ASP 644 Cb -0.17 -2.18 0.21 0.00 -1.45 0.00 0.00 42.92 39.34 1vld s ASP 644 CO 0.66 -0.18 0.59 -3.20 0.13 0.00 0.00 175.17 173.17 1vld n ASN 645 N -0.74 2.56 0.23 -0.34 5.15 -1.26 -4.96 115.26 115.90 1vld n ASN 645 Ca -0.01 -3.15 0.18 0.00 -0.60 0.00 0.00 54.58 51.00 1vld n ASN 645 Cb 0.53 -0.68 0.87 0.00 -0.53 0.00 0.00 39.78 39.97 1vld n ASN 645 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1vld h PRO 646 N 4.73 0.00 0.00 1.20 0.11 -1.96 -3.16 132.00 132.91 1vld h PRO 646 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1vld h PRO 646 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1vld h PRO 646 CO 0.69 0.00 -1.41 0.09 -0.21 0.00 0.00 178.00 177.16 1vld n ASN 647 N -3.62 0.45 -4.66 -2.05 3.02 -1.26 -4.95 115.26 102.19 1vld n ASN 647 Ca 0.01 -0.01 -0.38 0.00 -0.03 0.00 0.00 54.58 54.17 1vld n ASN 647 Cb 0.31 1.19 0.05 0.00 -0.61 0.00 0.00 39.78 40.72 1vld n ASN 647 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1vld n ARG 648 N -2.27 1.19 -2.37 3.52 1.85 -1.20 -4.91 116.66 112.48 1vld n ARG 648 Ca -0.01 0.45 -0.35 0.00 -1.00 0.00 0.00 57.85 56.94 1vld n ARG 648 Cb 0.52 -2.31 -0.01 0.00 -1.05 0.00 0.00 32.46 29.61 1vld n ARG 648 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 1vld s LYS 649 N -2.78 3.60 -0.15 2.89 -2.85 -1.26 -5.00 119.74 114.18 1vld s LYS 649 Ca 0.74 1.55 -0.15 0.00 -1.00 0.00 0.00 55.97 57.11 1vld s LYS 649 Cb -0.43 -2.12 -0.04 0.00 -2.06 0.00 0.00 37.83 33.18 1vld s LYS 649 CO 0.48 -0.64 0.36 0.15 0.10 0.00 0.00 175.35 175.80 1vld s LYS 650 N -3.14 4.28 -0.28 1.78 -0.14 -1.26 -5.05 119.74 115.92 1vld s LYS 650 Ca 0.69 0.21 0.01 0.00 -1.36 0.00 0.00 55.97 55.52 1vld s LYS 650 Cb -0.22 -3.44 0.08 0.00 -1.68 0.00 0.00 37.83 32.57 1vld s LYS 650 CO 0.26 0.18 0.02 0.95 -0.76 0.00 0.00 175.35 176.00 1vld s THR 651 N 0.62 1.52 0.10 2.17 -4.23 -1.26 -5.11 115.64 109.44 1vld s THR 651 Ca 0.20 -1.55 -0.30 0.00 -1.18 0.00 0.00 61.69 58.86 1vld s THR 651 Cb -0.14 -1.98 -0.05 0.00 1.34 0.00 0.00 72.50 71.67 1vld s THR 651 CO 0.06 -0.40 0.99 -0.69 -0.54 0.00 0.00 174.62 174.05 1vld s VAL 652 N 1.34 4.47 -0.37 2.29 1.01 -1.26 -4.29 120.40 123.59 1vld s VAL 652 Ca 0.03 1.99 -0.40 0.00 0.00 0.00 0.00 61.98 63.60 1vld s VAL 652 Cb -0.18 -4.27 -0.17 0.00 0.00 0.00 0.00 36.38 31.75 1vld s VAL 652 CO -0.12 0.27 1.33 0.00 0.00 0.00 0.00 175.10 176.58 1vld n ALA 653 N 3.00 -1.50 -1.01 5.51 0.00 -0.84 -0.95 120.51 124.72 1vld n ALA 653 Ca 0.03 0.45 -0.01 0.00 0.00 0.00 0.00 53.44 53.92 1vld n ALA 653 Cb 0.49 -1.66 -0.00 0.00 0.00 0.00 0.00 19.45 18.28 1vld n ALA 653 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vld n LEU 654 N 3.16 0.65 0.14 0.00 4.77 -1.26 -4.44 117.00 120.02 1vld n LEU 654 Ca 0.26 0.01 -0.01 0.00 -0.03 0.00 0.00 56.01 56.24 1vld n LEU 654 Cb -0.03 -1.92 0.19 0.00 -2.33 0.00 0.00 43.42 39.32 1vld n LEU 654 CO 0.75 -0.71 0.52 -0.09 -1.33 0.00 0.00 177.39 176.53 1vld h ARG 655 N 0.28 0.00 -0.23 3.23 2.43 -1.18 -1.62 114.38 117.30 1vld h ARG 655 Ca -0.01 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1vld h ARG 655 Cb 0.72 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 1vld h ARG 655 CO 0.02 0.59 -0.08 0.11 -1.51 0.00 0.00 179.97 179.10 1vld h TRP 656 N 0.00 0.37 0.04 2.20 5.08 -1.89 -0.99 115.95 120.77 1vld h TRP 656 Ca -0.01 -0.04 -0.00 0.00 1.08 0.00 0.00 58.89 59.92 1vld h TRP 656 Cb 1.05 -0.11 0.00 0.00 -3.00 0.00 0.00 29.16 27.10 1vld h TRP 656 CO 0.00 0.43 -0.02 0.35 -1.28 0.00 0.00 178.44 177.92 1vld h PHE 657 N 0.34 -0.05 -0.85 0.12 3.57 -1.65 0.29 116.94 118.70 1vld h PHE 657 Ca 0.07 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.63 1vld h PHE 657 Cb 0.35 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.06 1vld h PHE 657 CO 0.01 0.50 0.56 0.00 -2.23 0.00 0.00 178.31 177.15 1vld h ALA 658 N 0.24 1.55 -0.23 2.41 0.00 -1.11 0.11 119.26 122.24 1vld h ALA 658 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1vld h ALA 658 Cb 0.58 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1vld h ALA 658 CO 0.01 0.32 0.00 0.39 0.00 0.00 0.00 179.25 179.97 1vld n GLU 659 N -4.48 1.71 -3.74 0.00 1.02 -0.39 -4.96 120.64 109.80 1vld n GLU 659 Ca 0.13 -1.09 -0.23 0.00 -0.02 0.00 0.00 57.16 55.95 1vld n GLU 659 Cb 0.19 -1.33 0.02 0.00 -0.02 0.00 0.00 31.44 30.30 1vld n GLU 659 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vld n GLY 660 N 1.07 -0.37 1.03 0.62 0.00 0.39 -5.01 105.19 102.93 1vld n GLY 660 Ca 0.14 0.17 -0.08 0.00 0.00 0.00 0.00 46.02 46.26 1vld n GLY 660 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1vld n ARG 661 N -4.26 0.70 -2.26 1.61 1.85 0.95 -5.02 116.66 110.24 1vld n ARG 661 Ca -0.28 -1.06 -0.41 0.00 -1.00 0.00 0.00 57.85 55.10 1vld n ARG 661 Cb 0.67 0.63 -0.03 0.00 -1.05 0.00 0.00 32.46 32.68 1vld n ARG 661 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1vld s GLU 662 N -2.47 4.45 0.10 2.89 8.01 -1.26 -4.42 118.70 126.00 1vld s GLU 662 Ca 0.07 2.04 -0.35 0.00 0.01 0.00 0.00 54.97 56.75 1vld s GLU 662 Cb 0.00 -3.14 -0.15 0.00 -4.31 0.00 0.00 34.13 26.53 1vld s GLU 662 CO 0.05 -0.08 1.53 1.17 0.01 0.00 0.00 175.26 177.95 1vld n LYS 663 N 1.43 1.80 -0.28 1.61 0.00 -1.10 -4.85 118.16 116.76 1vld n LYS 663 Ca 0.01 0.65 0.03 0.00 0.00 0.00 0.00 58.31 59.01 1vld n LYS 663 Cb 0.43 -2.38 0.05 0.00 0.00 0.00 0.00 35.03 33.12 1vld n LYS 663 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1vld n ASP 664 N 3.47 0.89 -5.00 3.14 5.75 -1.26 -5.09 116.55 118.46 1vld n ASP 664 Ca 0.18 -2.27 -0.19 0.00 -0.01 0.00 0.00 54.79 52.50 1vld n ASP 664 Cb 0.25 -0.25 0.02 0.00 -1.03 0.00 0.00 41.12 40.12 1vld n ASP 664 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1vld s THR 665 N -1.01 2.57 -2.00 2.12 -4.23 -1.26 -4.87 115.64 106.95 1vld s THR 665 Ca 0.11 -1.07 0.21 0.00 -1.18 0.00 0.00 61.69 59.76 1vld s THR 665 Cb 0.09 -2.64 0.60 0.00 1.34 0.00 0.00 72.50 71.90 1vld s THR 665 CO 0.01 0.00 1.72 -2.65 -0.54 0.00 0.00 174.62 173.16 1vld n PRO 666 N -1.96 0.83 -1.58 3.99 -0.02 -1.26 -4.91 135.00 130.10 1vld n PRO 666 Ca 0.10 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.20 1vld n PRO 666 Cb 0.61 -1.40 0.05 0.00 -0.02 0.00 0.00 33.50 32.73 1vld n PRO 666 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1vld n ASP 667 N -0.90 0.38 -0.47 2.55 -0.08 -1.26 -4.85 116.55 111.92 1vld n ASP 667 Ca 0.16 0.81 0.01 0.00 -1.51 0.00 0.00 54.79 54.26 1vld n ASP 667 Cb 0.07 -1.34 0.05 0.00 2.34 0.00 0.00 41.12 42.24 1vld n ASP 667 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11 1vld n TRP 668 N -1.63 0.20 -3.82 -0.67 7.02 -1.26 -4.89 117.44 112.40 1vld n TRP 668 Ca 0.13 -0.08 -0.02 0.00 -1.02 0.00 0.00 57.50 56.52 1vld n TRP 668 Cb 0.47 -0.09 0.01 0.00 -2.42 0.00 0.00 31.31 29.27 1vld n TRP 668 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1vld s GLY 669 N -0.47 -0.09 0.73 6.99 0.00 -1.26 -4.70 107.32 108.51 1vld s GLY 669 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 44.72 44.67 1vld s GLY 669 CO 0.03 1.93 1.10 2.56 0.00 0.00 0.00 173.10 178.72 1vld s PRO 670 N -2.45 2.69 0.43 2.90 0.04 -1.26 -5.06 135.00 132.29 1vld s PRO 670 Ca 0.19 0.49 -0.23 0.00 0.04 0.00 0.00 61.00 61.49 1vld s PRO 670 Cb -0.01 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 1vld s PRO 670 CO 0.02 -1.16 1.10 1.03 0.04 0.00 0.00 177.00 178.03 1vld s ARG 671 N -5.33 3.97 0.42 4.56 0.52 -1.26 -4.91 118.95 116.91 1vld s ARG 671 Ca 0.59 1.63 0.24 0.00 -0.52 0.00 0.00 55.73 57.67 1vld s ARG 671 Cb -0.12 -2.46 1.27 0.00 0.52 0.00 0.00 34.95 34.17 1vld s ARG 671 CO 0.52 -0.34 1.70 -0.07 0.02 0.00 0.00 175.30 177.13 1vld h LEU 672 N 2.25 0.34 -0.19 2.53 3.38 -1.99 0.25 115.31 121.88 1vld h LEU 672 Ca -0.49 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1vld h LEU 672 Cb 1.23 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1vld h LEU 672 CO 0.61 -0.06 0.00 -0.46 0.09 0.00 0.00 178.44 178.63 1vld n ASN 673 N -4.66 0.33 -1.50 -0.43 0.23 -1.26 -2.46 115.26 105.50 1vld n ASN 673 Ca 0.31 0.56 0.08 0.00 -0.53 0.00 0.00 54.58 55.00 1vld n ASN 673 Cb 1.16 -0.64 0.35 0.00 -2.08 0.00 0.00 39.78 38.57 1vld n ASN 673 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1vld n ASN 674 N -1.84 4.89 -4.11 0.53 5.03 0.86 -4.94 115.26 115.69 1vld n ASN 674 Ca 0.04 -2.77 -0.08 0.00 0.87 0.00 0.00 54.58 52.64 1vld n ASN 674 Cb 0.27 -0.60 -0.10 0.00 -1.02 0.00 0.00 39.78 38.33 1vld n ASN 674 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1vld s GLN 675 N -2.43 0.66 -0.29 3.52 -0.21 -1.03 -4.24 119.66 115.65 1vld s GLN 675 Ca 0.49 -1.22 -0.06 0.00 0.02 0.00 0.00 55.36 54.59 1vld s GLN 675 Cb 0.36 0.09 0.01 0.00 1.00 0.00 0.00 33.01 34.47 1vld s GLN 675 CO 0.17 -0.08 0.06 0.08 -2.12 0.00 0.00 175.29 173.39 1vld s VAL 676 N -3.71 3.75 -1.44 1.09 1.01 -1.23 -4.47 120.40 115.39 1vld s VAL 676 Ca 0.07 -0.79 -0.07 0.00 0.00 0.00 0.00 61.98 61.19 1vld s VAL 676 Cb 0.06 -2.94 0.05 0.00 0.00 0.00 0.00 36.38 33.55 1vld s VAL 676 CO -0.08 0.08 0.80 0.00 0.00 0.00 0.00 175.10 175.90 1vld n ARG 678 N -4.48 -0.81 -4.37 0.00 1.85 -1.26 -4.84 116.66 102.74 1vld n ARG 678 Ca -0.13 0.12 -0.24 0.00 -1.00 0.00 0.00 57.85 56.60 1vld n ARG 678 Cb 0.60 -4.16 -0.13 0.00 -1.05 0.00 0.00 32.46 27.72 1vld n ARG 678 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1vld s LYS 679 N -7.17 1.17 0.00 2.89 1.02 -0.86 -2.73 119.74 114.07 1vld s LYS 679 Ca 0.49 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 55.39 1vld s LYS 679 Cb -0.29 -1.39 0.00 0.00 -0.52 0.00 0.00 37.83 35.64 1vld s LYS 679 CO 0.99 0.33 0.00 0.41 -0.92 0.00 0.00 175.35 176.16 1vld n GLY 680 N 1.30 -0.74 3.93 -3.33 0.00 -1.26 -3.53 105.19 101.57 1vld n GLY 680 Ca -0.19 -1.70 -0.30 0.00 0.00 0.00 0.00 46.02 43.83 1vld n GLY 680 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vld s LEU 681 N -2.53 2.70 0.56 0.99 1.43 -0.49 -4.89 118.68 116.44 1vld s LEU 681 Ca 0.00 0.31 0.34 0.00 -1.03 0.00 0.00 54.13 53.75 1vld s LEU 681 Cb 0.00 -2.41 1.48 0.00 0.03 0.00 0.00 46.19 45.28 1vld s LEU 681 CO 0.00 -2.61 2.03 -0.61 0.23 0.00 0.00 176.35 175.39 1vld h GLN 682 N -1.54 0.00 -7.18 1.70 4.15 -1.77 -3.39 115.11 107.08 1vld h GLN 682 Ca -0.44 0.00 -0.54 0.00 0.77 0.00 0.00 58.65 58.44 1vld h GLN 682 Cb 1.25 0.00 0.17 0.00 0.21 0.00 0.00 27.48 29.10 1vld h GLN 682 CO 0.41 0.02 0.38 0.95 -1.93 0.00 0.00 178.83 178.66 1vld s THR 683 N -3.74 2.16 0.19 2.39 -4.23 -1.26 -4.85 115.64 106.30 1vld s THR 683 Ca 0.00 0.08 -0.17 0.00 -1.18 0.00 0.00 61.69 60.42 1vld s THR 683 Cb 0.10 -2.62 0.16 0.00 1.34 0.00 0.00 72.50 71.48 1vld s THR 683 CO 0.53 -0.04 1.61 0.74 -0.54 0.00 0.00 174.62 176.92 1vld h THR 684 N -0.48 0.30 0.00 3.99 2.02 -1.90 -0.11 112.91 116.74 1vld h THR 684 Ca -0.47 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1vld h THR 684 Cb 1.30 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1vld h THR 684 CO 0.48 0.00 0.00 0.35 0.37 0.00 0.00 175.52 176.72 1vld n THR 685 N -5.42 0.44 -0.95 3.16 -2.24 -1.26 -4.89 114.28 103.11 1vld n THR 685 Ca 0.05 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1vld n THR 685 Cb 0.33 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1vld n THR 685 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vld n GLY 686 N 1.13 0.79 3.58 3.38 0.00 -0.05 -4.94 105.19 109.08 1vld n GLY 686 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1vld n GLY 686 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vld s LYS 687 N -0.05 1.91 -0.15 1.61 1.02 -1.26 -1.40 119.74 121.42 1vld s LYS 687 Ca 0.00 -1.92 -0.29 0.00 0.02 0.00 0.00 55.97 53.78 1vld s LYS 687 Cb 0.00 -1.75 -0.04 0.00 -0.52 0.00 0.00 37.83 35.52 1vld s LYS 687 CO 0.00 0.10 1.62 0.08 -0.92 0.00 0.00 175.35 176.23 1vld s VAL 688 N -2.60 3.68 -0.48 3.17 1.01 -0.04 -4.78 120.40 120.36 1vld s VAL 688 Ca 0.34 0.79 -0.15 0.00 0.00 0.00 0.00 61.98 62.96 1vld s VAL 688 Cb 0.03 -3.62 0.08 0.00 0.00 0.00 0.00 36.38 32.88 1vld s VAL 688 CO 0.18 -0.19 0.40 -1.61 0.00 0.00 0.00 175.10 173.88 1vld s GLU 689 N 4.39 2.93 0.38 2.72 2.02 0.57 -0.59 118.70 131.11 1vld s GLU 689 Ca 0.72 -1.43 0.28 0.00 0.02 0.00 0.00 54.97 54.55 1vld s GLU 689 Cb -0.28 -4.12 1.21 0.00 0.10 0.00 0.00 34.13 31.04 1vld s GLU 689 CO 0.28 -1.08 1.83 0.74 0.02 0.00 0.00 175.26 177.06 1vld h PHE 690 N 8.73 0.00 -3.19 1.61 -1.00 -1.48 -3.24 116.94 118.37 1vld h PHE 690 Ca -0.28 0.00 -0.62 0.00 2.81 0.00 0.00 57.97 59.89 1vld h PHE 690 Cb 1.10 0.00 -0.40 0.00 3.61 0.00 0.00 35.95 40.26 1vld h PHE 690 CO 0.65 0.00 -0.72 0.42 -1.61 0.00 0.00 178.31 177.05 1vld s ILE 691 N -3.50 1.58 -0.09 -0.55 1.01 -1.25 -1.43 121.20 116.96 1vld s ILE 691 Ca 0.02 -2.35 -0.29 0.00 0.00 0.00 0.00 60.65 58.03 1vld s ILE 691 Cb 0.09 -2.13 -0.07 0.00 0.01 0.00 0.00 42.46 40.36 1vld s ILE 691 CO 0.42 -0.78 2.05 0.00 0.00 0.00 0.00 174.94 176.63 1vld s ALA 692 N 0.65 3.18 0.28 9.38 0.00 -0.04 -4.89 121.76 130.33 1vld s ALA 692 Ca 0.15 1.02 -0.03 0.00 0.00 0.00 0.00 51.96 53.10 1vld s ALA 692 Cb -0.22 -3.95 0.38 0.00 0.00 0.00 0.00 23.12 19.33 1vld s ALA 692 CO -0.07 -2.14 1.90 1.79 0.00 0.00 0.00 175.76 177.24 1vld h THR 693 N 6.34 1.22 0.34 0.00 1.35 -1.90 0.01 112.91 120.28 1vld h THR 693 Ca -0.45 -0.56 -0.01 0.00 -0.55 0.00 0.00 66.41 64.85 1vld h THR 693 Cb 1.23 0.20 -0.01 0.00 -1.73 0.00 0.00 68.15 67.84 1vld h THR 693 CO 0.95 0.25 -0.24 0.77 -0.25 0.00 0.00 175.52 177.01 1vld h SER 694 N 1.06 -0.61 0.22 5.36 4.64 -1.90 -0.63 113.55 121.70 1vld h SER 694 Ca 0.27 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.59 1vld h SER 694 Cb 0.03 0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1vld h SER 694 CO -0.04 -0.37 -0.21 -0.07 -0.87 0.00 0.00 176.83 175.27 1vld h LEU 695 N -0.57 0.00 -0.74 5.97 3.38 -1.86 -1.89 115.31 119.60 1vld h LEU 695 Ca -0.03 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 1vld h LEU 695 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1vld h LEU 695 CO 0.01 0.21 -0.46 0.50 0.09 0.00 0.00 178.44 178.79 1vld h LYS 696 N 0.00 0.40 -0.51 1.13 3.64 -0.58 -0.65 116.57 120.00 1vld h LYS 696 Ca -0.00 -0.21 -0.09 0.00 -1.27 0.00 0.00 60.65 59.07 1vld h LYS 696 Cb 0.38 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 1vld h LYS 696 CO 0.03 0.78 -0.04 -0.91 -2.27 0.00 0.00 179.45 177.03 1vld h ASN 697 N 0.32 0.91 0.08 4.20 -0.26 -0.38 -2.32 115.58 118.13 1vld h ASN 697 Ca 0.02 -0.33 0.00 0.00 -0.56 0.00 0.00 56.30 55.44 1vld h ASN 697 Cb 0.93 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.94 1vld h ASN 697 CO 0.08 1.02 -0.09 0.15 -1.06 0.00 0.00 177.43 177.53 1vld h PHE 698 N 0.78 -0.23 -0.29 1.19 3.57 -0.93 -1.11 116.94 119.94 1vld h PHE 698 Ca 0.14 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.56 1vld h PHE 698 Cb 0.58 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 1vld h PHE 698 CO 0.04 -0.14 -0.14 1.05 -2.23 0.00 0.00 178.31 176.89 1vld h GLU 699 N -0.19 0.50 0.00 1.11 4.11 -1.09 -2.00 114.58 117.01 1vld h GLU 699 Ca 0.01 -0.15 0.00 0.00 0.07 0.00 0.00 59.36 59.29 1vld h GLU 699 Cb 0.19 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1vld h GLU 699 CO -0.03 0.63 0.00 0.93 0.07 0.00 0.00 179.01 180.61 1vld h GLU 700 N 0.46 0.00 -0.00 1.06 5.08 -1.20 -2.16 114.58 117.81 1vld h GLU 700 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1vld h GLU 700 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1vld h GLU 700 CO 0.03 0.00 -0.08 1.04 -1.00 0.00 0.00 179.01 179.00 1vld n GLN 701 N -2.63 0.71 0.00 2.33 6.02 -0.44 -4.90 117.38 118.47 1vld n GLN 701 Ca 0.03 -0.21 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 1vld n GLN 701 Cb 0.37 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.13 1vld n GLN 701 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1vld n GLY 702 N 1.26 0.78 3.37 1.08 0.00 -0.81 -5.04 105.19 105.81 1vld n GLY 702 Ca 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.73 1vld n GLY 702 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1vld n TYR 703 N -0.93 4.93 -2.61 1.61 4.02 -0.91 -5.00 117.16 118.28 1vld n TYR 703 Ca 0.00 -3.55 -0.42 0.00 -0.01 0.00 0.00 57.90 53.92 1vld n TYR 703 Cb 0.00 -1.94 -0.03 0.00 -0.02 0.00 0.00 39.34 37.35 1vld n TYR 703 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1vld s ILE 704 N 0.11 4.59 -0.35 -0.72 -1.09 -1.26 -4.06 121.20 118.43 1vld s ILE 704 Ca 0.37 1.87 -0.01 0.00 -2.23 0.00 0.00 60.65 60.66 1vld s ILE 704 Cb -0.05 -4.20 0.13 0.00 -1.58 0.00 0.00 42.46 36.76 1vld s ILE 704 CO -0.03 0.07 0.19 -0.62 -1.23 0.00 0.00 174.94 173.33 1vld s ASP 705 N 1.14 3.20 0.33 3.58 -1.08 -1.26 -5.01 116.67 117.56 1vld s ASP 705 Ca 0.53 -2.04 0.13 0.00 -0.52 0.00 0.00 52.55 50.64 1vld s ASP 705 Cb -0.22 -0.48 1.01 0.00 -1.46 0.00 0.00 42.92 41.77 1vld s ASP 705 CO 0.24 -0.33 1.69 -0.08 0.52 0.00 0.00 175.17 177.20 1vld h GLU 706 N 7.29 0.42 -0.56 4.34 4.81 -2.02 -0.15 114.58 128.71 1vld h GLU 706 Ca -0.01 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1vld h GLU 706 Cb 0.97 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.26 1vld h GLU 706 CO 0.33 0.28 0.00 0.72 -0.73 0.00 0.00 179.01 179.60 1vld n HIS 707 N -4.98 0.48 -2.82 0.92 8.25 -1.26 -4.27 115.22 111.54 1vld n HIS 707 Ca 0.30 -0.19 -0.11 0.00 -0.26 0.00 0.00 57.72 57.46 1vld n HIS 707 Cb 0.89 -0.12 0.03 0.00 1.12 0.00 0.00 29.99 31.91 1vld n HIS 707 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1vld n ARG 708 N 0.18 0.79 -1.96 -0.41 0.63 -0.07 -4.82 116.66 111.00 1vld n ARG 708 Ca 0.08 -2.00 -0.32 0.00 -0.92 0.00 0.00 57.85 54.68 1vld n ARG 708 Cb 0.37 -1.40 0.02 0.00 0.45 0.00 0.00 32.46 31.90 1vld n ARG 708 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1vld s PRO 709 N 0.32 3.27 0.31 -0.14 0.04 -1.25 -4.76 135.00 132.80 1vld s PRO 709 Ca 0.32 1.14 0.01 0.00 0.04 0.00 0.00 61.00 62.51 1vld s PRO 709 Cb 0.23 -2.03 0.50 0.00 0.04 0.00 0.00 34.50 33.24 1vld s PRO 709 CO -0.21 -0.85 1.89 0.66 0.04 0.00 0.00 177.00 178.53 1vld h SER 710 N 0.23 0.73 -3.15 6.66 4.64 -1.88 -3.41 113.55 117.36 1vld h SER 710 Ca -0.46 -0.09 -0.59 0.00 -0.47 0.00 0.00 61.79 60.18 1vld h SER 710 Cb 1.22 -0.19 -0.05 0.00 -0.31 0.00 0.00 62.40 63.07 1vld h SER 710 CO 0.57 0.66 -0.11 -0.32 -0.87 0.00 0.00 176.83 176.77 1vld s MET 711 N -5.35 4.10 -0.14 4.77 -2.45 -1.26 -0.86 119.30 118.11 1vld s MET 711 Ca -0.10 0.58 -0.29 0.00 -1.25 0.00 0.00 55.69 54.64 1vld s MET 711 Cb 0.16 -3.25 -0.04 0.00 1.25 0.00 0.00 34.83 32.96 1vld s MET 711 CO 0.78 0.62 1.57 -1.58 1.05 0.00 0.00 175.02 177.46 1vld s HIS 712 N -0.94 2.18 0.32 4.11 2.46 -0.52 -4.96 115.29 117.95 1vld s HIS 712 Ca 0.27 0.47 0.07 0.00 0.47 0.00 0.00 55.06 56.33 1vld s HIS 712 Cb -0.18 -3.86 -0.03 0.00 -0.13 0.00 0.00 32.58 28.38 1vld s HIS 712 CO 0.16 -3.12 0.26 0.95 -2.47 0.00 0.00 174.74 170.52 1vld s THR 713 N 4.37 0.02 -0.93 0.89 -4.23 -1.26 -5.03 115.64 109.48 1vld s THR 713 Ca 0.69 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 59.02 1vld s THR 713 Cb -0.28 -2.49 0.14 0.00 1.34 0.00 0.00 72.50 71.21 1vld s THR 713 CO 0.27 0.00 1.09 -0.47 -0.54 0.00 0.00 174.62 174.97 1vld s TYR 714 N -3.49 3.22 -0.31 3.99 5.04 -1.26 -4.90 117.35 119.63 1vld s TYR 714 Ca 0.40 -1.50 -0.19 0.00 -2.44 0.00 0.00 57.07 53.33 1vld s TYR 714 Cb 0.03 -4.22 -0.01 0.00 0.35 0.00 0.00 41.96 38.10 1vld s TYR 714 CO 0.26 -1.42 0.59 0.08 -1.34 0.00 0.00 175.55 173.72 1vld s VAL 715 N 2.31 4.97 0.20 3.14 1.01 -1.26 -5.01 120.40 125.76 1vld s VAL 715 Ca 0.31 0.74 -0.32 0.00 0.00 0.00 0.00 61.98 62.71 1vld s VAL 715 Cb -0.05 -3.97 -0.13 0.00 0.00 0.00 0.00 36.38 32.23 1vld s VAL 715 CO -0.09 -0.13 1.64 -2.65 0.00 0.00 0.00 175.10 173.88 1vld n PRO 716 N 5.81 2.52 -1.69 2.72 -0.02 -1.26 -4.86 135.00 138.21 1vld n PRO 716 Ca -0.02 0.91 -0.43 0.00 -2.02 0.00 0.00 63.50 61.94 1vld n PRO 716 Cb 0.49 -2.71 -0.03 0.00 -0.02 0.00 0.00 33.50 31.23 1vld n PRO 716 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vld n ALA 717 N 3.49 2.26 0.28 3.55 0.00 -1.26 -4.83 120.51 123.99 1vld n ALA 717 Ca 0.15 0.34 0.16 0.00 0.00 0.00 0.00 53.44 54.09 1vld n ALA 717 Cb 0.33 -2.57 0.82 0.00 0.00 0.00 0.00 19.45 18.03 1vld n ALA 717 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1vld h TRP 718 N 8.11 0.00 -2.53 0.00 5.08 -1.89 -3.11 115.95 121.61 1vld h TRP 718 Ca -0.46 0.00 -0.61 0.00 1.08 0.00 0.00 58.89 58.91 1vld h TRP 718 Cb 1.22 0.00 -0.42 0.00 -3.00 0.00 0.00 29.16 26.96 1vld h TRP 718 CO 0.75 0.00 -0.62 -1.91 -1.28 0.00 0.00 178.44 175.39 1vld n GLU 719 N -2.67 2.12 -4.40 0.12 4.07 -1.26 -4.30 120.64 114.33 1vld n GLU 719 Ca -0.01 -4.50 -0.20 0.00 -0.06 0.00 0.00 57.16 52.39 1vld n GLU 719 Cb 0.12 -2.21 -0.10 0.00 -0.06 0.00 0.00 31.44 29.18 1vld n GLU 719 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 1vld s SER 720 N -1.97 2.04 0.06 4.31 1.04 -1.17 -4.57 113.70 113.44 1vld s SER 720 Ca 0.34 -1.33 -0.17 0.00 0.48 0.00 0.00 55.95 55.26 1vld s SER 720 Cb 0.07 -0.02 -0.14 0.00 0.10 0.00 0.00 66.02 66.03 1vld s SER 720 CO -0.08 -0.60 1.31 1.56 0.98 0.00 0.00 173.24 176.42 1vld h GLN 721 N 2.25 0.55 -0.01 4.02 4.20 -1.91 -2.76 115.11 121.46 1vld h GLN 721 Ca -0.40 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 57.96 1vld h GLN 721 Cb 1.24 0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.07 1vld h GLN 721 CO 0.67 0.97 -0.44 0.36 -0.67 0.00 0.00 178.83 179.72 1vld n LYS 722 N -4.31 0.84 -0.05 1.46 2.85 -1.26 -4.49 118.16 113.20 1vld n LYS 722 Ca -0.06 -0.61 -0.06 0.00 -1.05 0.00 0.00 58.31 56.53 1vld n LYS 722 Cb 0.51 -1.49 -0.06 0.00 -0.65 0.00 0.00 35.03 33.34 1vld n LYS 722 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1vld n HIS 723 N -0.55 0.00 -2.70 5.58 8.25 -1.25 -5.02 115.22 119.53 1vld n HIS 723 Ca 0.10 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.15 1vld n HIS 723 Cb 0.39 -0.43 -0.05 0.00 1.12 0.00 0.00 29.99 31.02 1vld n HIS 723 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1vld s SER 724 N -4.50 7.51 0.58 0.41 0.15 -1.04 -4.93 113.70 111.88 1vld s SER 724 Ca -0.09 1.88 0.35 0.00 0.70 0.00 0.00 55.95 58.80 1vld s SER 724 Cb 0.03 -2.60 1.80 0.00 -1.71 0.00 0.00 66.02 63.54 1vld s SER 724 CO 0.32 -0.02 2.17 -0.65 1.20 0.00 0.00 173.24 176.25 1vld h PRO 725 N 5.08 0.00 0.00 5.44 0.11 -1.88 -2.25 132.00 138.49 1vld h PRO 725 Ca -0.44 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.60 1vld h PRO 725 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1vld h PRO 725 CO 0.71 0.04 -0.33 1.25 -0.21 0.00 0.00 178.00 179.46 1vld h LEU 726 N 0.00 0.00 0.00 2.35 5.85 -1.91 -3.23 115.31 118.37 1vld h LEU 726 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1vld h LEU 726 Cb 0.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1vld h LEU 726 CO 0.01 0.33 0.00 0.00 -0.34 0.00 0.00 178.44 178.43 1vld n ALA 727 N -2.27 1.83 0.17 1.25 0.00 -0.85 -2.24 120.51 118.41 1vld n ALA 727 Ca -0.00 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.48 1vld n ALA 727 Cb 0.49 -1.19 0.10 0.00 0.00 0.00 0.00 19.45 18.85 1vld n ALA 727 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1vld h VAL 728 N 0.00 0.08 0.00 0.00 2.07 -1.77 -3.25 116.25 113.38 1vld h VAL 728 Ca 0.00 -1.13 -0.33 0.00 0.82 0.00 0.00 66.70 66.06 1vld h VAL 728 Cb 0.04 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 1vld h VAL 728 CO 0.00 0.05 -2.21 0.29 0.02 0.00 0.00 177.57 175.72 1vld n LYS 729 N -2.97 0.51 -3.73 1.57 5.02 -0.95 -4.80 118.16 112.81 1vld n LYS 729 Ca 0.02 0.14 -0.33 0.00 -2.02 0.00 0.00 58.31 56.12 1vld n LYS 729 Cb 0.56 -1.39 -0.08 0.00 -0.02 0.00 0.00 35.03 34.10 1vld n LYS 729 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1vld s TYR 730 N -2.42 3.80 -0.27 2.13 2.02 -0.95 -4.80 117.35 116.86 1vld s TYR 730 Ca -0.29 -3.16 0.25 0.00 -0.37 0.00 0.00 57.07 53.50 1vld s TYR 730 Cb 0.09 -3.05 1.15 0.00 -0.40 0.00 0.00 41.96 39.75 1vld s TYR 730 CO 0.46 -0.66 1.74 -1.00 -1.57 0.00 0.00 175.55 174.52 1vld h PRO 731 N 5.75 0.00 -5.71 -1.71 0.13 -1.63 -3.34 132.00 125.49 1vld h PRO 731 Ca 0.16 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.71 1vld h PRO 731 Cb 0.79 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.83 1vld h PRO 731 CO 0.81 0.00 -0.12 -0.51 -0.23 0.00 0.00 178.00 177.95 1vld s LEU 732 N -4.70 4.26 -0.39 1.56 1.43 -0.88 -4.93 118.68 115.03 1vld s LEU 732 Ca 0.01 0.80 -0.20 0.00 -1.03 0.00 0.00 54.13 53.72 1vld s LEU 732 Cb 0.08 -2.71 0.01 0.00 0.03 0.00 0.00 46.19 43.60 1vld s LEU 732 CO 0.33 -0.03 0.60 -0.83 0.23 0.00 0.00 176.35 176.65 1vld s GLY 733 N 0.71 1.76 -0.15 -3.19 0.00 -0.19 -1.39 107.32 104.87 1vld s GLY 733 Ca 0.26 -1.04 -0.06 0.00 0.00 0.00 0.00 44.72 43.87 1vld s GLY 733 CO 0.10 1.44 0.07 -0.29 0.00 0.00 0.00 173.10 174.43 1vld s MET 734 N 2.65 3.68 -0.05 2.90 1.75 0.12 -1.41 119.30 128.93 1vld s MET 734 Ca 0.22 -0.29 0.06 0.00 -1.25 0.00 0.00 55.69 54.43 1vld s MET 734 Cb -0.15 -3.14 -0.01 0.00 2.84 0.00 0.00 34.83 34.37 1vld s MET 734 CO 0.16 0.48 -0.24 -0.48 -0.65 0.00 0.00 175.02 174.28 1vld s LEU 735 N -0.21 2.11 -0.58 4.11 2.34 -0.99 -2.45 118.68 123.02 1vld s LEU 735 Ca 0.08 -0.48 0.05 0.00 0.06 0.00 0.00 54.13 53.84 1vld s LEU 735 Cb -0.12 -1.38 0.18 0.00 -0.56 0.00 0.00 46.19 44.32 1vld s LEU 735 CO 0.01 0.27 0.47 -1.54 -1.06 0.00 0.00 176.35 174.50 1vld n SER 736 N 2.79 1.72 -3.19 1.48 3.41 -1.26 -2.67 113.62 115.89 1vld n SER 736 Ca -0.17 -2.92 -0.20 0.00 -0.26 0.00 0.00 58.87 55.32 1vld n SER 736 Cb 0.52 -0.67 0.17 0.00 -0.26 0.00 0.00 64.21 63.97 1vld n SER 736 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1vld n PRO 737 N 2.10 -2.80 -2.42 4.33 -0.02 -1.26 -4.04 135.00 130.89 1vld n PRO 737 Ca 0.24 -1.11 -0.39 0.00 -2.02 0.00 0.00 63.50 60.22 1vld n PRO 737 Cb 0.41 -1.13 -0.04 0.00 -0.02 0.00 0.00 33.50 32.73 1vld n PRO 737 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1vld s HIS 738 N -2.17 3.37 0.02 6.00 3.76 -1.26 -1.47 115.29 123.54 1vld s HIS 738 Ca 0.46 1.64 -0.32 0.00 -0.15 0.00 0.00 55.06 56.69 1vld s HIS 738 Cb -0.05 -3.31 -0.11 0.00 1.11 0.00 0.00 32.58 30.22 1vld s HIS 738 CO 0.36 -0.83 1.88 -0.35 -0.85 0.00 0.00 174.74 174.95 1vld n PRO 739 N 0.67 2.53 -0.24 8.40 -0.04 -1.26 -4.85 135.00 140.21 1vld n PRO 739 Ca 0.01 0.93 -0.06 0.00 -0.04 0.00 0.00 63.50 64.34 1vld n PRO 739 Cb 0.46 -2.81 0.05 0.00 -0.04 0.00 0.00 33.50 31.15 1vld n PRO 739 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1vld h ARG 740 N 9.26 0.91 -0.78 0.54 9.65 -1.94 -3.15 114.38 128.88 1vld h ARG 740 Ca -0.48 -0.09 -0.48 0.00 -1.10 0.00 0.00 59.98 57.83 1vld h ARG 740 Cb 1.25 -0.19 -0.27 0.00 -1.39 0.00 0.00 29.97 29.37 1vld h ARG 740 CO 0.94 0.66 0.27 1.19 2.80 0.00 0.00 179.97 185.83 1vld n PHE 741 N -4.56 2.53 -3.60 2.20 3.01 -1.26 -4.86 117.46 110.92 1vld n PHE 741 Ca 0.05 -2.23 -0.10 0.00 1.01 0.00 0.00 57.45 56.18 1vld n PHE 741 Cb 0.06 -0.88 -0.06 0.00 -0.01 0.00 0.00 39.48 38.59 1vld n PHE 741 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1vld s SER 742 N -2.21 -0.41 -1.11 4.37 0.15 -1.19 -4.23 113.70 109.07 1vld s SER 742 Ca 0.55 0.62 -0.16 0.00 0.70 0.00 0.00 55.95 57.66 1vld s SER 742 Cb 0.46 0.57 0.15 0.00 -1.71 0.00 0.00 66.02 65.49 1vld s SER 742 CO 0.03 -0.26 1.33 -0.32 1.20 0.00 0.00 173.24 175.21 1vld s MET 743 N -0.51 3.91 7.61 5.44 1.75 -1.19 -4.40 119.30 131.92 1vld s MET 743 Ca 0.00 -2.27 0.00 0.00 -1.25 0.00 0.00 55.69 52.17 1vld s MET 743 Cb -0.02 -5.02 0.00 0.00 2.84 0.00 0.00 34.83 32.62 1vld s MET 743 CO -0.02 -1.78 0.00 0.72 -0.65 0.00 0.00 175.02 173.29 1vld n HIS 744 N 6.03 0.00 1.53 4.11 8.25 -1.26 -0.82 115.22 133.06 1vld n HIS 744 Ca 0.32 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.91 1vld n HIS 744 Cb 0.45 0.01 0.75 0.00 1.12 0.00 0.00 29.99 32.32 1vld n HIS 744 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1vld n THR 745 N 0.00 0.06 -2.32 1.59 -2.24 -1.17 -4.33 114.28 105.87 1vld n THR 745 Ca 0.00 0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.37 1vld n THR 745 Cb 0.00 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 67.64 1vld n THR 745 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1vld n MET 746 N -1.09 3.84 0.00 -0.78 2.81 -0.00 -4.01 117.12 117.88 1vld n MET 746 Ca 0.18 -3.58 0.00 0.00 -1.81 0.00 0.00 57.70 52.48 1vld n MET 746 Cb 0.13 -2.85 0.00 0.00 -0.71 0.00 0.00 33.22 29.79 1vld n MET 746 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1vld n GLY 747 N 2.51 -0.44 3.56 3.03 0.00 -1.26 -3.15 105.19 109.45 1vld n GLY 747 Ca 0.42 0.22 -0.31 0.00 0.00 0.00 0.00 46.02 46.36 1vld n GLY 747 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vld n ASP 748 N 0.00 -0.69 0.00 1.61 2.03 -1.26 -4.71 116.55 113.53 1vld n ASP 748 Ca 0.00 0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.57 1vld n ASP 748 Cb 0.00 -1.35 0.00 0.00 -0.72 0.00 0.00 41.12 39.05 1vld n ASP 748 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1vld n GLY 749 N 0.75 0.94 2.95 0.27 0.00 -1.26 -4.75 105.19 104.09 1vld n GLY 749 Ca 0.09 -0.60 -0.02 0.00 0.00 0.00 0.00 46.02 45.48 1vld n GLY 749 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vld n LYS 750 N 0.00 -1.95 -3.13 1.61 5.02 -1.26 -1.94 118.16 116.51 1vld n LYS 750 Ca 0.00 0.56 -0.22 0.00 -2.02 0.00 0.00 58.31 56.62 1vld n LYS 750 Cb 0.00 -5.02 0.02 0.00 -0.02 0.00 0.00 35.03 30.01 1vld n LYS 750 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1vld n ASN 751 N -0.97 -5.25 -3.39 4.39 5.15 -1.26 -4.33 115.26 109.60 1vld n ASN 751 Ca -0.02 -0.31 -0.22 0.00 -0.60 0.00 0.00 54.58 53.42 1vld n ASN 751 Cb 0.51 -4.27 0.17 0.00 -0.53 0.00 0.00 39.78 35.66 1vld n ASN 751 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1vld n SER 752 N -2.43 -0.64 0.08 1.20 3.41 -0.82 -4.92 113.62 109.50 1vld n SER 752 Ca -0.08 -1.23 -0.10 0.00 -0.26 0.00 0.00 58.87 57.20 1vld n SER 752 Cb 0.59 -0.77 -0.08 0.00 -0.26 0.00 0.00 64.21 63.70 1vld n SER 752 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1vld h TYR 753 N -1.91 0.25 -0.01 7.33 0.05 -1.85 -3.26 116.97 117.56 1vld h TYR 753 Ca -0.32 -0.16 0.00 0.00 0.05 0.00 0.00 58.73 58.30 1vld h TYR 753 Cb 0.92 -0.02 -0.00 0.00 1.01 0.00 0.00 36.73 38.64 1vld h TYR 753 CO 0.00 1.06 0.11 0.52 -1.05 0.00 0.00 178.16 178.80 1vld h MET 754 N 0.06 0.00 0.00 4.88 2.86 -1.88 -1.39 114.93 119.46 1vld h MET 754 Ca -0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1vld h MET 754 Cb 1.71 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.37 1vld h MET 754 CO 0.15 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.21 1vld n ASN 755 N -3.11 0.00 -0.15 1.22 3.02 -1.23 -1.86 115.26 113.16 1vld n ASN 755 Ca -0.02 -0.79 0.04 0.00 -0.03 0.00 0.00 54.58 53.78 1vld n ASN 755 Cb 0.18 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.34 1vld n ASN 755 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1vld n TYR 756 N -0.81 0.00 -1.86 3.10 4.02 -0.52 -4.72 117.16 116.36 1vld n TYR 756 Ca 0.09 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.56 1vld n TYR 756 Cb 0.04 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.33 1vld n TYR 756 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1vld s ILE 757 N -1.41 2.73 0.16 -0.72 1.01 -0.77 -4.90 121.20 117.30 1vld s ILE 757 Ca 0.06 0.32 -0.24 0.00 0.00 0.00 0.00 60.65 60.80 1vld s ILE 757 Cb 0.07 -3.21 0.05 0.00 0.01 0.00 0.00 42.46 39.38 1vld s ILE 757 CO 0.26 0.01 1.59 0.11 0.00 0.00 0.00 174.94 176.90 1vld h LYS 758 N 7.93 -0.26 -0.95 2.79 1.57 -1.90 -2.05 116.57 123.71 1vld h LYS 758 Ca -0.43 0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.28 1vld h LYS 758 Cb 1.21 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.53 1vld h LYS 758 CO 0.93 -0.17 0.10 -3.47 -0.57 0.00 0.00 179.45 176.28 1vld n ASP 759 N -5.42 2.82 -0.03 0.86 2.03 -1.26 -3.91 116.55 111.64 1vld n ASP 759 Ca 0.01 -2.37 -0.05 0.00 0.52 0.00 0.00 54.79 52.90 1vld n ASP 759 Cb 0.35 -0.58 -0.02 0.00 -0.72 0.00 0.00 41.12 40.15 1vld n ASP 759 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 1vld n HIS 760 N 0.10 0.00 -3.69 -0.67 -0.00 -0.78 -4.98 115.22 105.20 1vld n HIS 760 Ca 0.13 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.20 1vld n HIS 760 Cb 0.69 -0.21 -0.10 0.00 -0.12 0.00 0.00 29.99 30.25 1vld n HIS 760 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1vld s ARG 761 N -2.11 0.47 -0.19 1.57 0.52 -1.19 -4.11 118.95 113.91 1vld s ARG 761 Ca -0.08 0.80 -0.08 0.00 -0.52 0.00 0.00 55.73 55.85 1vld s ARG 761 Cb 0.03 0.08 -0.04 0.00 0.52 0.00 0.00 34.95 35.53 1vld s ARG 761 CO 0.11 -0.13 0.07 0.08 0.02 0.00 0.00 175.30 175.46 1vld s VAL 762 N 1.09 4.82 0.11 3.52 1.01 -0.27 -4.73 120.40 125.95 1vld s VAL 762 Ca -0.07 -0.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.66 1vld s VAL 762 Cb -0.06 -3.19 -0.07 0.00 0.00 0.00 0.00 36.38 33.06 1vld s VAL 762 CO -0.10 0.44 0.71 -0.70 0.00 0.00 0.00 175.10 175.45 1vld s GLU 763 N 0.52 4.45 -0.24 2.72 2.12 -1.26 0.41 118.70 127.41 1vld s GLU 763 Ca 0.04 1.01 -0.03 0.00 0.36 0.00 0.00 54.97 56.34 1vld s GLU 763 Cb -0.13 -3.28 0.13 0.00 0.26 0.00 0.00 34.13 31.12 1vld s GLU 763 CO 0.01 0.53 0.39 0.08 -0.54 0.00 0.00 175.26 175.73 1vld s VAL 764 N -0.92 -0.62 -0.80 3.70 1.01 -0.71 -4.90 120.40 117.16 1vld s VAL 764 Ca 0.34 -0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.24 1vld s VAL 764 Cb -0.21 -0.79 0.01 0.00 0.00 0.00 0.00 36.38 35.38 1vld s VAL 764 CO 0.23 -0.09 0.65 0.47 0.00 0.00 0.00 175.10 176.37 1vld n ASP 765 N 5.37 -4.52 0.00 3.32 8.00 -1.26 -3.06 116.55 124.39 1vld n ASP 765 Ca -0.04 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.16 1vld n ASP 765 Cb 0.50 -3.13 0.00 0.00 -0.02 0.00 0.00 41.12 38.47 1vld n ASP 765 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vld n GLY 766 N -1.36 0.85 3.11 0.44 0.00 -1.26 -4.99 105.19 101.97 1vld n GLY 766 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1vld n GLY 766 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1vld s TYR 767 N -3.46 2.66 -0.43 1.61 5.04 -1.17 -5.09 117.35 116.50 1vld s TYR 767 Ca 0.00 -1.53 -0.28 0.00 -2.44 0.00 0.00 57.07 52.82 1vld s TYR 767 Cb 0.00 -1.85 0.03 0.00 0.35 0.00 0.00 41.96 40.49 1vld s TYR 767 CO 0.00 -0.75 1.08 0.15 -1.34 0.00 0.00 175.55 174.69 1vld s LYS 768 N 1.24 3.79 0.30 4.97 1.02 -1.26 -1.75 119.74 128.05 1vld s LYS 768 Ca 0.03 0.63 -0.07 0.00 0.02 0.00 0.00 55.97 56.58 1vld s LYS 768 Cb -0.13 -3.86 -0.06 0.00 -0.52 0.00 0.00 37.83 33.26 1vld s LYS 768 CO -0.11 -1.22 0.60 0.71 -0.92 0.00 0.00 175.35 174.41 1vld s TYR 769 N 4.11 3.47 0.28 3.18 1.51 0.17 -4.80 117.35 125.26 1vld s TYR 769 Ca 0.45 0.76 -0.29 0.00 -1.01 0.00 0.00 57.07 56.98 1vld s TYR 769 Cb -0.09 -2.20 -0.10 0.00 -0.11 0.00 0.00 41.96 39.47 1vld s TYR 769 CO 0.26 0.13 1.15 -0.46 -1.11 0.00 0.00 175.55 175.53 1vld s TRP 770 N -2.10 3.45 -0.01 2.71 -0.11 -1.26 -1.12 118.94 120.50 1vld s TRP 770 Ca 0.46 1.61 -0.22 0.00 1.22 0.00 0.00 56.10 59.17 1vld s TRP 770 Cb -0.11 -3.38 -0.05 0.00 -1.50 0.00 0.00 33.47 28.43 1vld s TRP 770 CO 0.29 -0.89 0.65 0.42 -4.62 0.00 0.00 176.95 172.79 1vld s ILE 771 N -1.05 4.90 -0.12 5.86 1.01 -1.26 -1.17 121.20 129.38 1vld s ILE 771 Ca 0.46 1.35 0.02 0.00 0.00 0.00 0.00 60.65 62.48 1vld s ILE 771 Cb -0.34 -3.99 0.01 0.00 0.01 0.00 0.00 42.46 38.16 1vld s ILE 771 CO 0.43 0.38 -0.18 -0.32 0.00 0.00 0.00 174.94 175.25 1vld s MET 772 N 0.03 2.52 0.11 2.79 -2.45 -1.08 -4.42 119.30 116.80 1vld s MET 772 Ca 0.34 -0.67 -0.22 0.00 -1.25 0.00 0.00 55.69 53.88 1vld s MET 772 Cb -0.18 -2.08 -0.07 0.00 1.25 0.00 0.00 34.83 33.74 1vld s MET 772 CO 0.18 -0.04 0.67 1.03 1.05 0.00 0.00 175.02 177.92 1vld s ARG 773 N 0.90 4.38 -0.02 4.11 0.52 0.07 -0.63 118.95 128.28 1vld s ARG 773 Ca -0.07 0.94 -0.01 0.00 -0.52 0.00 0.00 55.73 56.07 1vld s ARG 773 Cb -0.15 -3.26 0.01 0.00 0.52 0.00 0.00 34.95 32.07 1vld s ARG 773 CO -0.01 0.57 0.04 0.08 0.02 0.00 0.00 175.30 176.00 1vld s VAL 774 N -1.00 -0.02 0.16 3.52 1.01 -0.42 -2.31 120.40 121.33 1vld s VAL 774 Ca 0.33 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.07 1vld s VAL 774 Cb -0.21 -0.07 -0.08 0.00 0.00 0.00 0.00 36.38 36.02 1vld s VAL 774 CO 0.22 0.03 1.23 0.21 0.00 0.00 0.00 175.10 176.79 1vld s ASN 775 N 0.35 7.04 0.19 3.32 3.84 -1.25 -0.10 114.94 128.32 1vld s ASN 775 Ca -0.03 2.22 -0.14 0.00 0.21 0.00 0.00 52.86 55.12 1vld s ASN 775 Cb -0.04 -2.60 0.19 0.00 -0.55 0.00 0.00 41.25 38.25 1vld s ASN 775 CO -0.01 -0.44 1.26 -1.54 -2.79 0.00 0.00 177.10 173.58 1vld n SER 776 N 2.94 -0.54 -0.32 -4.21 3.41 -0.96 -0.59 113.62 113.35 1vld n SER 776 Ca 0.06 1.42 0.13 0.00 -0.26 0.00 0.00 58.87 60.23 1vld n SER 776 Cb 0.44 -0.32 0.32 0.00 -0.26 0.00 0.00 64.21 64.39 1vld n SER 776 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1vld h ILE 777 N 0.00 0.57 0.00 -1.33 2.04 -1.91 0.31 117.51 117.18 1vld h ILE 777 Ca 0.28 -0.19 -0.18 0.00 1.00 0.00 0.00 64.86 65.77 1vld h ILE 777 Cb 0.48 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.52 1vld h ILE 777 CO -0.81 0.10 -0.85 0.44 0.00 0.00 0.00 178.15 177.03 1vld h ASP 778 N 0.54 0.00 0.26 1.72 3.32 -1.23 -2.46 116.42 118.58 1vld h ASP 778 Ca 0.57 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.61 1vld h ASP 778 Cb 1.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1vld h ASP 778 CO -0.46 0.85 -0.13 0.00 -1.72 0.00 0.00 179.24 177.79 1vld h ALA 779 N 1.15 -0.62 -0.71 3.45 0.00 -0.20 -2.86 119.26 119.47 1vld h ALA 779 Ca -0.01 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 54.96 1vld h ALA 779 Cb 1.57 0.14 -0.13 0.00 0.00 0.00 0.00 17.79 19.36 1vld h ALA 779 CO 0.11 -0.60 -0.27 1.49 0.00 0.00 0.00 179.25 179.99 1vld h GLU 780 N -0.58 -0.07 -0.35 0.00 4.22 -0.62 0.58 114.58 117.76 1vld h GLU 780 Ca -0.04 0.00 0.10 0.00 0.08 0.00 0.00 59.36 59.51 1vld h GLU 780 Cb 0.27 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1vld h GLU 780 CO 0.06 -0.04 0.42 0.00 -2.18 0.00 0.00 179.01 177.26 1vld h ALA 781 N 1.41 2.01 -0.31 2.92 0.00 -1.50 0.19 119.26 123.98 1vld h ALA 781 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1vld h ALA 781 Cb 0.56 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1vld h ALA 781 CO -0.75 -0.60 0.00 0.54 0.00 0.00 0.00 179.25 178.44 1vld n ARG 782 N -3.63 2.31 -3.11 0.00 1.74 0.19 -4.97 116.66 109.18 1vld n ARG 782 Ca 0.06 -1.94 -0.14 0.00 -0.77 0.00 0.00 57.85 55.06 1vld n ARG 782 Cb 0.57 -1.31 0.06 0.00 -1.02 0.00 0.00 32.46 30.77 1vld n ARG 782 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vld n GLY 783 N 0.75 -0.14 3.26 -0.13 0.00 0.68 -4.65 105.19 104.95 1vld n GLY 783 Ca 0.13 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1vld n GLY 783 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vld s ILE 784 N -3.26 2.26 0.03 -0.61 1.01 -0.32 -4.88 121.20 115.43 1vld s ILE 784 Ca 0.11 -0.96 0.06 0.00 0.00 0.00 0.00 60.65 59.87 1vld s ILE 784 Cb -0.05 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.52 1vld s ILE 784 CO 0.53 0.56 -0.17 -0.54 0.00 0.00 0.00 174.94 175.32 1vld s LYS 785 N 0.27 2.15 -0.64 2.79 1.02 -1.26 -3.90 119.74 120.16 1vld s LYS 785 Ca -0.15 -0.94 -0.31 0.00 0.02 0.00 0.00 55.97 54.59 1vld s LYS 785 Cb -0.17 -2.23 -0.14 0.00 -0.52 0.00 0.00 37.83 34.77 1vld s LYS 785 CO 0.08 0.55 2.45 -1.71 -0.92 0.00 0.00 175.35 175.80 1vld n ASN 786 N 1.62 1.46 0.00 2.83 4.05 -1.26 -1.11 115.26 122.85 1vld n ASN 786 Ca -0.16 0.02 0.00 0.00 0.45 0.00 0.00 54.58 54.89 1vld n ASN 786 Cb 0.52 -1.23 0.00 0.00 1.23 0.00 0.00 39.78 40.30 1vld n ASN 786 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1vld n GLY 787 N 6.39 1.16 3.82 8.20 0.00 -0.37 -4.93 105.19 119.45 1vld n GLY 787 Ca 0.50 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.18 1vld n GLY 787 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vld s ASP 788 N -1.13 6.72 -0.42 1.61 1.01 -0.27 -4.71 116.67 119.48 1vld s ASP 788 Ca 0.00 1.74 -0.28 0.00 0.71 0.00 0.00 52.55 54.72 1vld s ASP 788 Cb 0.00 -2.54 0.02 0.00 1.01 0.00 0.00 42.92 41.41 1vld s ASP 788 CO 0.00 -0.51 1.07 -0.76 0.21 0.00 0.00 175.17 175.17 1vld s LEU 789 N -3.39 3.80 0.34 1.23 1.43 -1.26 -1.08 118.68 119.75 1vld s LEU 789 Ca 0.63 0.57 0.08 0.00 -1.03 0.00 0.00 54.13 54.37 1vld s LEU 789 Cb -0.11 -3.46 -0.03 0.00 0.03 0.00 0.00 46.19 42.62 1vld s LEU 789 CO 0.17 -1.09 0.28 0.27 0.23 0.00 0.00 176.35 176.22 1vld s ILE 790 N 4.04 3.48 -0.15 -0.59 -4.36 0.13 -0.36 121.20 123.39 1vld s ILE 790 Ca 0.44 -1.40 0.01 0.00 -0.26 0.00 0.00 60.65 59.44 1vld s ILE 790 Cb -0.09 -3.16 0.02 0.00 1.25 0.00 0.00 42.46 40.47 1vld s ILE 790 CO 0.25 -0.17 -0.16 -0.60 0.24 0.00 0.00 174.94 174.50 1vld s ARG 791 N -3.98 2.51 -0.15 0.37 3.52 0.70 -0.59 118.95 121.32 1vld s ARG 791 Ca 0.41 -0.64 -0.07 0.00 -0.13 0.00 0.00 55.73 55.29 1vld s ARG 791 Cb -0.05 -2.22 -0.04 0.00 -1.56 0.00 0.00 34.95 31.08 1vld s ARG 791 CO 0.26 -0.20 0.09 0.00 -0.81 0.00 0.00 175.30 174.65 1vld s ALA 792 N 1.34 3.61 0.35 6.12 0.00 0.28 -2.22 121.76 131.24 1vld s ALA 792 Ca 0.03 -0.71 -0.14 0.00 0.00 0.00 0.00 51.96 51.15 1vld s ALA 792 Cb -0.13 -1.93 0.04 0.00 0.00 0.00 0.00 23.12 21.10 1vld s ALA 792 CO -0.10 0.39 0.70 1.52 0.00 0.00 0.00 175.76 178.27 1vld s TYR 793 N -0.30 0.26 0.00 0.00 -0.85 -0.84 0.03 117.35 115.65 1vld s TYR 793 Ca 0.10 -0.80 0.00 0.00 -0.52 0.00 0.00 57.07 55.85 1vld s TYR 793 Cb -0.12 0.60 0.00 0.00 0.38 0.00 0.00 41.96 42.82 1vld s TYR 793 CO 0.01 -1.40 0.00 0.27 -1.52 0.00 0.00 175.55 172.92 1vld n ASN 794 N -1.18 0.00 0.27 -0.18 0.23 -0.91 -2.11 115.26 111.37 1vld n ASN 794 Ca -0.05 -0.93 0.18 0.00 -0.53 0.00 0.00 54.58 53.25 1vld n ASN 794 Cb 0.60 0.00 0.89 0.00 -2.08 0.00 0.00 39.78 39.20 1vld n ASN 794 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1vld h ASP 795 N 0.00 0.00 1.18 0.53 3.32 -1.95 -2.90 116.42 116.60 1vld h ASP 795 Ca 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1vld h ASP 795 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1vld h ASP 795 CO 0.00 0.00 -0.86 0.03 -1.72 0.00 0.00 179.24 176.69 1vld h ARG 796 N 0.00 0.00 0.00 3.56 3.08 -1.89 -3.49 114.38 115.63 1vld h ARG 796 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1vld h ARG 796 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1vld h ARG 796 CO 0.00 0.44 0.00 0.41 -1.07 0.00 0.00 179.97 179.75 1vld n GLY 797 N 1.29 -1.62 3.11 0.04 0.00 -1.10 -4.80 105.19 102.12 1vld n GLY 797 Ca -0.02 -1.18 -0.16 0.00 0.00 0.00 0.00 46.02 44.66 1vld n GLY 797 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vld s SER 798 N -3.21 1.25 -0.03 1.61 0.01 -1.26 -2.15 113.70 109.91 1vld s SER 798 Ca 0.00 -0.58 -0.01 0.00 1.31 0.00 0.00 55.95 56.67 1vld s SER 798 Cb 0.00 -0.00 0.03 0.00 0.21 0.00 0.00 66.02 66.26 1vld s SER 798 CO 0.00 -0.14 0.05 -0.69 0.41 0.00 0.00 173.24 172.86 1vld s VAL 799 N -1.34 -0.07 -0.13 3.43 1.01 0.10 -2.56 120.40 120.84 1vld s VAL 799 Ca -0.06 0.25 -0.20 0.00 0.00 0.00 0.00 61.98 61.97 1vld s VAL 799 Cb -0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1vld s VAL 799 CO 0.01 0.10 0.56 -0.63 0.00 0.00 0.00 175.10 175.15 1vld s ILE 800 N 1.27 5.11 0.21 2.22 1.09 -0.16 -0.56 121.20 130.38 1vld s ILE 800 Ca -0.07 1.11 -0.00 0.00 -1.10 0.00 0.00 60.65 60.58 1vld s ILE 800 Cb -0.13 -3.89 -0.04 0.00 -1.06 0.00 0.00 42.46 37.34 1vld s ILE 800 CO -0.03 0.24 0.13 -0.76 -0.10 0.00 0.00 174.94 174.42 1vld s LEU 801 N 1.07 1.24 -0.38 2.97 1.43 0.24 -4.58 118.68 120.66 1vld s LEU 801 Ca 0.29 -1.40 -0.11 0.00 -1.03 0.00 0.00 54.13 51.88 1vld s LEU 801 Cb -0.16 0.33 0.03 0.00 0.03 0.00 0.00 46.19 46.42 1vld s LEU 801 CO 0.12 -0.83 0.22 0.00 0.23 0.00 0.00 176.35 176.09 1vld s ALA 802 N -4.08 3.30 0.33 4.21 0.00 -0.32 0.22 121.76 125.42 1vld s ALA 802 Ca 0.39 -1.75 -0.29 0.00 0.00 0.00 0.00 51.96 50.31 1vld s ALA 802 Cb 0.07 -2.64 -0.11 0.00 0.00 0.00 0.00 23.12 20.44 1vld s ALA 802 CO 0.13 -1.42 1.45 0.00 0.00 0.00 0.00 175.76 175.91 1vld s ALA 803 N 1.56 3.59 -0.34 0.00 0.00 -0.24 -2.62 121.76 123.71 1vld s ALA 803 Ca 0.02 1.45 0.03 0.00 0.00 0.00 0.00 51.96 53.46 1vld s ALA 803 Cb -0.19 -3.57 0.10 0.00 0.00 0.00 0.00 23.12 19.46 1vld s ALA 803 CO 0.07 -0.88 0.07 -1.14 0.00 0.00 0.00 175.76 173.88 1vld s GLN 804 N -1.47 1.30 0.20 0.00 0.74 0.19 -1.23 119.66 119.39 1vld s GLN 804 Ca 0.54 -1.69 -0.30 0.00 0.05 0.00 0.00 55.36 53.96 1vld s GLN 804 Cb -0.44 -2.90 -0.09 0.00 1.10 0.00 0.00 33.01 30.68 1vld s GLN 804 CO 0.55 -0.96 1.28 0.08 -0.55 0.00 0.00 175.29 175.69 1vld s VAL 805 N 1.05 3.27 0.35 1.34 1.01 -1.26 -1.30 120.40 124.87 1vld s VAL 805 Ca 0.11 1.07 -0.10 0.00 0.00 0.00 0.00 61.98 63.05 1vld s VAL 805 Cb -0.19 -3.68 0.03 0.00 0.00 0.00 0.00 36.38 32.54 1vld s VAL 805 CO -0.12 0.17 0.63 0.28 0.00 0.00 0.00 175.10 176.06 1vld s THR 806 N -0.01 0.00 -0.44 3.92 -1.32 0.86 -4.89 115.64 113.76 1vld s THR 806 Ca 0.55 -1.28 0.10 0.00 -1.21 0.00 0.00 61.69 59.85 1vld s THR 806 Cb -0.36 -2.68 -0.11 0.00 -1.51 0.00 0.00 72.50 67.85 1vld s THR 806 CO 0.39 0.00 0.41 -0.62 -2.21 0.00 0.00 174.62 172.58 1vld n GLU 807 N -0.53 3.63 0.00 7.08 -0.58 -1.26 -2.27 120.64 126.71 1vld n GLU 807 Ca -0.04 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 1vld n GLU 807 Cb 0.61 -0.97 0.00 0.00 -0.57 0.00 0.00 31.44 30.50 1vld n GLU 807 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1vld s LEU 809 N 0.00 1.34 0.00 0.00 1.43 -1.26 -1.17 118.68 119.02 1vld s LEU 809 Ca 0.00 -0.47 -0.21 0.00 -1.03 0.00 0.00 54.13 52.42 1vld s LEU 809 Cb 0.00 1.03 -0.05 0.00 0.03 0.00 0.00 46.19 47.20 1vld s LEU 809 CO 0.00 -0.64 0.62 -1.58 0.23 0.00 0.00 176.35 174.98 1vld s GLN 810 N -3.11 4.34 -0.24 1.70 0.74 -1.26 -4.83 119.66 117.00 1vld s GLN 810 Ca -0.01 0.78 -0.42 0.00 0.05 0.00 0.00 55.36 55.76 1vld s GLN 810 Cb 0.01 -3.34 -0.18 0.00 1.10 0.00 0.00 33.01 30.60 1vld s GLN 810 CO -0.07 0.37 1.51 -2.30 -0.55 0.00 0.00 175.29 174.25 1vld n PRO 811 N 2.70 0.57 0.00 1.67 -0.02 -1.26 -0.51 135.00 138.15 1vld n PRO 811 Ca -0.06 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1vld n PRO 811 Cb 0.51 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 1vld n PRO 811 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vld n GLY 812 N 3.37 0.76 3.30 -1.23 0.00 -1.26 -5.08 105.19 105.06 1vld n GLY 812 Ca 0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 1vld n GLY 812 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vld s THR 813 N -2.03 3.01 0.10 2.61 2.01 0.33 -1.03 115.64 120.65 1vld s THR 813 Ca 0.00 -0.64 0.06 0.00 0.31 0.00 0.00 61.69 61.42 1vld s THR 813 Cb 0.00 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 1vld s THR 813 CO 0.00 0.48 -0.03 0.68 -0.69 0.00 0.00 174.62 175.06 1vld s VAL 814 N 0.99 3.80 -0.09 3.82 -7.23 -0.50 -4.43 120.40 116.75 1vld s VAL 814 Ca -0.01 -1.12 -0.01 0.00 -1.81 0.00 0.00 61.98 59.03 1vld s VAL 814 Cb -0.15 -2.81 0.03 0.00 0.56 0.00 0.00 36.38 34.01 1vld s VAL 814 CO -0.01 0.09 -0.00 -2.28 -0.31 0.00 0.00 175.10 172.59 1vld s HIS 815 N -1.32 0.81 -0.04 2.82 5.04 -0.98 -2.35 115.29 119.27 1vld s HIS 815 Ca 0.25 -0.32 -0.02 0.00 -1.54 0.00 0.00 55.06 53.43 1vld s HIS 815 Cb -0.11 -0.88 0.03 0.00 0.04 0.00 0.00 32.58 31.66 1vld s HIS 815 CO 0.17 -0.38 0.07 0.45 -2.34 0.00 0.00 174.74 172.70 1vld s SER 816 N 1.93 1.14 0.72 9.88 0.15 -1.09 -0.75 113.70 125.67 1vld s SER 816 Ca 0.04 0.08 -0.16 0.00 0.70 0.00 0.00 55.95 56.62 1vld s SER 816 Cb -0.13 -0.12 -0.01 0.00 -1.71 0.00 0.00 66.02 64.05 1vld s SER 816 CO -0.06 -0.25 0.81 -1.22 1.20 0.00 0.00 173.24 173.72 1vld n TYR 817 N 5.30 0.14 -3.21 3.44 0.53 -1.26 -4.16 117.16 117.94 1vld n TYR 817 Ca -0.03 0.38 0.00 0.00 -1.02 0.00 0.00 57.90 57.23 1vld n TYR 817 Cb 0.50 -2.02 0.00 0.00 -1.03 0.00 0.00 39.34 36.79 1vld n TYR 817 CO 0.00 0.00 0.00 -0.85 -1.02 0.00 0.00 176.86 174.99 1vld n GLU 818 N -1.47 1.60 -0.99 -0.72 -0.00 -0.54 -4.67 120.64 113.84 1vld n GLU 818 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.28 1vld n GLU 818 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.94 1vld n GLU 818 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1vld n SER 819 N -2.02 -2.93 -4.61 -1.84 7.64 -0.31 -4.14 113.62 105.40 1vld n SER 819 Ca 0.00 0.00 -0.57 0.00 1.01 0.00 0.00 58.87 59.31 1vld n SER 819 Cb 0.00 -0.87 -0.07 0.00 -1.01 0.00 0.00 64.21 62.26 1vld n SER 819 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vld n ALA 821 N 3.01 2.57 -2.99 0.00 0.00 -1.26 -4.44 120.51 117.39 1vld n ALA 821 Ca 0.22 -0.14 -0.36 0.00 0.00 0.00 0.00 53.44 53.16 1vld n ALA 821 Cb 0.12 -1.39 -0.12 0.00 0.00 0.00 0.00 19.45 18.05 1vld n ALA 821 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1vld s VAL 822 N -3.03 4.42 -0.29 0.00 1.01 -1.26 -3.69 120.40 117.56 1vld s VAL 822 Ca 0.12 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 61.94 1vld s VAL 822 Cb 0.17 -3.05 0.04 0.00 0.00 0.00 0.00 36.38 33.54 1vld s VAL 822 CO 0.58 0.36 -0.00 -0.47 0.00 0.00 0.00 175.10 175.57 1vld s TYR 823 N 1.41 3.19 -0.37 5.22 5.04 -1.26 -3.85 117.35 126.73 1vld s TYR 823 Ca 0.05 -1.65 0.02 0.00 -2.44 0.00 0.00 57.07 53.05 1vld s TYR 823 Cb -0.15 -2.12 0.15 0.00 0.35 0.00 0.00 41.96 40.19 1vld s TYR 823 CO 0.04 -0.75 0.29 0.34 -1.34 0.00 0.00 175.55 174.12 1vld s ASP 824 N 1.31 2.13 0.27 4.32 2.15 -1.26 -4.73 116.67 120.86 1vld s ASP 824 Ca -0.03 -2.18 -0.29 0.00 0.43 0.00 0.00 52.55 50.48 1vld s ASP 824 Cb -0.19 -0.10 -0.09 0.00 -0.30 0.00 0.00 42.92 42.24 1vld s ASP 824 CO -0.01 -0.27 1.12 -2.16 -0.17 0.00 0.00 175.17 173.68 1vld s PRO 825 N 0.98 4.61 0.01 4.34 0.04 -1.26 -1.25 135.00 142.46 1vld s PRO 825 Ca 0.21 1.83 0.26 0.00 0.04 0.00 0.00 61.00 63.33 1vld s PRO 825 Cb -0.16 -3.19 1.09 0.00 0.04 0.00 0.00 34.50 32.28 1vld s PRO 825 CO -0.04 0.16 1.82 1.28 0.04 0.00 0.00 177.00 180.27 1vld n LEU 826 N 1.30 0.02 0.00 -3.56 4.77 0.94 -4.71 117.00 115.76 1vld n LEU 826 Ca -0.01 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 1vld n LEU 826 Cb 0.45 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 1vld n LEU 826 CO 0.54 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 1vld n GLY 827 N 1.15 5.41 3.67 -0.72 0.00 -1.26 -4.95 105.19 108.49 1vld n GLY 827 Ca 0.06 -1.20 -0.46 0.00 0.00 0.00 0.00 46.02 44.42 1vld n GLY 827 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1vld n THR 828 N 0.00 0.11 -1.59 2.61 -1.04 -1.26 -4.48 114.28 108.62 1vld n THR 828 Ca 0.00 -0.03 -0.48 0.00 -2.04 0.00 0.00 64.05 61.50 1vld n THR 828 Cb 0.00 -1.55 -0.04 0.00 -1.82 0.00 0.00 70.33 66.92 1vld n THR 828 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vld n ALA 829 N 3.27 -0.53 -1.48 2.41 0.00 -1.26 -0.96 120.51 121.95 1vld n ALA 829 Ca 0.16 0.45 -0.17 0.00 0.00 0.00 0.00 53.44 53.89 1vld n ALA 829 Cb 0.29 -2.05 -0.07 0.00 0.00 0.00 0.00 19.45 17.62 1vld n ALA 829 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vld n GLY 830 N 1.97 1.59 0.00 0.00 0.00 -1.26 -4.75 105.19 102.74 1vld n GLY 830 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1vld n GLY 830 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vld n LYS 831 N -1.81 0.00 -3.99 1.61 5.02 -0.13 -4.79 118.16 114.07 1vld n LYS 831 Ca -0.17 -0.49 -0.11 0.00 -2.02 0.00 0.00 58.31 55.53 1vld n LYS 831 Cb 0.63 -0.49 -0.04 0.00 -0.02 0.00 0.00 35.03 35.12 1vld n LYS 831 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1vld s SER 832 N 0.00 0.21 0.46 4.39 1.04 -1.14 -2.98 113.70 115.69 1vld s SER 832 Ca 0.00 -1.11 -0.25 0.00 0.48 0.00 0.00 55.95 55.07 1vld s SER 832 Cb 0.00 0.66 -0.08 0.00 0.10 0.00 0.00 66.02 66.70 1vld s SER 832 CO 0.00 -1.29 1.37 0.00 0.98 0.00 0.00 173.24 174.30 1vld s ALA 833 N -3.45 3.14 0.08 5.32 0.00 -0.64 -4.74 121.76 121.46 1vld s ALA 833 Ca 0.23 1.35 0.04 0.00 0.00 0.00 0.00 51.96 53.58 1vld s ALA 833 Cb -0.02 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 1vld s ALA 833 CO 0.13 -1.11 0.00 0.34 0.00 0.00 0.00 175.76 175.12 1vld s ASP 834 N -0.71 5.06 0.00 0.00 2.15 -1.06 -0.04 116.67 122.07 1vld s ASP 834 Ca 0.62 -0.15 0.02 0.00 0.43 0.00 0.00 52.55 53.47 1vld s ASP 834 Cb -0.41 -1.23 0.01 0.00 -0.30 0.00 0.00 42.92 40.99 1vld s ASP 834 CO 0.51 0.19 0.47 -2.11 -0.17 0.00 0.00 175.17 174.06 1vld n ARG 835 N 0.66 0.42 -0.19 4.34 1.85 -0.38 -0.99 116.66 122.38 1vld n ARG 835 Ca -0.11 -0.50 -0.08 0.00 -1.00 0.00 0.00 57.85 56.16 1vld n ARG 835 Cb 0.52 -0.95 0.02 0.00 -1.05 0.00 0.00 32.46 30.99 1vld n ARG 835 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 1vld h GLY 836 N 0.31 0.86 0.00 2.89 0.00 -1.73 -3.42 103.07 101.97 1vld h GLY 836 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1vld h GLY 836 CO 0.00 0.45 0.00 0.61 0.00 0.00 0.00 176.54 177.60 1vld n GLY 837 N -0.77 1.96 3.36 4.60 0.00 -1.25 -4.38 105.19 108.71 1vld n GLY 837 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1vld n GLY 837 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vld h ILE 839 N 5.31 0.38 0.00 0.00 1.08 -1.88 -0.70 117.51 121.69 1vld h ILE 839 Ca 0.39 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.86 1vld h ILE 839 Cb 0.82 0.61 0.00 0.00 -3.07 0.00 0.00 36.82 35.18 1vld h ILE 839 CO 1.54 0.00 0.00 0.59 -0.69 0.00 0.00 178.15 179.59 1vld n ASN 840 N -3.77 0.00 0.15 1.72 3.02 -1.26 -2.23 115.26 112.89 1vld n ASN 840 Ca 0.09 -0.96 0.02 0.00 -0.03 0.00 0.00 54.58 53.70 1vld n ASN 840 Cb 0.69 0.00 0.20 0.00 -0.61 0.00 0.00 39.78 40.07 1vld n ASN 840 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1vld h ILE 841 N 0.00 1.13 0.00 2.41 2.04 -1.33 -1.13 117.51 120.63 1vld h ILE 841 Ca 0.00 -1.98 -0.20 0.00 1.00 0.00 0.00 64.86 63.68 1vld h ILE 841 Cb 0.00 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 38.19 1vld h ILE 841 CO 0.00 0.52 -1.59 0.18 0.00 0.00 0.00 178.15 177.25 1vld n LEU 842 N -3.55 0.72 -4.74 1.44 4.77 -0.95 -4.26 117.00 110.43 1vld n LEU 842 Ca -0.00 0.32 -0.37 0.00 -0.03 0.00 0.00 56.01 55.93 1vld n LEU 842 Cb 0.61 0.13 0.05 0.00 -2.33 0.00 0.00 43.42 41.89 1vld n LEU 842 CO 0.40 0.21 0.91 0.42 -1.33 0.00 0.00 177.39 178.00 1vld s THR 843 N -2.86 2.18 0.27 -5.08 -4.23 -1.24 -4.84 115.64 99.83 1vld s THR 843 Ca -0.04 0.12 -0.29 0.00 -1.18 0.00 0.00 61.69 60.29 1vld s THR 843 Cb 0.09 -3.05 -0.09 0.00 1.34 0.00 0.00 72.50 70.78 1vld s THR 843 CO 0.82 -0.02 1.15 -2.16 -0.54 0.00 0.00 174.62 173.87 1vld s PRO 844 N -3.25 4.57 0.00 3.99 0.04 -1.26 -1.49 135.00 137.61 1vld s PRO 844 Ca 0.79 1.88 0.24 0.00 0.04 0.00 0.00 61.00 63.94 1vld s PRO 844 Cb -0.37 -3.18 0.18 0.00 0.04 0.00 0.00 34.50 31.17 1vld s PRO 844 CO 0.40 0.10 1.22 -0.40 0.04 0.00 0.00 177.00 178.36 1vld n ASP 845 N 1.40 2.14 -4.73 6.66 3.85 -1.26 -4.48 116.55 120.13 1vld n ASP 845 Ca 0.00 -1.57 -0.42 0.00 -0.71 0.00 0.00 54.79 52.09 1vld n ASP 845 Cb 0.44 0.30 -0.03 0.00 -1.35 0.00 0.00 41.12 40.48 1vld n ASP 845 CO 0.00 0.00 0.00 -0.60 -1.01 0.00 0.00 177.20 175.59 1vld s ARG 846 N -2.34 4.33 0.57 0.11 3.52 -1.26 -4.96 118.95 118.92 1vld s ARG 846 Ca 0.22 2.12 -0.19 0.00 -0.13 0.00 0.00 55.73 57.75 1vld s ARG 846 Cb 0.19 -3.21 -0.06 0.00 -1.56 0.00 0.00 34.95 30.31 1vld s ARG 846 CO 0.49 -0.39 0.96 0.66 -0.81 0.00 0.00 175.30 176.21 1vld n TYR 847 N 3.34 0.86 -0.21 5.12 0.53 -1.26 -4.48 117.16 121.06 1vld n TYR 847 Ca 0.09 0.45 0.29 0.00 -1.02 0.00 0.00 57.90 57.72 1vld n TYR 847 Cb 0.42 -2.15 0.72 0.00 -1.03 0.00 0.00 39.34 37.29 1vld n TYR 847 CO 0.00 0.00 0.00 0.82 -1.02 0.00 0.00 176.86 176.66 1vld h ILE 848 N 0.68 0.53 -3.36 -0.72 2.04 -1.34 -3.43 117.51 111.91 1vld h ILE 848 Ca -0.48 -0.01 -0.11 0.00 1.00 0.00 0.00 64.86 65.26 1vld h ILE 848 Cb 1.36 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 1vld h ILE 848 CO 0.52 0.00 0.14 -0.94 0.00 0.00 0.00 178.15 177.87 1vld s SER 849 N -5.55 0.36 0.24 1.72 1.04 -1.13 -4.94 113.70 105.44 1vld s SER 849 Ca -0.05 -1.32 -0.06 0.00 0.48 0.00 0.00 55.95 55.00 1vld s SER 849 Cb 0.22 0.81 0.24 0.00 0.10 0.00 0.00 66.02 67.39 1vld s SER 849 CO 0.78 -1.61 1.88 0.50 0.98 0.00 0.00 173.24 175.77 1vld h LYS 850 N 2.02 1.26 0.00 4.02 3.64 -1.92 -3.29 116.57 122.31 1vld h LYS 850 Ca -0.32 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1vld h LYS 850 Cb 1.25 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1vld h LYS 850 CO 0.41 0.90 -0.64 0.66 -2.27 0.00 0.00 179.45 178.51 1vld n TYR 851 N -4.34 0.00 -2.85 1.91 4.01 -1.26 -4.80 117.16 109.82 1vld n TYR 851 Ca 0.10 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.41 1vld n TYR 851 Cb 0.08 -0.05 -0.02 0.00 -0.31 0.00 0.00 39.34 39.03 1vld n TYR 851 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1vld s ALA 852 N -1.94 3.28 -1.56 -0.72 0.00 -1.24 -4.65 121.76 114.93 1vld s ALA 852 Ca 0.01 -2.71 -0.11 0.00 0.00 0.00 0.00 51.96 49.15 1vld s ALA 852 Cb 0.05 -4.15 -0.06 0.00 0.00 0.00 0.00 23.12 18.96 1vld s ALA 852 CO 0.31 -3.09 2.75 0.00 0.00 0.00 0.00 175.76 175.72 1vld s GLY 854 N 2.49 2.76 0.05 0.00 0.00 -1.26 -4.89 107.32 106.48 1vld s GLY 854 Ca 0.63 -1.19 -0.16 0.00 0.00 0.00 0.00 44.72 44.00 1vld s GLY 854 CO -0.06 -2.11 0.48 -3.16 0.00 0.00 0.00 173.10 168.24 1vld s MET 855 N -3.81 4.00 -0.29 2.90 0.23 -1.26 -2.35 119.30 118.72 1vld s MET 855 Ca 0.19 0.51 0.08 0.00 -1.03 0.00 0.00 55.69 55.44 1vld s MET 855 Cb 0.05 -3.17 0.46 0.00 -1.53 0.00 0.00 34.83 30.64 1vld s MET 855 CO 0.10 0.64 1.31 0.00 -2.03 0.00 0.00 175.02 175.04 1vld n ALA 856 N 1.57 4.57 -0.29 3.16 0.00 -1.26 -3.87 120.51 124.40 1vld n ALA 856 Ca -0.11 -3.50 0.11 0.00 0.00 0.00 0.00 53.44 49.94 1vld n ALA 856 Cb 0.52 -0.51 0.27 0.00 0.00 0.00 0.00 19.45 19.72 1vld n ALA 856 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1vld h ASN 857 N 1.58 0.04 0.00 0.00 4.21 -1.71 -2.91 115.58 116.79 1vld h ASN 857 Ca 0.25 0.18 0.00 0.00 1.21 0.00 0.00 56.30 57.94 1vld h ASN 857 Cb 1.35 0.24 0.00 0.00 -1.12 0.00 0.00 38.32 38.79 1vld h ASN 857 CO 0.52 -0.11 0.00 0.59 -1.29 0.00 0.00 177.43 177.14 1vld n ASN 858 N -5.19 0.12 -3.61 5.81 3.02 -0.75 -3.98 115.26 110.68 1vld n ASN 858 Ca 0.20 -0.67 -0.29 0.00 -0.03 0.00 0.00 54.58 53.79 1vld n ASN 858 Cb 0.63 -0.06 -0.14 0.00 -0.61 0.00 0.00 39.78 39.60 1vld n ASN 858 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1vld s THR 859 N -1.65 0.50 -0.03 3.41 -4.23 -1.10 -4.48 115.64 108.07 1vld s THR 859 Ca 0.00 -1.46 0.01 0.00 -1.18 0.00 0.00 61.69 59.06 1vld s THR 859 Cb 0.00 -1.38 0.02 0.00 1.34 0.00 0.00 72.50 72.48 1vld s THR 859 CO 0.00 -0.80 -0.02 0.00 -0.54 0.00 0.00 174.62 173.26 1vld s ALA 860 N 1.44 0.43 -0.23 3.99 0.00 -1.02 -4.58 121.76 121.78 1vld s ALA 860 Ca 0.13 0.04 -0.12 0.00 0.00 0.00 0.00 51.96 52.01 1vld s ALA 860 Cb -0.19 -0.31 -0.05 0.00 0.00 0.00 0.00 23.12 22.57 1vld s ALA 860 CO -0.19 -0.02 0.23 -0.51 0.00 0.00 0.00 175.76 175.27 1vld s LEU 861 N 0.78 4.13 0.31 0.00 1.43 -1.26 0.13 118.68 124.20 1vld s LEU 861 Ca -0.09 0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.29 1vld s LEU 861 Cb -0.12 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 1vld s LEU 861 CO -0.01 0.02 0.22 0.68 0.23 0.00 0.00 176.35 177.49 1vld s VAL 862 N 1.14 0.10 -0.01 -1.59 -7.23 -0.48 -4.80 120.40 107.52 1vld s VAL 862 Ca 0.11 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.30 1vld s VAL 862 Cb -0.14 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.31 1vld s VAL 862 CO 0.05 0.00 -0.06 -0.70 -0.31 0.00 0.00 175.10 174.09 1vld s GLU 863 N -3.67 0.56 0.03 4.82 2.56 -0.90 -2.08 118.70 120.02 1vld s GLU 863 Ca 0.38 -0.20 0.08 0.00 0.00 0.00 0.00 54.97 55.23 1vld s GLU 863 Cb 0.04 -0.55 -0.02 0.00 2.00 0.00 0.00 34.13 35.59 1vld s GLU 863 CO 0.22 0.10 -0.24 0.96 -0.56 0.00 0.00 175.26 175.74 1vld s ILE 864 N 0.05 1.91 0.06 -3.70 -4.36 -1.26 -1.99 121.20 111.92 1vld s ILE 864 Ca -0.00 -1.22 -0.09 0.00 -0.26 0.00 0.00 60.65 59.08 1vld s ILE 864 Cb -0.05 -1.62 0.00 0.00 1.25 0.00 0.00 42.46 42.04 1vld s ILE 864 CO -0.00 0.36 0.19 -1.83 0.24 0.00 0.00 174.94 173.90 1vld s GLU 865 N -1.02 0.77 0.25 0.37 -1.05 -0.94 -4.97 118.70 112.11 1vld s GLU 865 Ca 0.10 -0.80 -0.31 0.00 -0.15 0.00 0.00 54.97 53.81 1vld s GLU 865 Cb -0.09 0.32 -0.11 0.00 -0.44 0.00 0.00 34.13 33.80 1vld s GLU 865 CO 0.01 -0.23 1.59 0.15 0.95 0.00 0.00 175.26 177.73 1vld s LYS 866 N -3.24 4.16 -0.01 -4.83 1.02 -1.26 -0.21 119.74 115.37 1vld s LYS 866 Ca 0.00 2.51 -0.30 0.00 0.02 0.00 0.00 55.97 58.20 1vld s LYS 866 Cb 0.02 -3.07 -0.05 0.00 -0.52 0.00 0.00 37.83 34.21 1vld s LYS 866 CO -0.08 -0.62 1.40 -0.46 -0.92 0.00 0.00 175.35 174.67 1vld s TRP 867 N 0.39 2.84 -0.67 3.18 -0.00 0.51 -4.73 118.94 120.46 1vld s TRP 867 Ca 0.66 0.82 0.26 0.00 -0.00 0.00 0.00 56.10 57.84 1vld s TRP 867 Cb -0.47 -3.66 0.78 0.00 -0.00 0.00 0.00 33.47 30.13 1vld s TRP 867 CO 0.42 -2.43 1.76 0.38 -0.00 0.00 0.00 176.95 177.07 1vld h ASP 868 N 7.87 0.00 0.00 5.86 2.03 -1.90 -3.47 116.42 126.81 1vld h ASP 868 Ca -0.37 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 1vld h ASP 868 Cb 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 1vld h ASP 868 CO 0.90 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 179.72 1vld n GLY 869 N 1.15 0.78 3.84 7.15 0.00 -1.26 -5.09 105.19 111.76 1vld n GLY 869 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1vld n GLY 869 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vld s ASP 870 N -2.15 6.43 0.04 1.61 3.68 -1.26 -4.97 116.67 120.04 1vld s ASP 870 Ca 0.00 1.60 0.24 0.00 2.13 0.00 0.00 52.55 56.52 1vld s ASP 870 Cb 0.00 -2.51 0.34 0.00 -1.45 0.00 0.00 42.92 39.30 1vld s ASP 870 CO 0.00 -0.72 1.29 2.29 0.13 0.00 0.00 175.17 178.15 1vld n LYS 871 N -1.79 0.13 -3.66 4.34 2.85 -1.26 -4.98 118.16 113.80 1vld n LYS 871 Ca 0.07 0.02 -0.22 0.00 -1.05 0.00 0.00 58.31 57.13 1vld n LYS 871 Cb 0.54 -1.57 0.01 0.00 -0.65 0.00 0.00 35.03 33.36 1vld n LYS 871 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1vld n TYR 872 N -1.75 -2.17 -2.65 5.58 4.02 -1.26 -1.63 117.16 117.30 1vld n TYR 872 Ca 0.04 0.80 -0.43 0.00 -0.01 0.00 0.00 57.90 58.30 1vld n TYR 872 Cb 0.38 -3.11 0.00 0.00 -0.02 0.00 0.00 39.34 36.60 1vld n TYR 872 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1vld n GLU 873 N -2.79 3.61 -0.41 -0.72 2.13 -1.26 -3.29 120.64 117.90 1vld n GLU 873 Ca -0.22 -3.77 0.07 0.00 0.66 0.00 0.00 57.16 53.90 1vld n GLU 873 Cb 0.64 -2.91 0.13 0.00 0.27 0.00 0.00 31.44 29.57 1vld n GLU 873 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 1vld n ILE 874 N 3.56 1.58 -0.09 6.31 -5.35 -1.18 -4.94 119.36 119.26 1vld n ILE 874 Ca 0.37 -2.17 0.00 0.00 -0.27 0.00 0.00 62.75 60.68 1vld n ILE 874 Cb 0.38 -0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.24 1vld n ILE 874 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57